Profil

Beljonne David

Université de Mons - UMONS > Faculté des Sciences > Service de Chimie des matériaux nouveaux

Université de Mons - UMONS > Faculté de Médecine et de Pharmacie > Chimie générale, organique et biomédicale

Université de Mons - UMONS > Faculté des Sciences > Chimie des matériaux nouveaux


Main Referenced Co-authors
Cornil, Jérôme  (148)
Brédas, Jean-Luc  (129)
LAZZARONI, Roberto  (69)
Olivier, Yoann  (47)
Friend, R.H. (39)
Main Referenced Keywords
Chemistry (all) (10); General Chemistry (10); General Materials Science (8); Materials Chemistry (8); Materials Science (all) (8);
Main Referenced Unit & Research Centers
CIRMAP - Centre d'Innovation et de Recherche en Matériaux Polymères (234)
CRIM - Ingénierie des matériaux (1)
Main Referenced Disciplines
Chemistry (499)
Physics (156)
Materials science & engineering (4)
Biochemistry, biophysics & molecular biology (4)
Biotechnology (2)

Publications (total 611)

The most downloaded
20 downloads
Quarti, C., Marchal, N., & Beljonne, D. (01 January 2018). Tuning the Optoelectronic Properties of Two-Dimensional Hybrid Perovskite Semiconductors with Alkyl Chain Spacers. Journal of Physical Chemistry Letters, 9, 3416-3424. https://hdl.handle.net/20.500.12907/28553
The most cited
2170 citations (Scopus®)
Albota, M., Beljonne, D., Brédas, J.-L., Ehrlich, J. E., Fu, J.-Y., Heikal, A. A., Hess, S., Kogej, T., Levin, M. D., Marder, S. R., McCord-Maughon, D., Perry, J. W., Röckel, H., Rumi, M., Subramaniam, G., Webb, W. W., & Xu, C. (01 January 1998). Design of organic molecules with large two-photon absorption cross sections. Science, 281, 1653-1655. https://hdl.handle.net/20.500.12907/24579

Puozzo, H., SAIEV S., Bonnaud, L., Lazzaroni, R., Beljonne, D., & Raquez, J.-M. (15 November 2022). Tailoring of novel benzoxazine-based thermosetting matrices incorporating carbonaceous particles for innovative broad-range piezoresistive pressure sensors. Poster session presented at BPG annual meeting, Blankenberge, Belgium.

Kress, J. A., Quarti, C., An, Q., Bitton, S., Tessler, N., Beljonne, D., & Vaynzof, Y. (14 October 2022). Persistent Ion Accumulation at Interfaces Improves the Performance of Perovskite Solar Cells. ACS Energy Letters, 7 (10), 3302 - 3310. doi:10.1021/acsenergylett.2c01636
Peer reviewed

Puozzo, H., Saiev S., Bonnaud, L., Lazzaroni, R., Beljonne, D., & Raquez, J.-M. (06 September 2022). Tailoring of novel benzoxazine-based thermosetting matrices incorporating. Poster session presented at Matinée des chercheurs 2022, Mons, Belgium.

Raciti, E.* , Gali, S. M., Melchionna, M., Filippini, G., Actis, A., Chiesa, M., Bevilacqua, M., Fornasiero, P., Prato, M., Beljonne, D., & Lazzaroni, R.*. (31 August 2022). Radical defects modulate the photocatalytic response in 2D-graphitic carbon nitride. Chemical Science, 13 (34), 9927 - 9939. doi:10.1039/d2sc03964h
Peer Reviewed verified by ORBi

Gillett, A. J., Friend, R. H., & Beljonne, D. (23 August 2022). Controlling the Spin Exchange Energy through Charge Transfer for Triplet State Management in Organic Semiconductors. Chemistry of Materials, 34 (16), 7095 - 7105. doi:10.1021/acs.chemmater.2c01301
Peer Reviewed verified by ORBi

Sneyd, A. J., Beljonne, D., & Rao, A. (28 July 2022). A New Frontier in Exciton Transport: Transient Delocalization. Journal of Physical Chemistry Letters, 13 (29), 6820 - 6830. doi:10.1021/acs.jpclett.2c01133
Peer Reviewed verified by ORBi

Yang, L., Ma, J., Zheng, W., Osella, S., Droste, J., Komber, H., Liu, K., Böckmann, S., Beljonne, D., Hansen, M. R., Bonn, M., Wang, H. I., Liu, J., & Feng, X. (July 2022). Solution Synthesis and Characterization of a Long and Curved Graphene Nanoribbon with Hybrid Cove-Armchair-Gulf Edge Structures. Advanced Science, 9 (19), 2200708. doi:10.1002/advs.202200708
Peer reviewed

Jouclas, R., Liu, J., Volpi, M., Silva de Moraes, L., Garbay, G., Mcintosh, N., Bardini, M., Lemaur, V., Vercouter, A., Gatsios, C., Modesti, F., Turetta, N., Beljonne, D., Cornil, J., Kennedy, A. R., Koch, N., Erk, P., Samorì, P., Schweicher, G., & Geerts, Y. H. (July 2022). Dinaphthotetrathienoacenes: Synthesis, Characterization, and Applications in Organic Field-Effect Transistors. Advanced Science, 9 (19), 2105674. doi:10.1002/advs.202105674
Peer reviewed

Puozzo, H., Saiev S., Bonnaud Leila, Lazzaroni, R., Beljonne, D., & Raquez, J.-M. (16 June 2022). Tailoring of novel benzoxazine-based thermosetting matrices incorporating. Poster session presented at Bordeaux Polymer Conference, Bordeaux, France.

Jacobs, I. E., Lin, Y., Huang, Y., Ren, X., Simatos, D., Chen, C., Tjhe, D., Statz, M., Lai, L., Finn, P. A., Neal, W. G., D'Avino, G., Lemaur, V., Fratini, S., Beljonne, D., Strzalka, J., Nielsen, C. B., Barlow, S., Marder, S. R., & Sirringhaus, H. (June 2022). High-Efficiency Ion-Exchange Doping of Conducting Polymers. Advanced Materials, 34 (22), 2102988. doi:10.1002/adma.202102988
Peer Reviewed verified by ORBi

Comin, M., Lemaur, V., Giunchi, A., Beljonne, D., Blase, X., & D’Avino, G. (10 May 2022). Doping of semicrystalline conjugated polymers: dopants within alkyl chains do it better. Journal of Materials Chemistry C, 10 (37), 13815 - 13825. doi:10.1039/d2tc01115h
Peer Reviewed verified by ORBi

Zheng, W., Sun, B., Li, D., Gali, S. M., Zhang, H., Fu, S., Di Virgilio, L., Li, Z., Yang, S., Zhou, S., Beljonne, D., Yu, M., Feng, X., Wang, H. I., & Bonn, M. (May 2022). Band transport by large Fröhlich polarons in MXenes. Nature Physics, 18 (5), 544 - 550. doi:10.1038/s41567-022-01541-y
Peer Reviewed verified by ORBi

Liu, T., Tonnelé, C., Zhao, S., Rondin, L., Elias, C., Medina-Lopez, D., Okuno, H., Narita, A., Chassagneux, Y., Voisin, C., Campidelli, S., Beljonne, D., & Lauret, J.-S. (10 March 2022). Vibronic effect and influence of aggregation on the photophysics of graphene quantum dots. Nanoscale, 14 (10), 3826 - 3833. doi:10.1039/d1nr08279e
Peer Reviewed verified by ORBi

Hao, Y.* , Velpula, G., Kaltenegger, M., Bodlos, W. R., Vibert, F., Mali, K. S., De Feyter, S., Resel, R., Geerts, Y. H., Van Aert, S., Beljonne, D., & Lazzaroni, R.*. (08 March 2022). From 2D to 3D: Bridging Self-Assembled Monolayers to a Substrate-Induced Polymorph in a Molecular Semiconductor. Chemistry of Materials, 34 (5), 2238 - 2248. doi:10.1021/acs.chemmater.1c04038
Peer Reviewed verified by ORBi

Hall, D., Stavrou, K., Duda, E., Danos, A., Bagnich, S., Warriner, S., Slawin, A. M. Z., Beljonne, D., Köhler, A., Monkman, A., Olivier, Y., & Zysman-Colman, E. (07 March 2022). Diindolocarbazole - achieving multiresonant thermally activated delayed fluorescence without the need for acceptor units. Materials Horizons, 9 (3), 1068 - 1080. doi:10.1039/d1mh01383a
Peer Reviewed verified by ORBi

Dilmurat, R., Prodhan, S., Wang, L., & Beljonne, D. (28 February 2022). Thermally activated intra-chain charge transport in high charge-carrier mobility copolymers. Journal of Chemical Physics, 156 (8), 084115. doi:10.1063/5.0082569
Peer Reviewed verified by ORBi

Jacobs, I. E., D'Avino, G., Lemaur, V., Lin, Y., Huang, Y., Chen, C., Harrelson, T. F., Wood, W., Spalek, L. J., Mustafa, T., O'Keefe, C. A., Ren, X., Simatos, D., Tjhe, D., Statz, M., Strzalka, J. W., Lee, J.-K., McCulloch, I., Fratini, S., & Sirringhaus, H. (23 February 2022). Structural and Dynamic Disorder, Not Ionic Trapping, Controls Charge Transport in Highly Doped Conducting Polymers. Journal of the American Chemical Society, 144 (7), 3005 - 3019. doi:10.1021/jacs.1c10651
Peer Reviewed verified by ORBi

Dilmurat, R., Lemaur, V., Olivier, Y., Gali, S. M., & Beljonne, D. (17 February 2022). Tuning Short Contacts between Polymer Chains To Enhance Charge Transport in Amorphous Donor-Acceptor Polymers. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 126 (6), 3118 - 3126. doi:10.1021/acs.jpcc.1c09711
Peer Reviewed verified by ORBi

Meng, G., Liu, L., He, Z., Hall, D., Wang, X., Peng, T., Yin, X., Chen, P., Beljonne, D., Olivier, Y., Zysman-Colman, E., Wang, N., & Wang, S. (09 February 2022). Multi-resonant thermally activated delayed fluorescence emitters based on tetracoordinate boron-containing PAHs: colour tuning based on the nature of chelates. Chemical Science, 13 (6), 1665 - 1674. doi:10.1039/d1sc05692a
Peer Reviewed verified by ORBi

dos Santos, J. M., Sun, D., Moreno-Naranjo, J. M., Hall, D., Zinna, F., Ryan, S. T. J., Shi, W., Matulaitis, T., Cordes, D. B., Slawin, A. M. Z., Beljonne, D., Warriner, S. L., Olivier, Y., Fuchter, M. J., & Zysman-Colman, E. (27 January 2022). An S-shaped double helicene showing both multi-resonance thermally activated delayed fluorescence and circularly polarized luminescence. Journal of Materials Chemistry C, 10 (12), 4861 - 4870. doi:10.1039/d2tc00198e
Peer Reviewed verified by ORBi

Pantaler, M., Diez-Cabanes, V., Queloz, V. I. E., Sutanto, A., Schouwink, P. A., Pastore, M., García-Benito, I., Nazeeruddin, M. K., Beljonne, D., Lupascu, D. C., Quarti, C., & Grancini, G. (24 January 2022). Revealing Weak Dimensional Confinement Effects in Excitonic Silver/Bismuth Double Perovskites. JACS Au, 2 (1), 136 - 149. doi:10.1021/jacsau.1c00429
Peer reviewed

Duda, E., Hall, D., Bagnich, S., Carpenter-Warren, C. L., Saxena, R., Wong, M. Y., Cordes, D. B., Slawin, A. M. Z., Beljonne, D., Olivier, Y., Zysman-Colman, E., & Köhler, A. (20 January 2022). Enhancing Thermally Activated Delayed Fluorescence by Fine-Tuning the Dendron Donor Strength. Journal of Physical Chemistry B, 126 (2), 552 - 562. doi:10.1021/acs.jpcb.1c05749
Peer Reviewed verified by ORBi

Wang, X., Ma, J., Zheng, W., Osella, S., Arisnabarreta, N., Droste, J., Serra, G., Ivasenko, O., Lucotti, A., Beljonne, D., Bonn, M., Liu, X., Hansen, M. R., Tommasini, M., De Feyter, S., Liu, J., Wang, H. I., & Feng, X. (12 January 2022). Cove-Edged Graphene Nanoribbons with Incorporation of Periodic Zigzag-Edge Segments. Journal of the American Chemical Society, 144 (1), 228 - 235. doi:10.1021/jacs.1c09000
Peer Reviewed verified by ORBi

Fijahi, L., Salzillo, T., Tamayo, A., Bardini, M., Ruzié, C., Quarti, C., Beljonne, D., d’Agostino, S., Geerts, Y. H., & Mas-Torrent, M. (2022). Charge transfer complexes of a benzothienobenzothiophene derivative and their implementation as active layer in solution-processed thin film organic field-effect transistors. Journal of Materials Chemistry C, 10 (18), 7319-7328. doi:10.1039/d2tc00655c
Peer Reviewed verified by ORBi

Puozzo, H., Saiev, S., Bonnaud, L., De Winter, J., Lazzaroni, R., & Beljonne, D. (2022). Robust and Direct Route for the Development of Elastomeric Benzoxazine Resins by Copolymerization with Amines. Macromolecules. doi:10.1021/acs.macromol.2c01593
Peer Reviewed verified by ORBi

Oliveira, O. N., Beljonne, D., Wong, S. S., & Schanze, K. S. (17 November 2021). Forum on Artificial Intelligence/Machine Learning for Design and Development of Applied Materials. ACS Applied Materials and Interfaces, 13 (45), 53301 - 53302. doi:10.1021/acsami.1c18225
Peer Reviewed verified by ORBi

Beljonne, D. (01 November 2021). Long-range charge and energy transport in organic semiconductors. Paper presented at Pacifichem 2021, online, Unknown/unspecified.

Beljonne, D. (25 October 2021). EM-TCCM course on Simulation of Materials. Paper presented at IMDEA nanoscience, Madrid, Spain.

Sharma, N., Maciejczyk, M., Hall, D., Li, W., Liégeois, V., Beljonne, D., Olivier, Y., Robertson, N., Samuel, I. D. W., & Zysman-Colman, E. (22 September 2021). Spiro-Based Thermally Activated Delayed Fluorescence Emitters with Reduced Nonradiative Decay for High-Quantum-Efficiency, Low-Roll-Off, Organic Light-Emitting Diodes. ACS Applied Materials and Interfaces, 13 (37), 44628 - 44640. doi:10.1021/acsami.1c12234
Peer Reviewed verified by ORBi

Gillett, A. J., Privitera, A., Dilmurat, R., Karki, A., Qian, D., Pershin, A., Londi, G., Myers, W. K., Lee, J., Yuan, J., Koa, S. J., Riede, M. K., Gao, F., Bazan, G., Rao, A., Nguyen, T. Q., Beljonne, D., & Friend, R. H. (30 August 2021). The Role of Charge Recombination to Triplet Excitons in Organic Solar Cells. Nature, 597, 666-671.
Peer Reviewed verified by ORBi

Prodhan, S., Giannini, S., Wang, L., & Beljonne, D. (13 August 2021). Long-Range Interactions Boost Singlet Exciton Diffusion in Nanofibers of Pi-Extended Polymer Chains. Journal of Physical Chemistry Letters, 12, 8188-8193.
Peer reviewed

Wang, Y., Iglesias, D., Gali, S. M., Beljonne, D., & Samori, P. (09 August 2021). Light-Programmable Logic-In-Memory in 2D Semiconductors Enabled by Supramolecular Functionalization: Photoresponsive Collective Effect of Aligned Molecular Dipoles. ACS Nano, 15, 13732-13741.
Peer Reviewed verified by ORBi

Sneydt, A. J., Fukuin, T., Palecek, D., Prodhan, S., Wagner, I., Zhang, Y., Sung, J., Collins, M. S., Slater, T. J. A., Andaji-Garmaroudi, Z., MacFarlane, L. R., Garcia-Hernandez, J. D., Wang, L., Whittell, G. R., Hodgkiss, J. M., Chen, K., Beljonne, D., Manners, I., Friend, R. H., & Rao, A. (04 August 2021). Efficient Energy Transport in an Organic Semiconductor Mediated by Transient Exciton Delocalization. Science Advances, 7, 4232.
Peer reviewed

Puozzo, H., Bonnaud, L., Beljonne, D., Lazzaroni, R., & Saiev, S. (04 June 2021). Tailoring of novel benzoxazine-based copolymers for highly flexible and stretchable coatings. Poster session presented at 4th international symposium on Polybenzoxazines, Virtual event, Unknown/unspecified.

Xiao, M., Carey, R. L., Chen, H., Jiao, X., Lemaur, V., Schott, S., Beljonne, D., Nikolka, M., Jellett, C., Sadhanala, A., Rogers, S., Senanayak, S. P., Onwubiko, A., Han, S., Zhang, Z., Abdi-Jalebil, M., Zhang, Y., Thomas, T. H., Mahmoudi, N., & Sirringhaus, H. (28 April 2021). Charge Transport Physics of a Unique Class of Right-Rod Conjugated Polymers with Fused-Ring Conjugated Units Linked by Double Carbon-Carbon Bonds. Science Advances, 7, 5280.
Peer reviewed

Quintano, V., Diez-Cabanes, V., Dell'Elce, S., Di Mario, L., Pelli Cresi, S., Paladini, A., Beljonne, D., Liscio, A., & Palermo, V. (22 April 2021). Measurement of Conformational Switching of Azobenzenes from Macro-to Attomolar Scale in Self-Assembled 2D and 3D Nanostructures. Physical Chemistry Chemical Physics, 23, 11698-11708.
Peer Reviewed verified by ORBi

Marques, P. S., Londi, G., Yurash, B., Nguyen, T. Q., Marder, S. R., & Beljonne, D. (15 April 2021). Understanding How Lewis Acids Dope Organic Semiconductors: 'A 'Complex' Story'. Chemical Science, 12, 7012-7022.
Peer Reviewed verified by ORBi

Yao, X., Zheng, W., Osella, S., Qiu, Z., Fu, S., Schollmeyer, D., Beljonne, D., Muller, B., Bonn, M., Wang, H. I., & Mullen, K. (07 April 2021). Synthesis of Nonplanar Graphene Nanoribbon with fjord Edges. Journal of the American Chemical Society, 143, 5654-5658.
Peer Reviewed verified by ORBi

Beljonne, D. (05 April 2021). Singlet fission and triplet pair dissociation in organics. Paper presented at ACS spring meeting 2021, online, Unknown/unspecified.

Puozzo, H., Bonnaud, L., Beljonne, D., Lazzaroni, R., & Saiev, S. (30 March 2021). Development of novel benzoxazine-based resins for broad-range pressure sensing devices. Poster session presented at Mardi des Chercheurs, Virtual Meeting, Unknown/unspecified.

Beljonne, D. (15 March 2021). Manipulating spin and electrostatic effects in organic semiconductors. Paper presented at APS March meeting 2021, online, Unknown/unspecified.

Marchal, N., Mosconi, E., Garcia-Espejo, G., Almutairi, T., Beljonne, D., & Quarti, C. (08 March 2021). Cation Engineering for Resonant Energy Level Alignment in Two-Dimensional Lead Halide Perovskites. Journal of Physical Chemistry Letters, 12, 2528-2535.
Peer reviewed

Privitera, A., Warren, R., Londi, G., Kaienburg, P., Liu, J., Sperlich, A., Lauritzen, A. E., Thimm, O., Ardavan, A., Beljonne, D., & Riede, M. (27 January 2021). Electron Spin as Fingerprint for Charge Generation and Transport in Doped Organic Semiconductors. Journal of Materials Chemistry C, 9, 2944-2954.
Peer reviewed

Tanaka, H., Oda, S., Ricci, G., Gotoh, H., Tabata, K., Kawasumi, R., Beljonne, D., Olivier, Y., & Hatakeyama, T. (01 January 2021). Hypsochromic Shift of Multiple-Resonance-Induced Thermally Activated Delayed Fluorescence by Oxygen Atom Incorporation. Angewandte Chemie International Edition, 60, 17910-17914.
Peer Reviewed verified by ORBi

Hall, D., Rajamalli, P., Duda, E., Rodella, F., Suresh, S. M., Bagnich, S., Carpenter-Warren, C. L., Cordes, D. B., Slawin, A. M. Z., Strohriegel, P., Beljonne, D., Kohler, A., Olivier, Y., & Zysman-Colman, E. (01 January 2021). Substitution Effects on a New Pyridylbenzimidazole Acceptor for Thermally Activated Delayed Fluorescence and Their Use in Organic Light-Emitting Diodes. Advanced Optical Materials, 9, 2100846.
Peer reviewed

Gillett, A. J., Tonnelé, C., Londi, G., Ricci, G., Catherin, M., Unson, D. M. L., Casanova, D., Castet, F., Olivier, Y., Chen, W. M., Zaborova, E., Evans, E. W., Drummond, B. H., Conaghan, P. J., Cui, L. S., Greenham, N. C., Puttisong, Y., Fages, F., Beljonne, D., & Friend, R. H. (01 January 2021). Spontaneous Exciton Dissociation Enables Spin State Interconversion in Delayed Fluorescence Organic Semicondcutors. Nature Communications, 12, 6640.
Peer reviewed

Wang, Y., Wang, H., Gali, S. M., Turetta, N., Yao, Y., Wang, C., Beljonne, D., Chen, Y., & Samori, P. (01 January 2021). Molecular Doping of 2D Indium Selenide for Ultrahigh Performance and Low-Power Consumption Broadband Photodetectors. Advanced Functional Materials, 31, 2103353.
Peer Reviewed verified by ORBi

Beljonne, D., Anderson, M., Ramanan, C., Fontanesi, C., Frick, A., Surana, S., Cheyns, D., Furno, M., Keller, T., Allard, S., Scherf, U., D'Avino, G., Von Hauff, E., & Da Como, E. (01 January 2021). Displacement of Polarons by Vibrational Modes in Doped Conjugated Polymers. Physical Review Materials, 1, 055604.
Peer reviewed

Diez-Cabanes, V., Even, J., Beljonne, D., & Quarti, C. (01 January 2021). Electronic Structure and Optical Properties of Mixed Iodine/Bromine Lead Perovskites. To mix or Not to Mix? Advanced Optical Materials, 9, 2001832.
Peer reviewed

Stoeckel, M.-A., Olivier, Y., Gobbi, M., Dudenko, D., Lemaur, V., Zbiri, M., Guibert, A. A. Y., D'Avino, G., Liscio, F., Migliori, A., Ortolani, L., Demitri, N., Jin, X., Jeong, Y. G., Liscio, A., Nardi, M. V., Pasquali, L., Razzari, L., Beljonne, D., & Orgiu, E. (01 January 2021). Analysis of External and Internal Disorder to Understand Band-Like Transport in n-Type Organic Semiconductors. Advanced Materials, 33, 207870.
Peer reviewed

Wang, H., Wang, Y., Ni, Z., Turetta, N., Gali, S. M., Peng, H., Yao, Y., Chen, Y., Janica, I., Beljonne, D., Hu, W., Ciesielski, A., & Samori, P. (01 January 2021). 2D MXene-Molecular Hybrid Additive for High-Performance Ambipolar Polymer Field-Effect Transistors and Logic Gates. Advanced Materials, 33, 2008215.
Peer reviewed

Baisinger, L., Castan, J. M. A., Marques, P. S., Londi, G., Gohler, C., Deibel, C., Beljonne, D., Cabanetos, C., Blanchard, P., Benduhn, J., & Spoltore, D. (01 January 2021). Reducing Non-Radiative Voltage Losses by Methylation of Push-Pull Molecular Donors in Organic Solar Cells. ChemSusChem, 14, 1-11.
Peer Reviewed verified by ORBi

Fossepre, M., Tuvi-Arad, I., Beljonne, D., Richeter, S., Clément, S., & Surin, M. (02 December 2020). Binding Mode Multiplicity and Multiscale Chirality in the Supramolecular Assembly of DNA and a πConjugated Polymer. Chemphyschem: A European Journal of Chemical Physics and Physical Chemistry, 21 (23), 2543-2552. doi:10.1002/cphc.202000630
Peer Reviewed verified by ORBi

Han, S., Deng, R., Gu, Q., Ni, L., Huynh, U., Zhang, J., Yi, Z., Zhao, B., Kitamura, H., Tamura, H., Pershin, A., Xu, H., Huang, Z., Ahmad, S., Abdi-Jalebi, M., Sadhanala, A., Tang, M. L., Balukin, A., Beljonne, D., & Rao, A. (25 November 2020). Lanthanide-doped Inorganic Nanoparticles Turn Molecular Triplet Excitons Bright. Nature, 587, 594-599.
Peer Reviewed verified by ORBi

Londi, G., Khan, S. U. Z., Muccioli, L., D'Avino, G., Rand, B. P., & Beljonne, D. (13 November 2020). Fate of Low-Lying Charge-Transfer Excited States in a Donor:Acceptor Blend with Large Energy Offset. Journal of Physical Chemistry Letters, 11, 10219-10226.
Peer reviewed

Anichini, C., Aliprandi, A., Gali, S. M., Liscio, F., Minoia, A., Beljonne, D., Ciesielski, A., & Samori, P. (04 September 2020). Ultrafast and Highly Sensitive Chemically Functionalized Graphene Oxide-Based Humidity Sensors: Harnessing Device Performances via the Supramolecular Approach. ACS Applied Materials and Interfaces, 12, 44017-44025.
Peer Reviewed verified by ORBi

Taffet, E. J., Beljonne, D., & Scholes, G. D. (28 August 2020). Overlap-Driven Splitting of Triplet Pairs in Singlet Fission. Journal of the American Chemical Society, 11, 10219-10226.
Peer Reviewed verified by ORBi

Cornil, D., Rivolta, N., Mercier, V., Wiame, H., Beljonne, D., & Cornil, J. (17 August 2020). How to Enhance the Adhesion Energy at Oxide/Ag Interfaces in Low-Emissivity Glasses: A Theoretical Insight into Doping and Vacancy Effects. ACS Applied Materials and Interfaces, 12, 40838-40849.
Peer Reviewed verified by ORBi

Alvertis, A. M., Pandya, R., Beljonne, D., Legrand, L., Barisien, T., Monserrat, B., Musser, A. J., Rao, A., Chin, A. W., & Beljonne, D. (2020). First Principles Modeling of Exciton-Polaritons in Polydiacetylene Chains. Journal of Chemical Physics.
Peer Reviewed verified by ORBi

Niu, W., Ma, J., Soltani, P., Zheng, W., Liu, F., Popov, A. A., Weigand, J. J., Komber, H., Poliani, E., Casiraghi, C., Droste, J., Hansen, M. R., Osella, S., Beljonne, D., Bonn, M., Wang, H. I., Feng, X., & Liu, J. (02 July 2020). A Curved Graphene Nanoribbon with Multi-Edge Structure and High Intrinsic Charge Carrier Mobility. Journal of the American Chemical Society, 142, 18293-18298.
Peer Reviewed verified by ORBi

Prodhan, S., Qiu, J., Ricci, M., Roscioni, O. M., Wang, L., & Beljonne, D. (2020). Design Rules to Maximize Charge-Carrier Mobility along Conjugated Polymer Chains. Journal of Physical Chemistry Letters.
Peer reviewed

Gali, S. M., Pershin, A., Lherbier, A., Charlier, J. C., & Beljonne, D. (18 June 2020). Electronic and Transport Properties in Defective MoS2: Impact of Sulfur Vacancies. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 124, 15076-15084.
Peer Reviewed verified by ORBi

Beljonne, D., Shin, Y., Vranic, S., Just-Baringo, X., Gali, S. M., Kisby, T., Chen, Y., Gkoutzidou, A., Prestat, E., Larrosa, I., Kostarelos, K., & Casiraghi, C. (24 May 2020). Stable, Concentrated, Biocompatible, and Defect-Free Graphene Dispersions with Positive Charge. Nanoscale, 12, 12383-12394.
Peer Reviewed verified by ORBi

Feng, J., Taffet, E. J., Reponen, A. P. M., Romanov, A. S., Olivier, Y., Lemaur, V., Yang, L., Linnolahti, M., Bochmann, M., Beljonne, D., & Credgington, D. (12 May 2020). Carbene-Metal-Amide Polycrystalline Materials Feature Blueshifted Energy yet Unchanged Kinetics of Emission. Chemistry of Materials, 32, 4743-4753.
Peer Reviewed verified by ORBi

Nan, G., Beljonne, D., Zhang, X., & Quarti, C. (30 March 2020). Organic Cations Protect Methyalmmonium Lead Iodid Perovskites against Small Exciton-Polaron Formation. Journal of Physical Chemistry Letters, 11, 2983-2991.
Peer reviewed

Beljonne, D., Tries, A., Osella, S., Zhang, P., Xu, F., Ramanan, C., & Kläui, M. (24 March 2020). Experimental Observation of Strong Exciton Effects in Graphenne Nanoribbons. Nano Letters, 20, 2993-3002.
Peer Reviewed verified by ORBi

Kotova, M. S., Londi, G., Junker, J., Dietz, S., Privitera, A., Tvingstedt, K., Beljonne, D., Sperlich, A., & Dyakonov, V. (06 March 2020). On the absence of Triplet Exciton Loss Pathways in Non-Fullerene Acceptor based Organic Solar Cells. Materials Horizons, 7, 1641-1649.
Peer reviewed

Suresh, S. M., Duda, E., Hall, D., Yao, Z., Bagnich, S., Slawin, A. M. Z., Bässler, H., Beljonne, D., Buck, M., Olivier, Y., Köhler, A., & Zysman-Colman, E. (05 March 2020). A Deep Blue B, N-Doped Heptacene Emitter That Shows Both Thermally Activated Delayed Fluorescence and Delayed Fluorescence by Triplet-Triplet Annihilation. Journal of the American Chemical Society, 142, 6588-6599.
Peer Reviewed verified by ORBi

Beljonne, D. (28 February 2020). Electronic and excitonic processes in organic conjugated materials. Modelling insights. Paper presented at Invited Lecture, Valencia, Spain.

Feldmann, S., Macpherson, S., Senanayak, S. P., Abdi-Jalebi, M., Rivett, J. P. H., Nan, G., Tainter, G. D., Doherty, T. A. S., Frohna, K., Ringe, E., Friend, R. H., Sirringhaus, H., Saliba, M., Beljonne, D., Stranks, S. D., & Deschler, F. (01 February 2020). Photodoping Through Local Charge Carrier Accumulation in Alloyed Hybrid Perovskites for Highly Efficient Luminescence. Nature Photonics, 14, 123-128.
Peer Reviewed verified by ORBi

Taffet, E. J., Fassioli, F., Toa, Z. S. D., Beljonne, D., & Scholes, G. D. (28 January 2020). Uncovering Dark Multichromophoric States in Peridinin-Chlorophyll-Protein. Journal of the Royal Society, Interface, 17, 20190736.
Peer Reviewed verified by ORBi

Sharma, N., Wong, M. Y., Hall, D., Spuling, E., Tenopala-Carmona, F., Privitera, A., Copley, G., Cordes, D. B., Slawin, A. M. Z., Murawski, C., Gather, M. C., Beljonne, D., Olivier, Y., Samuel, I. D. W., & Zysmann-Colman, E. (27 January 2020). Exciton Efficiency Beyond the Spin Statistical Limit in Organic Light Emitting Diodes Based on Anthracene Derivatives. Journal of Materials Chemistry C, 8, 3773-3783.
Peer reviewed

D'Avino, G., Duhm, S., Guido Della Valle, R., Heimel, G., Oehzelt, M., Kera, S., Ueno, N., Beljonne, D., & Salzmann, I. (15 January 2020). Electrostatic Interactions Shape Molecular Organization and Electronic Structure of Organic Semiconductor Blends. Chemistry of Materials, 32, 1261-1271.
Peer Reviewed verified by ORBi

Chevrier, M., Fattori, A., Lasser, L., Kotras, C., Rose, C., Cangiotti, M., Beljonne, D., Ahmad, M., Surin, M., Lazzaroni, R., Dubois, P., Ottaviani, M., Richeter, S., Bouclé, J., & Clément, S. (02 January 2020). In Depth Analysis of Photovoltaic Performance of Chlorophyll Derivative-Based 'All Solid-State' Dye-Sensitized Solar Cells. Molecules, 25 (198), 1-20. doi:10.3390/molecules25010198
Peer reviewed

Privitera, A., Londi, G., Riede, M., D'Avino, G., & Beljonne, D. (2020). Molecular Quadrupole Moments Promote Ground-State Charge Generation in Doped Organic Semiconductors. Advanced Functional Materials.
Peer Reviewed verified by ORBi

Hall, D., Suresh, S. M., Dos Santos, P. L., Duda, E., Bagnich, S., Pershin, A., Rajamalli, P., Cordes, D. B., Slawin, A. M. Z., Beljonne, D., Samuel, I. D. W., Olivier, Y., & Zysman-Colman, E. (01 January 2020). Improving Processability and Efficiency of Resonant TADF Emitters: A Design Strategy. Advanced Optical Materials, 8, 1901627.
Peer reviewed

Queloz, V. I. E., Bouduban, M. E. F., Garcia-Benito, I., Fedorovskiy, A., Orlandi, S., Cavazzini, M., Pozzi, G., Trivedi, H., Lupascu, D. C., Beljonne, D., Moser, J. E., Nazeeruddin, M. K., Quarti, C., & Grancini, G. (2020). Spatial Charge Separation as the Origin of AnomalousStark Effect in Fluorous 2D Hybrid Perovskites. Advanced Functional Materials.
Peer Reviewed verified by ORBi

Wang, Y., Gali, S. M., Beljonne, D., Slassi, A., & Samori, P. (01 January 2020). Collective Dipole-Dominated Doping of Monolayer MoS2: Orientation and Magnitude Control via the Supramolecular Approach. Advanced Functional Materials, 30, 2002846.
Peer Reviewed verified by ORBi

Nishimura, N., Gray, V., Allardice, J. R., Zhang, Z., Pershin, A., Beljonne, D., & Rao, A. (01 January 2020). Photon Upconversion from Near-Infrared to Blue Light with TIPS-Anthracene as an Efficient Triplet-Triplet Annihilator. ACS Materials Letters, 6, 660-664.
Peer reviewed

Cornil, D., Rivolta, N., Mercier, V., Wiame, H., Beljonne, D., & Cornil, J. (01 January 2020). How to Enhance the Adhesion Energy at Oxide/Ag Interfaces in Low-Emissivity Glasses: A Theoretical Insight into Doping and Vacancy Effects. ACS Applied Materials and Interfaces, 12, 40838-40849.
Peer Reviewed verified by ORBi

Dong, Y., Nikolis, V. C., Talnack, F., Chin, Y. C., Benduhn, J., Londi, G., Kublitski, J., Zheng, X., Mannsfeld, S. C. B., Spoltore, D., Muccioli, L., Li, J., Blase, X., Beljonne, D., Bakulin, A. A., D'Avino, G., Durrant, J. R., & Vandewal, K. (01 January 2020). Orientation Dependent Molecular Electrostatics Drives Efficient Charge Generation in Homojunction Organic Solar Cells. Nature Communications, 11, 4617.
Peer reviewed

Knöller, J. A., Meng, G., Wang, X., Hall, D., Beljonne, D., Olivier, Y., Laschat, S., Zysman-Colman, E., & WANG, S. (01 January 2020). Intramolecular Borylation via Sequential B-Mes Bond Cleavage for the Divergent Synthesis of B, B-Doped Bnezol (4) helicenes. Angewandte Chemie International Edition, 59, 3156-3160.
Peer Reviewed verified by ORBi

Marques, P. S., Castan, J. M. A., Raul, B. A. L., Londi, G., Ramirez, I., Pshenichnikov, M. S., Walzer, K., Blais, M., Beljonne, D., Allain, M., & Calbanetos, C. (01 January 2020). Triphenylamine/Tetracyanobutadiene-Based Pi-Conjugated Push-Pull Molecules End-Capped with Arene Platforms: Synthesis, Photophysics, and Photovoltaic Response. Chemistry, 26, 16422-16433.
Peer Reviewed verified by ORBi

Slassi, A., Gali, S. M., Pershin, A., Gali, A., Cornil, J., & Beljonne, D. (01 January 2020). Interlayer Bonding in Two-Dimensional Materials: The Special Case of SnP3 and GeP3. Journal of Physical Chemistry Letters, 11, 4503-4510.
Peer reviewed

Tian, J., Cordes, D. B., Quarti, C., Beljonne, D., Slawin, A. M. Z., Zysman-Colman, E., & Morrison, F. D. (21 November 2019). Stable 6H Organic-Inorganic Hybrid Lead Perovskite and Competitive Formation of 6H and 3C Perovskite Structure with Mixed A Cations. ACS Applied Energy Materials, 2, 5427-5437.
Peer reviewed

Kim, V. O., Broch, K., Belova, V., Chen, Y. S., Gerlach, A., Schreiber, F., Tamura, H., Guido Della Valle, R., D'Avino, G., Salzmann, I., Beljonne, D., Rao, A., & Friend, R. H. (30 October 2019). Singlet Exciton Fission via an intermolecular charge transfer state in coevaporated pentacene-perfluoropentacene thin films. Journal of Chemical Physics, 151, 164706.
Peer Reviewed verified by ORBi

Fossepre, M., Trévisan, M. E., Rubio Magnieto, J., Tuvi-Arad, I., Beljonne, D., & Surin, M. (29 October 2019). Multiscale chirality and symmetry in the supramolecular self-assembly of DNA with a π-conjugated polymer. Poster session presented at ISNAC 2019: Annual Meeting of Japan Society of Nucleic Acid Chemistry, Tokyo , Japan.

Londi, G., Dilmurat, R., D'Avino, G., Lemaur, V., Olivier, Y., & Beljonne, D. (29 October 2019). Comprehensive Modelling Study of Singler Exciton Diffusion into Donor-Acceptor Dyads: When Small Changes in Chemical Structure Matter. Physical Chemistry Chemical Physics, 21, 25023-25034.
Peer Reviewed verified by ORBi

Fossepre, M., Trevisan, M., Cyriaque, V., Wattiez, R., Beljonne, D., Richeter, S., Clément, S., & Surin, M. (19 October 2019). Detection of the Enzymatic Cleavage of DNA through Supramolecular Chiral Induction to a Cationic Polythiophene. ACS Applied Bio Materials, 2, 2125-2136.
Peer reviewed

Li, J., Duchemin, I., Roscioni, O. M., Friederich, P., Anderson, M., Da Como, E., Kociok-Kohn, G., Wenzel, W., Zannoni, C., Beljonne, D., Blase, X., & D'Avino, G. (07 September 2019). Hosts Dependence of the Electron Affinity of Molecular Dopants. Materials Horizons, 6, 107-114.
Peer reviewed

Saiev, S., Bonnaud, L., Zuniga, C., Dubois, P., Beljonne, D., Ronda, J. C., Cadiz, V., & Lazzaroni, R. (07 September 2019). Positive effect of functional side groups on the structure and properties of benzoxazine networks and nanocomposites. Polymer Chemistry, 10, 5251-5264.
Peer Reviewed verified by ORBi

Park, K. S., Kwok, J. J., Dilmurat, R., Qu, G., Kafle, P., Luo, X., Jung, S. H., Olivier, Y., Lee, J. K., Mei, J., Diao, Y., & Beljonne, D. (09 August 2019). Tuning Conformation, Assembly, and Charge Transport Properties of Conjugated Polymers by Printing Flow. Science Advances, 5, 7757.
Peer reviewed

Marchal, N., Van Gompel, W., Gelvez-Rueda, M. C., Vandewal, K., Van Hecke, K., Boyen, H.-G., Conings, B., Herckens, R., Maheshwari, S., Lutsen, L., Quarti, C., Grozema, F. C., Vanderzande, D., & Beljonne, D. (01 August 2019). Lead-Halide Perovskites Meet Donor-Acceptor Charge-Transfer Complexes. Chemistry of Materials, 31, 6880-6888. doi:10.1088/1748-0221/5/03/T03001
Peer Reviewed verified by ORBi

Schott, S., Chopra, U., Lemaur, V., Melnyk, A., Olivier, Y., Di Pietro, R., Romanov, I., Carey, R. L., Jiao, X., Jellett, C., Little, M., Marks, A., Mc Neill, C. R., Mc Culloch, I., Nc Nellis, E. R., Beljonne, D., Sinova, J., & Sirringhaus, H. (01 August 2019). Polaron Spin Dynamics in High-Mobility Polymeric Semiconductors. Nature Physics, 15, 814-822.
Peer Reviewed verified by ORBi

Alloa, E., Grande, V., Dilmurat, R., Beljonne, D., Wurthner, F., & Hayes, S. C. (31 July 2019). Resonance Raman Study of the J-Type Aggregation Process of a Water Soluble Perylene Bisimide. Physical Chemistry Chemical Physics, 21, 18300-18309.
Peer Reviewed verified by ORBi

Huaulmé, Q., Aumaitre, C., Kontkanen, O. V., Beljonne, D., Sutter, A., Ulrich, G., Demadrille, R., & Leclerc, N. (24 July 2019). Functional Panchromatic BODIPY Dyes with near-infrared absorption: design, synthesis, characterization, and use in Dye-Sensitized Solar Cells. Belstein Journal of Organic Chemistry, 15, 1758-1768.
Peer reviewed

Fossepre, M., Trévisan, M. E., Rubio Magnieto, J., Tuvi-Arad, I., Beljonne, D., & Surin, M. (14 July 2019). Multiscale chirality and symmetry in the supramolecular self-assembly of DNA with a π-conjugated polymer. Poster session presented at 31th International Symposium on Chirality - CHIRALITY 2019, Bordeaux , France.

Thomas, T. H., Harkin, D. J., Gillett, A. J., Lemaur, V., Nikolka, M., Sadhanala, A., Richter, J. M., Armitage, J., Chen, H., McCulloch, I., Menke, S. M., Olivier, Y., Beljonne, D., & Sirringhaus, H. (2019). Short Contacts Between Chains Enhancing Luminescence Quantum Yields and Carrier Mobilities in Conjugated Copolymers. Nature Communications.
Peer reviewed

Yurash, B., Nakanotani, H., Olivier, Y., Beljonne, D., Adachi, C., & Nguyen, T. Q. (28 June 2019). Photoluminescence Quenching Probes Spin Conversion and Exciton Dynamics in Thermally Activated Delayed Fluorescence Materials. Advanced Materials, 31, 1804490.
Peer reviewed

Gali, S. M., Quarti, C., Olivier, Y., Cornil, J., Truflandrier, L., Castet, F., Muccioli, L., & Beljonne, D. (28 June 2019). Impact of Structural Anisotropy on Electro-Mechanical Response in Crystalline Organic Semiconductors. Journal of Materials Chemistry C, 7, 4382-4391.
Peer reviewed

Pershin, A., Hall, D., Lemaur, V., Sancho Garcia, J. C., Muccioli, L., Zysman-Colman, E., Beljonne, D., & Olivier, Y. (27 June 2019). Highly Emissive Excitons with Reduced Exchange Energy in Thermally Activated Delayed Fluorescence Molecules. Nature Communications, 10, 597.
Peer reviewed

Beljonne, D. (24 June 2019). Contemplating 30 years of modeling reserach in organic electronics: from conjugated polymers to hybrid organic-inorganic lead halide perovskites. Paper presented at 15th international conference on organic electronics, Hasselt, Belgium.

Beljonne, D. (22 June 2019). Modeling the energetics of charge carriers in organic semiconductors: DFT and beyond. Paper presented at 18th International Conference on Density Functional Theory and its Applications, Alicante, Spain.

Khan, S. U. Z., Londi, G., Liu, X., Fusella, M. A., D'Avino, G., Muccioli, L., Brigeman, A. N., Niesen, B., Yang, T. C. J., Olivier, Y., Dull, J. T., Giebnik, N. C., Beljonne, D., & Rand, B. P. (18 June 2019). Multiple Charge Transfer States in donor-acceptor heterojunctions with large frontier orbital energy offsets. Chemistry of Materials, 31, 6808-6817.
Peer Reviewed verified by ORBi

Lemaur, V., Cornil, J., Lazzaroni, R., Sirringhaus, H., Beljonne, D., & Olivier, Y. (2019). Resilience to Conformational Fluctuations Controls Energetic Disorder in Conjugated Polymer Materials: Insights from Atomistic Simulations. Chemistry of Materials.
Peer Reviewed verified by ORBi

Beljonne, D. (02 June 2019). Modeling charge and spin transport in conjugated polymers. Paper presented at 14th international symposium on functional pi-electron systems, Berlin, Germany.

Beljonne, D. (22 May 2019). Energetics of charge carriers in organic semiconductors, implications for optoelectronics. Paper presented at International symposium on design of organic optoelectronic materials, Beijing, China.

Idé, J., Cornil, D., Amaury, J., Benjamine, N., Boulanger, P., Ventelon, L., Lazzaroni, R., Beljonne, D., & Cornil, J. (16 May 2019). Glass Hardness Modification by Means of Ion Implantation: Electronic Doping versus Surface Composition Effect. Advanced Theory and Simulations, 2019, 1900039. doi:10.1002/adts.201900039
Peer reviewed

Osella, S., Minoia, A., Quarti, C., Cornil, J., Lazzaroni, R., Goffin, A.-L., Guillaume, M., & Beljonne, D. (16 May 2019). Modelling Coupled Ion Motion in Electrolyte Solutions for Lithium-Sulfur Batteries. Batteries and Supercaps, 2, 473 - 481. doi:10.1002/batt.201800150
Peer reviewed

Beljonne, D. (07 May 2019). Energetics of charge carriers in organic semiconductors, implications for optoelectronics. Paper presented at Physics Colloquium Dresden, Dresden, Germany.

Pont, S., Osella, S., Smith, A., Marsh, A. V., Li, Z., Beljonne, D., Cabral, J. T., & Durrant, J. R. (03 May 2019). Evidence for Strong and Weak Phenyl-C61-Butyric Acid Methyl Ester Photodimer Populations in Organic Solar Cells. Chemistry of Materials, 31, 6076-6083.
Peer Reviewed verified by ORBi

Tonnelé, C., Pershin, A., Gali, S. M., Lherbier, A., Charlier, J. C., Castet, F., Muccioli, L., & Beljonne, D. (26 April 2019). Atomistic Simulations of Charge Transport in Photoswitchable Organic-Graphene Hybrids. JPhys Materials, 2, 035001.
Peer reviewed

Fossépré, M., Trévisan, M. E., Cyriaque, V., Wattiez, R., Beljonne, D., Richeter, S., Clément, S., & Surin, M. (01 April 2019). Detection of the Enzymatic Cleavage of DNA through Supramolecular Chiral Induction to a Cationic Polythiophene. American Chemical Society Applied Bio Materials, 2, 2125-2136.
Peer reviewed

Beljonne, D. (17 March 2019). A microscopic view on electronic and excitonic effects in hybrid organic semiconductors. Paper presented at Advances in Organic and Hybrid Electronic Materials, Dubrovnik, Croatia.

Velpula, G., Phillipson, R., Lian, J. X., Cornil, D., Walker, P., Verguts, K., Brems, S., Uji-i, H., De Gendt, S., Beljonne, D., Lazzaroni, R., Mali, K. S., & De Feyter, S. (04 March 2019). Graphene Meets Ionic Liquids: Fermi Level Engineering via Electrostatic Forces. ACS Nano, 13, 3512-3521.
Peer Reviewed verified by ORBi

Fossepre, M., Trévisan, M. E., Rubio Magnieto, J., Beljonne, D., & Surin, M. (02 March 2019). Dynamics and induced chirality in the self-assembly of DNA with a π-conjugated polymer. Poster session presented at Annual Meeting of the Biophysical Society (BPS19), Baltimore, United States - Maryland.

Fossepre, M., Trévisan, M. E., Rubio Magnieto, J., Beljonne, D., & Surin, M. (04 February 2019). Dynamics and induced chirality in the self-assembly of DNA with a π-conjugated polymer. Poster session presented at CECAM workshop - Multiscale Modeling from Macromolecules to Cell: Opportunities and Challenges of Biomolecular Simulations, Lausanne, Switzerland.

Lemaur, V., Cornil, J., Lazzaroni, R., Beljonne, D., & Olivier, Y. (2019). Resilience to Conformational Fluctuations Controls Energetic Disorder in Conjugated Polymer Materials: Insights from Atomistic Simulations. Chemistry of Materials.
Peer Reviewed verified by ORBi

Beljonne, D., Thomas, T. H., Harkin, D. J., Gillett, A. J., Lemaur, V., Nikolka, M., Sadhanala, A., Richter, J. M., Armitage, J., Chen, H., & McCulloch, I. (2019). Short contacts Between Chains Enhancing Luminescence Quantum Yields and Carrier Mobilitiesin Conjugated Copolymers. Nature Communications.
Peer reviewed

Zhang, F., Lemaur, V., Choi, W., Kafle, P., Seki, S., Cornil, J., Beljonne, D., & Diao, Y. (2019). Repurposing DNA Binding Agents as H-Bonded Organic Semiconductors. Nature Communications.
Peer reviewed

Yurash, B., Nakanotani, H., Olivier, Y., Beljonne, D., Adachi, C., & Nguyen, T. Q. (01 January 2019). Photoluminiescence Quenching Probes Spin Conversion and Exciton Dynamics in Thermally Activated Delayed Fluorescence Materials. Advanced Materials, 31, 1804490.
Peer reviewed

Wang, Y., Slassi, A., Cornil, J., Beljonne, D., & Samori, P. (01 January 2019). Tuning the Optical and Electrical Properties of Few-Layer Black Phosphorus via Physisorption of Small Solvent Molecules. Small: Nano Micro, 5, 1903432.
Peer Reviewed verified by ORBi

Wang, Y., Slassi, A., Stoeckel, M.-A., Bertolazzi, S., Cornil, J., Beljonne, D., & Samori, P. (01 January 2019). Doping of Monolayer Transition Metal Dichalcogenies via Physisorption of Aromatic Solvent Molecules. Journal of Physical Chemistry Letters, 10, 540-547.
Peer reviewed

Labrunie, A., Londi, G., Daneyko, S. V., Blais, M., Dabos-Seignon, S., Welch, G. C., Beljonne, D., Blanchard, P., & Cabanetos, C. (01 January 2019). A triazatruxene-Based Molecular Dyad for Single-Component Organic Solar Cells. Chemistry squared, 2, 4.
Peer reviewed

Thouin, F., Valverde-Chavez, D. A., Quarti, C., Beljonne, D., Cortecchia, D., Bargigia, I., Petrozza, A., Silva, C., & Kandada, A. R. S. (01 January 2019). Phonon Coherences Reveal the Olaronic Character of excitons in Two-Dimensional Lead-Halide Perovskites. Nature Materials, 18, 349-356.
Peer Reviewed verified by ORBi

Chung, H., Dudenko, D., Zhang, F., D'Avino, G., Beljonne, D., Ruzié, C., Richard, A., Schweicher, G., & Cornil, J. (01 December 2018). Rotator Side Chains Trigger Coopertaive Transition for Shape and Function Memory Effect in Organic Semiconductors. Nature Communications, 9, 278.
Peer reviewed

Garcia-Benito, I., Quarti, C., Queloz, V. I. E., Orlandi, S., Zimmerman, I., Cavazzini, M., Lesch, A., Marras, S., Beljonne, D., Pozzi, G., Nazeeruddin, M. K., & Grancini, G. (24 October 2018). Fashioning Fluorous Organic Spacers for Tunable and Stable Kayered Hybrid Perovskites. Chemistry of Materials, 30, 8211-8220.
Peer Reviewed verified by ORBi

Marchal, N., Quarti, C., & Beljonne, D. (22 October 2018). Effect of electronically inert organic spacers on the optoelctronic properties of 2D hybrid perovskites. Paper presented at NanoGe Fall Meeting, Symposium 'Modeling Perovskite Solar Cells Microscale to Macroscale', Torremolinos, Spain.

Olivier, Y., Sancho Garcia, J. C., Muccioli, L., D'Avino, G., & Beljonne, D. (28 September 2018). Computational Design of Thermally Activated Delayed Fluorescence Materials: The Challenge Ahead. Journal of Physical Chemistry Letters, 9, 6149-6163.
Peer reviewed

Saeiv, S., Bonnaud, L., Dumas, L., Zhang, T., Dubois, P., Beljonne, D., & Lazzaroni, R. (27 September 2018). Modeling polymer nanocomposites of bio-sourced thermoset resins and carbon nanotubes. Paper presented at International conference on thermosets : thermosetting resins 2018, Berlin, Germany.

Wong, M. Y., Krotkus, S., Copley, G., Li, W., Murawski, C., Hall, D., Hedley, G. J., Jaricot, M., Cordes, D. B., Slawin, A. M. Z., Olivier, Y., Beljonne, D., Muccioli, L., Moral, M., Gather, M. C., Samuel, I. D. W., & Zysman-Colman, E. (07 September 2018). Deep-Blue Oxadizaole-Containing Thermally Activated Delayed Fluorescence Emitters for Organic Light-Emitting Diodes. ACS Applied Materials and Interfaces, 10, 33360-33372.
Peer Reviewed verified by ORBi

Beljonne, D. (22 July 2018). Charge transport in carbon-based materials: A microscopic view. Paper presented at Gordon Research Conference 'Electronic processes in organic, July 22-27, Lucca, Italy.

Saiev, S., Bonnaud, L., Dumas, L., Zhang, T., Dubois, P., Beljonne, D., & Lazzaroni, R. (20 July 2018). Do carbon nanotubes improve the thermomechanical properties of benzoxazine thermosets. ACS Applied Materials and Interfaces, 10, 26669-26677.
Peer Reviewed verified by ORBi

Marchal, N., Quarti, C., Beljonne, D., & Lazzaroni, R. (03 July 2018). Lanthanide titanates : A new family of oxide materials for photovoltaic application. Poster session presented at Worshop of the Materials Institute, Mons, Belgium.

Beljonne, D. (18 June 2018). Bulk and Interfacial Electrostatic effects in semiconductors: from molecular crystals to hybrid lead-halide perovskites. Paper presented at International Conference on Organic Electronics, June 18-22, Bordeaux, France.

Quarti, C., Harwell, J., Prezhdo, O. V., Beljonne, D., & Samuel, I. D. W. (25 May 2018). Hot-Hole Cooling Controls the Initial Ultrafast Relaxation in Methylammonium Lead Iodide Perovskite. Scientific Reports, 8, 8115.
Peer reviewed

Beljonne, D. (22 April 2018). How microstructure defines functions in organic electronics: Modeling insights. Paper presented at Spie Photonics Europe April 22-26, Strasbourg, France.

Marchal, N., Quarti, C., Beljonne, D., & Lazzaroni, R. (16 April 2018). Lanthanide titanates : A new family of oxide materials for photovoltaic application. Poster session presented at Excitonics thematic school, Les Houches, Unknown/unspecified.

Li, J., D'Avino, G., Duchemin, I., Beljonne, D., & Blase, X. (2018). Accurate Description of Charged Excitations in Molecular Solids from Embedded Many-Body Perturbation Theory. Physical Review. B.
Peer Reviewed verified by ORBi

Vercouter, A., Lemaur, V., Idé, J., Muccioli, L., Beljonne, D., & Cornil, J. (2018). Modélisation Théorique de la Conductivité Thermique de Réseau de Semiconducteurs Organiques. Chimie Nouvelle.

Gobbi, M., Bonacchi, S., Lian, J. X., Vercouter, A., Bertolazzi, S., Zyska, B., Timpel, M., Tatti, R., Olivier, Y., Hecht, S., Nardi, M. V., Beljonne, D., Orgiu, E., & Samori, P. (01 January 2018). Collective Molecular Switching in Hybrid Superlattices for Light-Modulated Two-Dimensional Electronics. Nature Communications, 9, 2661.
Peer reviewed

Beljonne, D. (01 January 2018). Correlated Electron-Hole Mechanism for Molecular Doping in Organic Semiconductors. Physical Review Materials, 1, 025602.
Peer reviewed

Nan, G., Zhang, X., Abdi-Jalebi, M., Andaji-Garmaroudi, Z., Stranks, S. D., Lu, G., & Beljonne, D. (01 January 2018). How Methylammonium cations and Chlorine Dopants Heal Defects in Lead Iodide Perovskites. Advanced Energy Materials, 8, 1702754.
Peer Reviewed verified by ORBi

He, T., Wu, Y., D'Avino, G., Schmidt, E., Stolte, M., Cornil, J., Beljonne, D., Ruden, P. P., Wurthner, F., & Frisbie, D. (01 January 2018). Crystal Step Edges can Trap Electrons on the Surfaces of N-Type Organic Semiconductors. Nature Communications, 9, 2141.
Peer reviewed

Chung, H., Dudenko, D., Zhang, F., D'Avino, G., Ruzié, C., Richard, A., Schweicher, G., Cornil, J., Beljonne, D., Geerts, Y., & Diao, Y. (2018). 'Rotator Side Chains Trigger Cooperative Transition for Shape and Function Memory Effect in Organic Semiconductors'. Nature Communications.
Peer reviewed

Bendhun, J., Piersimoni, F., Londi, G., Kirch, A., Widmer, J., Koerner, C., Beljonne, D., Neher, D., Spoltore, D., & Vandewal, K. (01 January 2018). Impact of Triplet Excited States on the Open-Circuit Voltage of Organic Solar Cells. Advanced Energy Materials, 8, 1800451.
Peer Reviewed verified by ORBi

Beljonne, D., Broch, K., Dieterle, J., Branchi, F., Hestand, N. J., Olivier, Y., Tamura, H., Cruz, C., Nichols, V. M., & Hinderhofer, A. (2018). Robust Singlet Fission in Pentacene Thin Films with Tuned Charge Transfer Interacations. Nature Communications.
Peer reviewed

Evans, E. W., Olivier, Y., Puttisong, Y., Myers, W. K., Hele, T. J. H., Menke, S. M., Thomas, T. H., Credgington, D., Beljonne, D., Friend, R. H., & Greenham, N. C. (2018). Vibrationally Assisted Intersystem Crossing in Benchmark Thermally Activated Delayed Fluorescence Molecules. Journal of Physical Chemistry Letters.
Peer reviewed

Saiev, S., Bonnaud, L., Dubois, P., Beljonne, D., & Lazzaroni, R. (2018). Modeling the Formation and Thermomechanical Properties of Polybenzoxazine Thermosets. Polymer Chemistry.
Peer Reviewed verified by ORBi

Quarti, C., Marchal, N., & Beljonne, D. (01 January 2018). Tuning the Optoelectronic Properties of Two-Dimensional Hybrid Perovskite Semiconductors with Alkyl Chain Spacers. Journal of Physical Chemistry Letters, 9, 3416-3424.
Peer reviewed

Broch, K., Dieterle, J., Branchi, F., Hestand, N. J., Olivier, Y., Tamura, H., Cruz, C., Nichols, V. M., Hinderhofer, A., Beljonne, D., Spano, F. C., Cerullo, G., Bardeen, C. J., & Schreiber, F. (01 January 2018). Robust Singlet Fission in Pentacene Thin Films with Tuned Charge Transfer Interacations. Nature Communications, 9, 954.
Peer reviewed

Luponosov, Y. N., Solodukhin, A. N., Kozlov, O. V., Flament, B., Douhéret, O., Viville, P., Beljonne, D., Lazzaroni, R., Cornil, J., Pshenichnikov, M. S., & Ponomarenko, S. A. (01 January 2018). Simple Donor-Acceptor Molecule with Long Exciton Diffusion Length for Organic Photovoltaics. Organic Electronics, 53, 185-190.
Peer Reviewed verified by ORBi

Broch, K., Venkateshvaran, D., Lemaur, V., Olivier, Y., Beljonne, D., Zelazny, M., Nasrallah, I., Harkin, D. J., Statz, M., Di Pietro, R., Kronemeijer, A. J., & Sirringhaus, H. (01 January 2018). Measurements of Ambipolar Seebeck Coefficients in High-Mobility Diketopyrrolopyrrole Donor-Acceptor Copolymers. Advanced Electronic Materials, 3, 1700225.
Peer reviewed

Taffet, E. J., Olivier, Y., Lam, F., Beljonne, D., & Scholes, G. D. (01 January 2018). Carbene-Metal-Amide Bond Deformation, Rather Than Ligand Rotation, Drives Delayed Fluorescence. Journal of Physical Chemistry Letters, 9, 1620-1626.
Peer reviewed

Olivier, Y., Yurash, B., Muccioli, L., D'Avino, G., Mikhnendo, O., Sancho-Garcia, J. C., Adachi, C., Nguyen, T. Q., & Beljonne, D. (27 December 2017). Nature of the Singlet and Triplet Excitations Mediating Thermally Activated Delayed Fluorescence. Physical Review Materials, 1 (075602). doi:10.1103/PhysRevMaterials.1.075602
Peer reviewed

Booker, E. P., Thomas, T. H., Quarti, C., Stanton, M. R., Dashwood, C. D., Gillett, A. J., Richter, J. M., Pearson, A. J., Davis, N. J. L. K., Sirringhaus, H., Price, M. B., Greenham, N. C., Beljonne, D., Dutton, S. E., & Deschler, F. (27 December 2017). Formation of Long-Lived Color Centers for Broadband Visible Light Emission in Low-Dimensional Layered Perovskites. Journal of the American Chemical Society, 139 (51), 18632 - 18639. doi:10.1021/jacs.7b10223
Peer Reviewed verified by ORBi

Beljonne, D. (18 December 2017). Probing Local Intermolecular Interactions with Light= Modeling insights. Paper presented at Conference on Progress in Organic Optoelectronics, Valencia, Spain.

Beljonne, D. (26 November 2017). Electronic structure at organic interfaces. Paper presented at MRS Internationam conference, symposium Organic Semiconductors-Surface, Interface, Bulk Doping and Charge Transport, Boston, United States - Massachusetts.

List, N. H., Knoops, J., Rubio Magnieto, J., Ide, J., Beljonne, D., Norman, P., Surin, M., & Linares, M. (01 November 2017). Origin of DNA-induced circular dichroism in a minor-groove binder. Journal of the American Chemical Society, 139, 14947-14953.
Peer Reviewed verified by ORBi

Frederix, P., Ide, J., Altay, Y., Schaeffer, G., Surin, M., Beljonne, D., Bodarenko, A., Jansen, T., Otto, S., & Marrink, S. (08 September 2017). Structural and spectroscopic properties of assemblies of self-replicating peptide macrocycles. ACS Nano, 11, 7858-7868. doi:10.1021/acsnano.7b02211
Peer Reviewed verified by ORBi

Saiev, S., Bonnaud, L., Dubois, P., Beljonne, D., & Lazzaroni, R. (04 September 2017). Modeling the formation and thermomechanical properties of polybenzoxazine thermosets. Polymer Chemistry, 8, 5988-5999.
Peer Reviewed verified by ORBi

Yong, C. K., Musser, A. J., Bayliss, S. I., Lukman, S., Tamura, H., Bubnova, O., Hallani, R. K., Meneau, A., Resel, R., Maruyama, M., Hotta, S., Herz, L. M., Beljonne, D., Anthony, J. E., Clark, J., & Sirringhaus, H. (12 July 2017). The Entangled Triplet Pair State in Acene and Heteroacene Materials. Nature Communications, 8, 15953.
Peer reviewed

Beljonne, D. (10 July 2017). Modeling electronic processes at interfaces: From molecular to perovskites. Paper presented at IPOE International Conference on Interfaces properties in organic electronics, Cergy-Pontoise, France.

Sgroi, M., Lazzaroni, R., Beljonne, D., & Pullini, D. (18 June 2017). Doping LiMnPO4 with Cobalt and Nickel: A First Principle Study. Batteries, 3, 11-20. doi:10.3390/batteries3020011
Peer Reviewed verified by ORBi

Ivanov, I., Hu, Y., Osella, S., Beser, U., Wang, H. I., Beljonne, D., Narita, A., Müllen, K., Turchinovich, D., & Bonn, M. (2017). Role of Edge Engineering in Photoconductivity of Graphene Nanoribbons. Journal of the American Chemical Society.
Peer Reviewed verified by ORBi

Beljonne, D. (09 May 2017). Electronic structure of MAPI perovskites: First-principles simulations of interfacial and doping effects. Paper presented at JPH2017 workshop on hybrid perovskites, Angers , France.

Beljonne, D. (09 May 2017). Electronic structure of MAPI perovskites: First-principles simulations of interfacial and doping effects. Paper presented at JPH2017 workshop on hybrid perovskites, Angers , France.

Cornil, D., Wiame, H., Lecomte, B., Cornil, J., & Beljonne, D. (09 May 2017). Which Oxide for Low-Emissivity Glasses? First-Principles Modeling of Silver Adhesion. ACS Applied Materials and Interfaces, 9, 18346-18354.
Peer Reviewed verified by ORBi

Monahan, N. R., Sun, D., Tamura, H., Williams, K. W., Xu, B., Zhong, Y., Kumar, B., Nuckolls, C., Harutyunyan, A. R., CHEN, G., Dai, H. L., Beljonne, D., Rao, Y., & Zhu, X. Y. (2017). Dynamics of the Triplet-Pair State Reveals the Likely Coexistence of Coherent and Incoherent Singlet Fission in Crystalline Hexacene. Nature Chemistry.
Peer Reviewed verified by ORBi

Beljonne, D. (01 April 2017). Doping LiMnPO4 with Cobalt and Nickel: A First Principle Study. Batteries, 3, 11.
Peer Reviewed verified by ORBi

Athanasopoulos, S., Alfonso Hernandez, L., Beljonne, D., Fernandez-Alberti, S., & Tretiak, S. (2017). Ultrafast Non-Forster Intramolecular Donor-Acceptor Excitation Energy Transfer. Journal of Physical Chemistry Letters.
Peer reviewed

Bertolazzi, S., Bonacchi, S., Nan, G., Pershin, A., Beljonne, D., & Samori, P. (2017). Engineering Chemically Active Defects in Monolayer MoS2 Transistors via Ion-Beam Irradiation and Their Healing via Vapor Deposition of Alkanethiols. Advanced Materials.
Peer reviewed

Sutton, C., Beljonne, D., Tummala, N. R., & Brédas, J. L. (13 March 2017). Singlet Fission in Rubrene Derivatives: Impact of Molecular Packing. Chemistry of Materials, 29, 2777-2787.
Peer Reviewed verified by ORBi

Quarti, C., De Angelis, F., & Beljonne, D. (17 January 2017). Influence of Surface Termination on the Energy Level Alignment at the CH3NH3PbI3 Perovskite/C60 Interface. Chemistry of Materials, 29, 958-968.
Peer Reviewed verified by ORBi

Gobbi, M., Bonacchi, S., Lian, J., Liu, Y., Wang, X.-Y., Stoeckel, M.-A., Squillaci, M. A., D'Avino, G., Narita, A., Mullen, K., Feng, X., Olivier, Y., Beljonne, D., Samori, P., & Orgiu, E. (16 January 2017). Periodic potentials in hybrid van der Waals heterostructures formed by supramolecular lattices on graphene. Nature Communications, 8, 14767. doi:10.1038/ncomms14767
Peer reviewed

Dervaux, J., Cormier, P.-A., Struzzi, C., Scardamaglia, M., Bittencourt, C., Petaccia, L., Cornil, D., Lasser, L., Beljonne, D., Cornil, J., Lazzaroni, R., & Snyders, R. (01 January 2017). Probing the Interaction Between 2-2'-bithiophene-5-carboxylic acid and TiO2 by Photoelectron Spectroscopy: A Joint Experimental and Theoretical Study. Journal of Chemical Physics, 147, 244704.
Peer Reviewed verified by ORBi

Keerthi, A., Radha, B., Rizzo, D., Lu, H., Diez Cabanes, V., Hou, I. C. Y., Beljonne, D., Cornil, J., Casiraghi, C., Baumgarten, M., Mullen, K., & Narita, A. (01 January 2017). Edge Functionalization of Structurally Defined Graphene Nanoribbons for Modulating the Self-Assembled Structures. Journal of the American Chemical Society, 139, 16454-16457.
Peer Reviewed verified by ORBi

Vangerven, T., Verstappen, P., Patil, N., D'haen, J., Cardinaletti, I., Bendhun, J., Van Den Brande, N., Defour, M., Lemaur, V., Beljonne, D., Lazzaroni, R., Champagne, B., Vandewal, K., Andreasen, J. W., Adriaensens, P., Breiby, D. W., Van Mele, B., Vanderzande, D., Maes, W., & Manca, J. (01 January 2017). Elucidating Batch-to-Batch Variation Caused by Homocoupled Side Products in Solution Processable Organic Solar Cells. Chemistry of Materials, 28, 9088-9098.
Peer Reviewed verified by ORBi

Haar, S., Bruna, M., Lian, J., Tomarchio, F., Olivier, Y., Mazzaro, R., Morandi, V., Moran, J., Ferrari, A. C., Beljonne, D., Ciesielski, A., & Samori, P. (23 December 2016). Liquid-Phase Exfoliation of Graphite into Single- and Few-Layer Graphene with α‑Functionalized Alkanes. Journal of Physical Chemistry Letters, 7, 2714-2721. doi:10.1021/acs.jpclett.6b01260
Peer reviewed

Viani, L., Minoia, A., Cornil, J., Beljonne, D., Egelhaaf, H. J., & Gierschner, J. (07 November 2016). Resonant Energy Transport in Dye-Filled Monolithic Crystals of Zeolite L: Modeling of Inhomogeneity. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 120, 27192-27199.
Peer Reviewed verified by ORBi

Beljonne, D. (19 October 2016). Elementary Electronic Processes in Carbon-based Materials and Beyond: what do we learn from Theory? Paper presented at Nanocon 2016 international Conference, Brno, Czechia.

Beljonne, D. (10 October 2016). Electronic processes at organic-(in)organic interfaces: From molecules to perovskites. Paper presented at CECAM workshop, Computational insight into photo-induced processes at interfaces, Bremen, Germany.

D'Avino, G., Muccioli, L., Castet, F., Poelking, C., Andrienko, D., Soos, Z. G., Cornil, J., & Beljonne, D. (07 September 2016). Electrostatic Phenomena in Organic Semiconductors: Fundamentals and Implications for Photovoltaics. Journal of Physics: Condensed Matter, 28.
Peer Reviewed verified by ORBi

Charalambidis, G., Georgilis, E., Panda, M. K., Anson, C. E., Powell, A. K., Doyle, S., Moss, D., Jochum, T., Horton, P. N., Coles, S. J., Linares, M., Beljonne, D., Naubron, J. V., Conradt, J., Kalt, H., Mitraki, A., Coutsolelos, A. G., & Balaban, T. S. (2016). A switchable Self-Assembling and Disassembling Chiral System Based on a Porphyrin-Substituted Phenylalanine-Phenylalanine Motif. Nature Communications.
Peer reviewed

Lian, J. X., Lherbier, A., Wang, L. J., Charlier, J. C., Beljonne, D., & Olivier, Y. (23 August 2016). Electronic Structure and Charge Transport in Nanostripped Graphene. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 120, 20024-20032. doi:10.1021/acs.jpcc.6b06265
Peer Reviewed verified by ORBi

Desmarchelier, A., Alvarenga, B. G., Caumes, X., Dubreucq, L., Troufflard, C., Tessier, M., Vanthuyne, N., Idé, J., Maistriaux, T., Beljonne, D., Brocorens, P., Lazzaroni, R., & Raynal, M. (2016). Tuning the Nature and Stability of Self-Assemblies Formed by Ester Benzene 1,3,5-Tricarboxamides: The Crucial Role Played by the Substituents. Soft Matter.
Peer Reviewed verified by ORBi

li, K., D'Avino, G., Duchemin, I., Beljonne, D., & Blase, X. (2016). Combining the Many-Body GW Formalism with Classical Polarizable Models: Insights on the Electronic Structure of Molecular Solids. Journal of Physical Chemistry Letters.
Peer reviewed

Beljonne, D. (01 July 2016). Charge Transport in Carbon-based Materials. Paper presented at International Conference on Synthetic Metals 2016, Guangzhou, China.

D'avino, G., Olivier, Y., Muccioli, L., & Beljonne, D. (01 July 2016). Do charges delocalize over multiple molecules in fullerene derivatives? Journal of Materials Chemistry C, 4, 3747-3756. doi:10.1039/c5tc03283k
Peer reviewed

Liu, J., Osella, S., Ma, J., Berger, R., Beljonne, D., Schollmeyer, D., Feng, X., & Müllen, K. (2016). Fused Dibnezo(a,m)rubicene: A New Bowl-Shaped Subunit of C70 Containing Two Pentagons. Journal of the American Chemical Society.
Peer Reviewed verified by ORBi

Döbbelin, M., Ciesielski, A., Haar, S., Osella, S., Bruna, M., Minoia, A., Grisanti, L., Mosciatti, T., Friend, R. H., Richard, F., Prasetyanto, E. A., De Cola, L., Palermo, V., Mazzaro, R., Morandi, V., Lazzaroni, R., Ferrari, A. C., Beljonne, D., & Samori, P. (2016). Light-Enhanced Liquid-Phase Exfoliation and Current Photoswitching in Graphene-Azobenzene Composites. Nature Communications.
Peer reviewed

Bacalum, M., Wang, L., Boodts, S., Yuan, P., Leen, V., Smisdom, N., Fron, E., Knippenberg, S., Fabre, G., Trouillas, P., Beljonne, D., Dehaen, W., Boens, N., & Ameloot, M. (2016). A Blue-Light-Emitting Bodipy Probe for Lipid Membranes. Langmuir.
Peer Reviewed verified by ORBi

Osella, S., Minoia, A., & Beljonne, D. (05 March 2016). Combined Molecular Dynamics and Density Functional Theory Study of Azobenzene-Graphene Interfaces. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 120, 6651-6658.
Peer Reviewed verified by ORBi

Liu, J., Narita, A., Osella, S., Zhang, W., Schollmeyer, D., Beljonne, D., Feng, X., & Müllen, K. (09 February 2016). Unexpected Scholl Reaction of 6,7,13,14-Tetraarylbenzenz(k)tetraphene: Selective Formation of Five-Memebered Rings in Polycyclic Aromatic Hydrocarbons. Journal of the American Chemical Society, 138, 2602-2068.
Peer Reviewed verified by ORBi

D'Avino, G., Muccioli, L., Olivier, Y., & Beljonne, D. (19 January 2016). Charge Separation and Recombination at Polymer-Fullerene Heterojunctions: Delocalization and Hybridization Effects. Journal of Physical Chemistry Letters, 7, 536-540.
Peer reviewed

Scardamaglia, M., Struzzi, C., Osella, S., Reckinger, N., Colomer, J.-F., Petaccia, L., Snyders, R., Beljonne, D., & Bittencourt, C. (07 January 2016). Tuning nitrogen species to control the charge carrier concentration in highly doped graphene. 2D Materials, 3 (1).
Peer reviewed

Oliveras-Gonzalezn, C., Gonzalez-Campo, A., Di Meo, F., Beljonne, D., Norman, P., Simon-Sorbed, M., Linares, M., & Amabilino, D. B. (2016). Bottom-Up Hierarchical Self-Assembly of Chiral Porphyrins through Coordination and Hydrogen Bonds. Journal of the American Chemical Society.
Peer Reviewed verified by ORBi

Tregnano, G., Wykes, M., Paterno, G. M., Beljonne, D., & Cacialli, F. (2016). Low-Temperature Photoluminescence Spectroscopy of Solvent-Free PCBM Single Crystals. Journal of Physical Chemistry. C, Nanomaterials and interfaces.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Castet, F. (2016). Modelling Organic Solar Cells: What are the Challenges Ahead? In Unconventional Thin Film Photovoltaics: Organic and Perovskite Solar Cells (pp. 367-390). RSC Publishing.

Spano, F. C., & Beljonne, D. (2016). Photophysical Properties of Molecular Aggregates 101. In WSPC Reference on Organic Electronics: Organic Semiconductors. World Scientific.

Musumeci, C., Osella, S., Ferlauto, L., Niedzalek, D., Grisanti, L., Bonacchi, S., Jouaiti, A., Milita, S., Ciesielski, A., Beljonne, D., Hosseini, M. W., & Samori, P. (01 January 2016). Influence of the Supramolecular Order on the Electrical Properties of 1D Coordination Polymers Based Materials. Nanoscale, 8, 2386-2394.
Peer Reviewed verified by ORBi

Lloyd, A., Cornil, D., Van Duin, A. C. T., Van Duin, D., Smith, R., Kenny, S. D., Cornil, J., & Beljonne, D. (01 January 2016). Development of a ReaxFF Potential for Ag/Zn/O and Application to Ag Deposition on ZnO. Surface Science, 645, 67-73.
Peer Reviewed verified by ORBi

Wang, L., & Beljonne, D. (2016). Optical Properties of Regiogular Poly(3-hexylthiophene) Aggregates from Fully Atomistic Investigations. CrystEngComm.
Peer Reviewed verified by ORBi

Tsutsui, Y., Schweicher, G., Chattopadhay, B., Sakurai, T., Arlin, J. B., Ruzié, C., Aliev, A., Ciesielski, A., Colella, S., Kennedy, A. R., Lemaur, V., Olivier, Y., Hadji, R., Sanguinet, L., Castet, F., Osella, S., Dudenko, D., Beljonne, D., Cornil, J., & Geerts, Y. H. (01 January 2016). Unraveling Unprecedented Charge Carrier Mobility through Structure Property Relationship of Four Isomers of Didodecylbenzothienol(3,2-b) (1) benzothiophene. Advanced Materials, 28, 7106-7114. doi:10.1002/adma.201601285
Peer reviewed

Wang, L., Prezdhdo, O. V., & Beljonne, D. (2016). Mixed Quantum-Classical Dynamics for Charge Transport in Organics. Physical Chemistry Chemical Physics.
Peer Reviewed verified by ORBi

Beljonne, D. (10 December 2015). Charge-transfer excitations in organic conjugated materials. Paper presented at Symposium on Hybrid Photovoltaics 2015, Berlin, Germany.

Marcelis, L., Rebarz, M., Lemaur, V., Fron, E., De Winter, J., Moucheron, C., Gerbaux, P., Beljonne, D., Sliwa, M., & Kirsch-De Mesmaeker, A. (07 December 2015). Photoaddition of Two Guanine Bases to Single Ru-TAP Complexes. Computational Studies and Ultrafast Spectroscopies to Elucidate the pH Dependence of Primary Processes. Journal of Physical Chemistry B, 119 (12), 4488-4500. doi:10.1021/acs.jpcb.5b00197
Peer Reviewed verified by ORBi

Beljonne, D. (05 October 2015). Charge Transport in Organic Conjugated Materials: Microstructure, electrostatics and phonons. Paper presented at Workshop on Theoretical Challenges in Organic Electronics, Heidelberg, Germany.

Wykes, M., Parambil, R., Beljonne, D., & Gierschner, J. (21 September 2015). Vibronic Coupling in Molecular Crystals: A Franck-Condon Hezberg-Teller Model of H-aggregate Fluorescence Based on Quantum Chemical Cluster Calculations. Journal of Chemical Physics, 143, 114116.
Peer Reviewed verified by ORBi

Golling, F. E., Osella, S., Quernheim, M., Wagner, M., Beljonne, D., & Mullen, K. (08 September 2015). PI-Extended (12) cycloparaphenylenes : from a hexaphenylbenzene cyclohexamer to its unexpected c2-symmetric congener. Chemical Science, 6, 7072-7078.
Peer Reviewed verified by ORBi

Tamura, H., Burghardt, I., Olivier, Y., & Beljonne, D. (04 September 2015). First-Principles Quantum Dynamics of Singlet Fission: Coherent versus Thermally Activated Mechanisms Governed by Molecular PI Stacking. Physical Review Letters, 115, 107401.
Peer Reviewed verified by ORBi

Rubio Magnieto, J., Azene, E. G., Knoops, J., Knippenberg, S., Delcourt, C., Thomas, A., Richeter, S., Mehdi, A., Dubois, P., Lazzaroni, R., Beljonne, D., Clément, S., & Surin, M. (17 July 2015). Self-Assembly and Hybridization Mechanisms of DNA with Cationic Polythiophene. Soft Matter, 11, 6460-6471.
Peer Reviewed verified by ORBi

Beljonne, D. (13 July 2015). Charge-Transfer Electronic Excitations in organic conjugated materials. Implications for singlet and exciton dissociation. Paper presented at Workshop on Multiscale Simulations of Organic Electronic Materials, Telluride, United States - Colorado.

Rubio Magnieto, J., Azene, E. G., Knoops, J., Knippenberg, S., Delcourt, C., Thomas, A., Richeter, S., Ahmad, M., Dubois, P., Lazzaroni, R., Beljonne, D., Clement, S., & Surin, M. (07 July 2015). Self-assembly and hybridization mechanisms of DNA with cationic polythiophene. Soft Matter, 11, 6460-6471. doi:10.1039/C5SM01484K
Peer Reviewed verified by ORBi

Beljonne, D. (14 May 2015). Electronic excitations in molecular aggregates: from optical properties to singlet fission. Paper presented at Workshop on Frontiers in Singlet Fission, Erlangen, Germany.

Struzzi, C., Scardamaglia, M., Ligot, S., Colomer, J. F., Osella, S., Beljonne, D., Snyders, R., & Bittencourt, C. (08 May 2015). CF4 Plasma Diagnostic and Fluorination of Vertically Aligned Carbon Nanotubes. Poster session presented at NANOWAL (The Wallonia Network for Nanotechnologies) and MAIN (The MAterials, Interfaces and Nanostructures Doctoral School) on Nanomaterials and Energy, Mons, Belgium.

Henwood, A. F., Lesieur, M., Bansal, A. K., Lemaur, V., Beljonne, D., Thompson, D. G., Graham, D., Slawin, A. M. Z., Samuel, I. F. D. W., Cazin, C. S. J., & Zysman-Colman, E. (02 April 2015). Palladium (O) NHC Complexes: A new Avenue to Highly efficient Phosphorescence. Chemical Science, 6, 3248-3261.
Peer Reviewed verified by ORBi

Struzzi, C., Scardamaglia, M., Ligot, S., Colomer, J. F., Osella, S., Beljonne, D., Snyders, R., & Bittencourt, C. (10 March 2015). CF4 Plasma Diagnostic and Fluorination of Vertically Aligned Carbon Nanotubes. Poster session presented at 8ème édition de la Matinée des Chercheurs 2015 (MdC2015), Mons, Belgium.

Beljonne, D. (10 March 2015). Singlet fission, exciton dissociation and charge transport in organic conjugated materials. Paper presented at Workshop on Electronic Properties of PI-Conjugated Materials III, Würzburg, Germany.

Marcelis, L., Rebarz, M., Lemaur, V., Fron, E., De Winter, J., Moucheron, C., Gerbaux, P., Beljonne, D., Sliwa, M., & Kirsch-De Mesmaeker, A. (06 March 2015). Photoaddition of two guanine bases to single Ru-TAP complexes: computational studies and ultrafast spectroscopies to elucidate the pH dependence of primary processes. Journal of Physical Chemistry B, 119, 4488-4500.
Peer Reviewed verified by ORBi

Yang, H., Withers, F., Gebremedehn, E., Lewis, E., Britnell, L., Felten, A., Palermo, V., Haigh, S., Beljonne, D., & Casiraghi, C. (01 January 2015). Dielectric Nanosheets Made by Liquid-Phase Exfoliation in Water and their Use in Graphene-Based Electronics. 2D Materials, 1, 011012.
Peer reviewed

Ratcliff, L., Grisanti, L., Genovese, L., Deutsch, T., Neumann, T., Danilov, D., Wenzel, W., Beljonne, D., & Cornil, J. (01 January 2015). Toward Fast and Accurate Evaluation of Charge On-Site Energies and Transfer Integrals in Supramolecular Architectures using Linear DFT-based Methods. Journal of Chemical Theory and Computation, 11, 277-286.
Peer reviewed

Kozlov, O. V., Luponosov, Y. N., Ponomarenko, S. A., Kausch-Busies, N., Paraschuk, D. Y., Olivier, Y., Beljonne, D., Cornil, J., & Pshenichnikov, M. S. (01 January 2015). Ultrafast Charge Generation Pathways in Photovoltaic Blends Based on Novel Star-Shaped Conjugated Molecules. Advanced Energy Materials, 5, 1401657.
Peer Reviewed verified by ORBi

Schwab, M. G., Narita, A., Osella, S., Hu, Y., Maghsoumi, A., Mavrinsky, A., Pisula, W., Castiglioni, C., Tommasini, M., Beljonne, D., Feng, X., & Müllen, K. (01 January 2015). Bottom-Up Synthesis of Nacklace-Like Graphene Nanoribbons. Chemistry: An Asian Journal, 10, 2134-2138.
Peer Reviewed verified by ORBi

Liu, J., Li, B. W., Tan, Y. Z., Giannakopoulos, A., Sanchez-Sanchez, C., Beljonne, D., Ruffieux, P., Fasel, R., Feng, X., & Müllen, K. (01 January 2015). Toward Cove-Edged Low Band Gap Graphene Nanoribbons. Journal of the American Chemical Society, 137, 6097-6103.
Peer Reviewed verified by ORBi

Lasser, L., Ronca, E., De Angelis, F., Cornil, J., Lazzaroni, R., & Beljonne, D. (01 January 2015). Pinning Effects in the Energy Level Alignment at Titanium-Dye Interfaces: Implications for Electron Injection and Light Harvesting. Journal of Physical Chemistry Letters, 119 (9899-9909).
Peer reviewed

Zhang, F., Wang, X., Qiu, F., Xue, M., Tregnago, G., Cacialli, F., Osella, S., Beljonne, D., & Feng, X. (01 January 2015). Geometric and Electronic Structures of Boron (III) - Cored Dyes Tailored by incorporation of heteroatoms into ligands. Chemistry: An Asian Journal, 10, 709-714.
Peer Reviewed verified by ORBi

Hahn, T., Geijer, J., Blase, X., Duchemin, I., Niedzalek, D., Tscheuschner, S., Beljonne, D., Bässler, H., & Köhler, A. (01 January 2015). Does Excess Energy Assist Photogeneration in an Organic Low-Bandgap Solar Cell? Advanced Functional Materials, 25, 1287-1295.
Peer Reviewed verified by ORBi

Niedzalek, D., Duchemin, I., Branquinho de Queiroz, T., Osella, S., Rao, A., Friend, R. H., Blase, X., Kümmel, S., & Beljonne, D. (01 January 2015). First principles calculations of charge transfer excitations in polymer-fullerene complexes: influence of excess energy. Advanced Functional Materials, 25, 1972-1984.
Peer Reviewed verified by ORBi

Tan, Y. Z., Osella, S., Liu, B., Yang, B., Beljonne, D., Feng, X., & Müllen, K. (01 January 2015). Sulfur-Annulated Hexa-peri-hexabenzocoronene Decorated with Phenylthio Groups at the periphery. Angewandte Chemie, 54, 2927-2931.
Peer reviewed

Kumar, M., Brocorens, P., Tonnelé, C., Beljonne, D., Surin, M., & George, S. J. (16 December 2014). A dynamic supramolecular polymer with stimuli-responsive handedness for in situ probing of enzymatic ATP hydrolysis. Nature Communications, 5 (5793), 1-8.
Peer reviewed

Scardamaglia, M., Struzzi, C., Osella, S., N., R., Colomer, J.-F., Amati, M., Alexey, B., Gregoratti, L., Petaccia, L., Snyders, R., Beljonne, D., & Bittencourt, C. (08 December 2014). Tuning nitrogen species: a way to control the doping of N-graphene. Paper presented at Groupe de Contact Rayonnement Synchrotron, Namur, Belgium.

Beljonne, D. (08 November 2014). Exciton fission and dissociation at organic interfaces. Paper presented at KAUST Solar Future 2014 Meeting, King Abdullah University of Science and Technology, Saudi Arabia, Saudi Arabia.

D'Avino, G., Muccioli, L., Zannoni, C., Beljonne, D., & Soos, Z. G. (08 October 2014). Electronic Polarization in Organic Crystals: A Comparative Study of Induced Dipoles and Intramolecular Charge Redistribution Schemes. Journal of Chemical Theory and Computation, 10, 4959-4971.
Peer reviewed

Guo, Z., De Cat, I., Van Averbeke, B., Lin, J., Wang, G., Xu, H., Lazzaroni, R., Beljonne, D., Schenning, A. P. H. J., & De Feyter, S. (12 September 2014). Affecting surface chirality via multicomponent adsorption of chiral and achiral molecules. Chemical Communications, 50, 11903-11906.
Peer Reviewed verified by ORBi

Tang, R., Zhang, F., Fu, Y., Xu, Q., Wang, X., Zhuang, X., Giannakopoulos, A., Beljonne, D., & Feng, X. (03 September 2014). Efficient Approach to Electron-Deficient 1,2,7,8-Tetraazaperylene Derivatives. Organic Letters, 16, 4726-4729.
Peer Reviewed verified by ORBi

Beljonne, D. (24 August 2014). Charge Transport in carbon-based materials: From 0D towards 3D. Paper presented at International Conference on Molecular Electronics (ElecMol), Strasbourg, France.

Gui, Z., De Cat, I., Van Averbeke, B., Lin, J., Wang, G., Xu, H., Lazzaroni, R., Beljonne, D., Schenning, A. P. H. J., & De Feyter, S. (18 August 2014). Affecting Surface Chirality via Multicomponent Adsorption of Chiral and Achiral Molecules. Chemical Communications, 50, 11903-11906.
Peer Reviewed verified by ORBi

Beljonne, D. (30 June 2014). Singlet fission, exciton dissociation and charge transport in organic conjugated materials: Modeling insights. Paper presented at International Conference on Synthetic Metals (ICSM), Turku, Finland.

Beljonne, D. (25 June 2014). Electronic Processes at Interfaces Modeling Insights. Paper presented at Workshop 'Surfaces, Interfaces and Functionalization Processes in Organic Compounds and Applications, Trieste, Italy.

Chen, L., Wang, L., & Beljonne, D. (07 June 2014). Designing Coved Graphene Nanoribbons with Charge Carrier Mobility Approaching that of Graphene. Carbon, 77, 868-879.
Peer Reviewed verified by ORBi

Beljonne, D. (26 May 2014). On the role of charge transfer excitations in mediating triplet diffusion, singlet fission and dissociation in organics. Poster session presented at E-MRS Spring Meeting, May 26-29, Lille, France.

Beljonne, D. (06 May 2014). Modeling graphene-organic hybrids: Exfoliation, doping and charge transport. Paper presented at Colloquim HU Berlin, Berlin, Germany.

Beljonne, D. (31 March 2014). Modeling (non) covalently functionalized graphene: exfoliation, doping and charge transport. Paper presented at Symposium 'Quantum Chemistry for Extended Systems', Beijing, China.

Beljonne, D. (19 March 2014). On the role of charge transfer excitations in mediating triplet diffusion, singlet fission and dissociation in organics. Paper presented at DPG Conference, symposium 'Exciton transfer in ordered atomic and molecular structures', Berlin, Germany.

Osella, S., Gueskine, V., Cornil, J., & Beljonne, D. (19 March 2014). Coherent Electron Transmission Across Nanographenes Tethered to Gold Electrodes: Influence of Linker Topology, Ribbon Width and Length. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 118, 7643-7652.
Peer Reviewed verified by ORBi

Beljonne, D. (03 March 2014). Exciton fission, dissociation and transport in organic conjugated materials; Modeling insights. Paper presented at APS March Meeting, Denver, United States - Colorado.

Christodoulou, C., Giannakopoulos, A., Nardi, M. V., Ligorio, G., Oehzelt, M., Chen, L., Pasquali, L., Timpel, M., Giglia, A., Nannarone, S., Norman, P., Linares, M., Parvez, K., Müllen, K., Beljonne, D., & Koch, N. (15 February 2014). Tuning the Work Function of Graphene-on-Quartz with a High Weight Molecular Acceptor. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 118, 4784-4790.
Peer Reviewed verified by ORBi

Boens, N., Wang, L., Leen, V., Yuan, P., Verbelen, B., Dehaen, W., Van Der Auweraer, M., De Borggraeve, W. D., Van Meervelt, L., Jacos, J., Beljonne, D., Tonnelé, C., Lazzaroni, R., Ruedas-Rama, M. J., Orte, A., Crovetto, L., & Talavera, E. M. (06 February 2014). 8-HaloBODIPY and Their 8-(C,N,O,S) Substituted Analogues: Solvent Dependent UV-Vis Spectroscopy, Variable Temperature NMR, Crystal Structure Determination, and Quantum-Chemical Calculations. Journal of Physical Chemistry. A, 118, 1576-1594.
Peer Reviewed verified by ORBi

Sforazzini, G., Kahnt, A., Wykes, M., Sprafke, J. K., Brovelli, S., Montarnal, D., Meinardi, F., Beljonne, D., Albinsson, B., & Anderson, H. L. (03 February 2014). Synthesis and Photophysics of Coaxial Threaded Molecular Wires: Polyrotaxanes with Triarylamine jackets. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 118, 4553-4566.
Peer Reviewed verified by ORBi

Idé, J., Méreau, R., Ducasse, L., Castet, F., Bock, H., Olivier, Y., Cornil, J., Beljonne, D., D'Avino, G., Roscioni, O. M., Muccioli, L., & Zannoni, C. (24 January 2014). Charge Dissociation at Interfaces Between Discotic Liquid Crystals: The Surprising Role of Column Mismatch. Journal of the American Chemical Society, 136, 2911-2920.
Peer Reviewed verified by ORBi

Liu, Z., Tonnelé, C., Battagliarin, G., Li, C., Gropeanu, R., Weil, T., Surin, M., Beljonne, D., Lazzaroni, R., Debliquy, M., Renoirt, J.-M., & Mullen, K. (02 January 2014). Functional Layers for Zn2+ Ion Detection: From Molecular Design to Optical Fiber Sensors. Journal of Physical Chemistry B, 118 (1), 309-314.
Peer Reviewed verified by ORBi

Wang, L., Olivier, Y., Prezhdo, O. V., & Beljonne, D. (01 January 2014). Maximizing Singlet Fission by Intermolecular Packing. Journal of Physical Chemistry Letters, 5, 3345-3353.
Peer reviewed

Pop, F., Melan, C., Danila, I., Linares, M., Beljonne, D., Amabilino, D. B., & Avarvari, N. (01 January 2014). Hierachical Self-Assembly of Supramolecular Helical Fibres from Amphiphilic C3-Symmetrical Functional Tris(tetrathiafulvalenes). Chemistry, 20, 17443-17453.
Peer Reviewed verified by ORBi

Berger, R., Giannakopoulos, A., Rivat, P., Wagner, M., Beljonne, D., Feng, X., & Müllen, K. (01 January 2014). Synthesis of Nitrogen-Doped ZigZag-Edge Peripheries: Dibenzo-9a-azaphenalene as Repeating Unit. Angewandte Chemie International Edition, 53, 10520-10524.
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Beljonne, D. (Ed.), & Cornil, J. (Ed.). (2014). Multiscale Modelling of Organic and Hybrid Photovoltaics. Springer, 2014.

Brédas, J. L., Cornil, J., Beljonne, D., Lazzaroni, R., & Leclère, P. (2014). L'électronique moléculaire/L'électronique plastique/Fabrication des Nanostructures. In Les Nanotechnologies, Troisième Edition, edited by M.Wautelet. Dunod 2014.

Oosterbaan, W. D., Bolsee, J. C., Wang, L., Vrindts, V., Lutsen, L. J., Lemaur, V., Beljonne, D., McNeill, C. R., Thomsen, L., Manca, J. V., & Vanderzande, D. J. M. (01 January 2014). On the relation between Morphology and FET Mobility of Poly(3-alkylthiophene)s at the Polymer/SiO2 and Polymer/Air Interface. Advanced Functional Materials, 24, 1994-2004.
Peer Reviewed verified by ORBi

Castet, F., D'Avino, G., Muccioli, L., Cornil, J., & Beljonne, D. (01 January 2014). Charge Separation Energetics at Organic Heterojunctions: On the Role of Structural and Electrostatic Disorder. Physical Chemistry Chemical Physics, 16, 20279-20290.
Peer Reviewed verified by ORBi

Cornil, D., Van Regemorter, T., Beljonne, D., & Cornil, J. (01 January 2014). Work Function Shifts of ZnO Surfaces upon Deposition of Self-Assembled Monolayers: A Theoretical Insight. Physical Chemistry Chemical Physics, 16, 20887-20899.
Peer Reviewed verified by ORBi

Salammal, S. T., Balandier, J.-Y., Arlin, J. B., Olivier, Y., Lemaur, V., Wang, L., Beljonne, D., Cornil, J., Kennedy, A. R., Geerts, Y. H., & Chattopadhyay, B. (01 January 2014). Polymorphism in Bulk and Thin Films: The Curious Case of Dithiophene-DPP (Boc)-Dithiophene. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 118, 657-669.
Peer Reviewed verified by ORBi

Olivier, Y., Niedzalek, D., Lemaur, V., Pisula, W., Mullen, K., Koldemir, U., Reynolds, J., Lazzaroni, R., & Beljonne, D. (01 January 2014). High-Mobility Hole and Electron Transport Conjugated Polymers: How structure Defines Fonction. Advanced Materials, 26, 2119-2136.
Peer reviewed

Venkateshvaran, D., Nikolta, M., Sadhanala, A., Lemaur, V., Zelazny, M., Kepa, M., Hurhangee, M., Kronemeijer, A. J., Pecunia, V., Nasrallah, I., Romanov, I., Broch, K., McCulloch, I., Emin, D., Olivier, Y., Cornil, J., Beljonne, D., & Sirringhaus, H. (01 January 2014). Approaching Disorder-Free Transport in High Mobility Conjugated Polymers. Nature, 515, 384-388.
Peer Reviewed verified by ORBi

Beljonne, D. (21 November 2013). Light harvesting in organics: Modeling insights. Paper presented at the 'March' meeting, Namur, Belgium.

Walker, B. J., Musser, A. J., Beljonne, D., & Friend, R. H. (17 November 2013). Singlet Exciton Fission in Solution. Nature Chemistry, 5, 1019-1024.
Peer Reviewed verified by ORBi

Beljonne, D. (07 November 2013). Light Harvesting Processes LHP2013. Paper presented at Light Harvesting Processes LHP2013, Kloster Banz, Germany.

Lemaur, V., Muccioli, L., Zannoni, C., Beljonne, D., Lazzaroni, R., Cornil, J., & Olivier, Y. (04 October 2013). On the Supramolecular Packing of High Electron Mobility Naphtalene Diimide Copolymers: The Perfect Registry of Asymmetric Branched Alkyl Side Chains. Macromolecules, 46, 8171-8178.
Peer Reviewed verified by ORBi

Beljonne, D. (08 September 2013). Non-Covalent Functionalization of graphene: killing two birds with one stone. Paper presented at European Congress and Exhibition on Advanced Materials and Processes, Sevilla, Spain.

Beljonne, D. (04 September 2013). Light Harvesting and Charge generation at Organic Heterojunctions: a microscopic view. Paper presented at Workshop Frontiers of modelling excited states in materials, Chicheley, United Kingdom.

Wang, L., & Beljonne, D. (14 August 2013). Charge Transport in Organic Semiconductors: Assessment of the Mean Filed Theory in the Hopping Regime. Journal of Chemical Physics, 139, 064316.
Peer Reviewed verified by ORBi

Solano, C. J. F., Jeremias, S., Paillard, E., Beljonne, D., & Lazzaroni, R. (17 July 2013). A joint theoretical/Experimental Study of the Structure, Dynamics, and Li+ Transport in Bis((tri)fluoro(methane)sulfonyl)imide (T)FSI-Based Ionic Liquids. Journal of Chemical Physics, 139, 034502.
Peer Reviewed verified by ORBi

Beljonne, D. (30 June 2013). A Microscopic View on Exciton Diffusion and Charge Generation in Organic Conjugated Materials. Paper presented at Symposium B:Polymer Organic Semiconductor Materials and Devices of the International Conference on Materials for Advanced Technologies 2013 (ICMAT), Suntec City, Singapore.

Beljonne, D. (26 June 2013). 4 Years on modeling the opto-electronic response of conjugated polymers. Paper presented at Supramolecular Functional Systems for Organic Electronics Conference, Strasbourg, France.

Chen, L., Wang, L., Shuai, Z., & Beljonne, D. (13 June 2013). Energy Level Alignment and Charge Carrier Mobility in Noncovalently Functionalized Graphene. Journal of Physical Chemistry Letters, 4, 2158-2165.
Peer reviewed

D'Avino, G., Mothy, S., Muccioli, L., Zannoni, C., Wang, L., Cornil, J., Beljonne, D., & Castet, F. (04 June 2013). Energetics of Electron-Hole Separation at P3HT/PCBM Heterojunctions. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 117, 12981-12990.
Peer Reviewed verified by ORBi

Beljonne, D., Yagamata, H., Brédas, J. L., Spano, F. C., & Olivier, Y. (31 May 2013). Charge-Transfer Excitations Steer the Davydov Splitting and Mediate Singlet Exciton Fission in Pentacene. Physical Review Letters, 10, 226402.
Peer Reviewed verified by ORBi

Grisanti, L., Olivier, Y., Wang, L., Athanasopoulos, S., Cornil, J., & Beljonne, D. (31 May 2013). Triplet Exciton Diffusion in Anthracene Crystal: Role of Local and Non-local Electron-Phonon Interactions. Physical Review. B, Condensed Matter, 88, 035450.
Peer Reviewed verified by ORBi

Beljonne, D. (27 May 2013). Exciton Transport and Dissociation at Organic Interfaces. Paper presented at E-MRS 2013 Spring Meeting,Symposium B, Organic and Hybrid Interfaces in Excitonic Solar Cells: from fundamental science to applications, Strasbourg, France.

Wang, L., & Beljonne, D. (17 May 2013). Flexible Surface Hopping Approach to Model the Crossover from Hopping to Bnad-Like Transport in Organic Crystals. Journal of Physical Chemistry Letters, 4, 1888-1894.
Peer reviewed

Athanasopoulos, S., Hoffmann, S. T., Bässler, H., Köhler, A., & Beljonne, D. (30 April 2013). To Hop or Not to Hop? Understanding the Temperature Dependence of Spectral Diffusion in Organic Semiconductors. Journal of Physical Chemistry Letters, 4, 1694-1700.
Peer reviewed

Pathipati, S. R., Pavlica, E., Treossi, E., Rizzoli, R., Veronese, G. P., Palermo, V., Chen, L., Beljonne, D., Cai, J., Fasel, R., Ruffieux, P., & Bratina, G. (08 April 2013). Modulation of Charge Transport Properties of Reduced Graphene Oxide by Submonolayer Physisorption of an Organic Dye. Organic Electronics, 14, 1787-1792.
Peer Reviewed verified by ORBi

Van Buul, A. M., Schwartz, E., Brocorens, P., Koepf, M., Beljonne, D., Maan, J. C., Christianen, P. C. M., Kouwer, P. H. J., Nolte, R. J. M., Engelkamp, H., Blank, K., & Rowan, A. E. (15 March 2013). Stiffness Versus Architecture of Single Helical Polyisocyanopeptides. Journal of Chemical Sciences, 4, 2357-2363.
Peer Reviewed verified by ORBi

Johnson, K., Huang, Y. S., Huettner, S., Sommer, M., Brinkmann, M., Mulherin, R., Niedzialek, D., Beljonne, D., Clark, J., Huck, W. T. S., & Friend, R. H. (12 March 2013). Control of Intrachain Charge Transfer in Model Systems for Block Copolymer Photovoltaic Materials. Journal of the American Chemical Society, 135, 5074-5083.
Peer Reviewed verified by ORBi

Schlierf, A., Yang, H., Azene, E. G., Treossi, E., Ortolani, L., Chen, L., Minoia, A., Morandi, V., Samori, P., Casiraghi, C., Beljonne, D., & Palermo, V. (2013). Nanoscale Insight into the Exfoliation Mechanism of Graphene with Organic Dyes: Effect of Charge, Dipole, and Molecular Structure. Nanoscale.
Peer Reviewed verified by ORBi

Beljonne, D. (07 February 2013). On the working principle of organic solar cells: Modeling Insights. Paper presented at Zernike Colloquim, Groningen, Netherlands.

Wang, L., Verbelen, B., Tonnele, C., Beljonne, D., Lazzaroni, R., Leen, V., Dehaen, W., & Boens, N. (25 January 2013). UV-vis Spectroscopy of the Coupling Products of the Palladium of the Palladium-Catalyzed C-H arylation of the BODIPY Core. Photochemical and Photobiological Sciences, &é, 835-847.
Peer Reviewed verified by ORBi

Schwartz, F., Liégeois, V., Koepf, M., Bodis, P., Cornelissen, J. J. L. M., Brocorens, P., Beljonne, D., Nolte, R. J. M., Rowan, A. E., Woutersen, S., & Champagne, B. (01 January 2013). Beta Sheets with a Twist: The confirmation of Helical Polysocyanopetides Determined by Using Vibrational Circular Dichroism. Chemistry, 19, 13168-13174.
Peer Reviewed verified by ORBi

Cornil, J., Verlaak, S., Martinelli, N., Mityashin, A., Olivier, Y., Van Regemorter, T., Muccioli, L., Zannoni, C., Castet, F., Beljonne, D., & Heremans, P. (01 January 2013). Exploring the Energy Landscape of the Charge Transport Levels in Organic Semiconductors at the Molecular Scale. Accounts of Chemical Research, 46, 434-443.
Peer Reviewed verified by ORBi

Idé, J., Mothy, S., Savoyant, A., Fritsch, A., Aurel, P., Méreau, R., Ducasse, L., Cornil, J., Beljonne, D., & Castet, F. (01 January 2013). Interfacial Dipole and Band Bending in Model Pentacene/C60 Heterojunctions. International Journal of Quantum Chemistry, 113, 580-584.
Peer Reviewed verified by ORBi

Ramlot, D., Rebarz, M., Volker, L., Ovaere, M., Beljonne, D., Dehaen, W., Van Meervelt, L., Moucheron, C., & Kirsch-De Mesmaeker, A. (2013). An Experimental and Theoretical Approach to the Photophysical Properties of Some Rh and Ir Complexes Incorporating the Dipyrromethene Ligand. European Journal of Inorganic Chemistry, 2031-2040.
Peer Reviewed verified by ORBi

Masri, Z., Ruseckas, A., Emelianova, E. V., Wang, L., Bansal, A. K., Matheson, A., Lemke, H. T., Nielson, M. M., Nguyen, A. T., Coulembier, O., Dubois, P., Beljonne, D., & Samuel, I. D. W. (01 January 2013). Molecular weight dependence of exciton diffusion in poly(3-hexylthiophene). Advanced Energy Materials, 3, 1445-1453.
Peer Reviewed verified by ORBi

Tan, Y. Z., Yang, B., Parvez, K., Narita, A., Osella, S., Beljonne, D., Feng, X., & Müllen, K. (01 January 2013). Atomically Precise Edge Chlorination of Nanographenes and its Applications in Graphene Nanoribbons. Nature Communications, 4, 2646.
Peer reviewed

Niedzialek, D., Lemaur, V., Dudenko, D., Shu, J., Hansen, M. R., Andreasen, J. W., Pisula, W., Mullen, K., Cornil, J., & Beljonne, D. (01 January 2013). Probing the Relation Between Charge Transport and Supramolecular Organization Down to the Angström Resolution in a Benzothiadiazole-cyclopentadithiophene Copolymer. Advanced Materials, 25, 1939-1947.
Peer reviewed

Kervyn, S., Fenwick, O., Di Stasio, F., Shin, Y. S., Wouters, J., Accorsi, G., Osella, S., Beljonne, D., Cacialli, F., & Bonifazi, D. (01 January 2013). Polymorphism, Fluorescence, and Optoelectronic Properties of a Borazine Derivative. Chemistry, 19, 7771-7779.
Peer Reviewed verified by ORBi

Kirkus, M., Knippenberg, S., Beljonne, D., Cornil, J., Janssen, R. A. J., & Meskers, S. C. J. (01 January 2013). Synthesis and Optical Properties of Pyrrolo {3,2-b}pyrrole-2,5{1H,4H}-dione {iDPP}-Based Molecules. Journal of Physical Chemistry. A, 117, 2782-2789.
Peer Reviewed verified by ORBi

Xu, J., Semin, S., Niedzialek, D., Kouwer, P. H. J., Fron, E., Coutino, E., Savoini, M., Li, Y., Hofkens, J., Uji-i, H., Beljonne, D., Rasing, T., & Rowan, A. E. (01 January 2013). Self-Assembled Organic Microfibres for Nonlinear Optics. Advanced Materials, 25, 2084-2089.
Peer reviewed

Beljonne, D., Cacialli, F., & Bonifazi, D. (01 January 2013). Polymorphism, Fluorescence, and Optoelectronic Properties of a Borazine Derivative. Chemistry, 19, 7771-7779.
Peer Reviewed verified by ORBi

Kocherzhenko, A. A., Whaley, K. B., Sforazzini, G., Anderson, H. L., Wykes, M., Beljonne, D., Grozema, F. C., & Siebbeles, L. D. A. (15 November 2012). Effects of the Environment on Charge Transport in Molecular Wires. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 116, 25213-25225.
Peer Reviewed verified by ORBi

Van Regemorter, T., Guillaume, M., Fuchs, A., Lennartz, C., Gueskine, V., Beljonne, D., & Cornil, J. (06 November 2012). Methodological Aspects of the Quantum-Chemical Description of Interface Dipoles at TTF/TCNQ Interfaces. Journal of Chemical Physics, 137, 174708.
Peer Reviewed verified by ORBi

Minoia, A., Chen, L., Beljonne, D., & Lazzaroni, R. (02 October 2012). Molecular Modeling Study of the Structure and Stability of Polymer/Carbon Nanotube Interfaces. Polymer, 53, 5480-5490.
Peer Reviewed verified by ORBi

George, S. J., De Bruijn, R., Tomovic, Z., Van Averbeke, B., Beljonne, D., Lazzaroni, R., Schenning, A. P. H. J., & Meijer, E. W. (02 October 2012). Asymmetric Noncovalent Synthesis of Self-Assembled One-Dimensional Stacks by a Chiral Supramolecular Auxiliary Approach. Journal of the American Chemical Society, 134, 17789-17796.
Peer Reviewed verified by ORBi

Boens, N., Leen, V., Dehaen, W., Wang, L., Robeyns, K., Qin, W., Tang, X., Beljonne, D., Tonnele, C., Paredes, J. M., Ruedas-Rama, M. J., Orte, A., Crovetto, L., Talavera, E. M., & Alvarez-Pez, J. M. (30 August 2012). Visible Absorption and Fluorescence Spectroscopy of Conformationally Constrained Annulated BODIPY Dyes. Journal of Physical Chemistry. A, 116, 9621-9631.
Peer Reviewed verified by ORBi

Van Regemorter, T., Guillaume, M., Sini, G., Sears, J., Gueskine, V., Brédas, J. L., Beljonne, D., & Cornil, J. (28 August 2012). Density Functional Theory for the Description of Charge Transfer Processes at TTF-TCNQ Interfaces. SHS Web of Conferences, 78, 1273.
Peer Reviewed verified by ORBi

Mothy, S., Guillaume, M., Idé, J., Castet, F., Ducasse, L., Cornil, J., & Beljonne, D. (09 August 2012). Tuning the Interfacial Electronic Structure at Organic Heterojunctions by Chemical Design. Journal of Physical Chemistry Letters, 3, 2374-2378.
Peer reviewed

Nieto-Ortega, C., Ramirez, F. J., Amabilino, D. B., Linares, M., Beljonne, D., Lopez Navarrete, J. T., & Casado, J. (24 July 2012). Electronic and Vibrational Circular Dichroism Spectroscopies for the Understanding of Chiral Organization in Porphyrin Aggregates. Chemical Communications, 48, 9147-9149.
Peer Reviewed verified by ORBi

Tautz, R., Da Como, E., Limmer, T., Feldmann, J., Egelhaaf, H. J., Von Hauff, E., Lemaur, V., Beljonne, D., Yilmaz, S., Dumsch, I., Allard, S., & Scherf, U. (24 July 2012). Structural Correlations in the Generation of Polaron Pairs in Low-Bandgap Polymers for PHOTOVOLTAICS. Nature Communications, 3, 970.
Peer reviewed

Hoffmann, S. T., Athanasopoulos, S., Beljonne, D., Bässler, H., & Köhler, A. (05 July 2012). How do Triplets and Charges Move in Disordered Organic Semiconductors? A Monte Carlo Study Comprising the Equilibrium and Nonequilibrium Regime. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 116, 16371-16383.
Peer Reviewed verified by ORBi

Kirkus, M., Wang, L., Mothy, S., Beljonne, D., Cornil, J., Janssen, R. A. J., & Meskers, S. C. J. (03 July 2012). Optical Properties of Oligothiophene Substituted Diketopyrrolopyrrole Derivatives in Solid Phase: Joint J and H-type Aggregation. Journal of Physical Chemistry. A, 116, 7927-7936.
Peer Reviewed verified by ORBi

Cornil, J., & Beljonne, D. (01 July 2012). Séparation des Charges dans les Cellules Solaires Organiques: Un nouveau Paradigme. Élement: le Magazine de l'Université de Mons, 7, 36-37.

Beljonne, D. (10 June 2012). Electronic structure calculations of self assembled monolayers on graphene and graphene nanoribbons. Paper presented at CIMTEC conference 2012, 10/06/2012->14/06/2012, Montecatini, Italy.

Lin, J., Surin, M., Beljonne, D., Lou, X., Van Dongen, J. L. J., & Schenning, A. P. H. J. (07 June 2012). On the Mechanism of Dynamic Polymerization via Recycled ss-DNA Templated Assembly of Non-Natural Bases. Chemical Science, 3, 2372-2376.
Peer Reviewed verified by ORBi

Osella, S., Narita, A., Schwab, M. G., Hernandez, Y., Feng, X., Müllen, K., & Beljonne, D. (25 May 2012). Graphene Nanoribbons as low Band Gap Donor Materials for Organic Photovoltaics: Quantum Chemical Aided Design. ACS Nano, 6, 5539-5548.
Peer Reviewed verified by ORBi

Petrozza, A., Fazzi, D., Avilov, I., Beljonne, D., Friend, R. H., & Kim, J. S. (26 April 2012). Effects of Polymer Packing Structure on Photoinduced Triplet Generation and Dynamics. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 116, 11298-11305.
Peer Reviewed verified by ORBi

Lo, M., Lefebvre, J. F., Marcotte, N., Tonnele, C., Beljonne, D., Lazzaroni, R., Clement, S., & Richeter, S. (03 February 2012). Synthesis of Stable Free Base Secochlorins and Their Corresponding Metal Complexes from Meso-tetraarylporphyrin Derivatives. Chemical Communications, 48, 3460-3462.
Peer Reviewed verified by ORBi

Bakulin, A. A., Rao, A., Pavelyev, V. G., Van Loosdrecht, P. H. M., Pshenichnikov, M. S., Niedzialek, D., Cornil, J., Beljonne, D., & Friend, R. H. (21 January 2012). The Role of Driving Energy and Delocalized States for Charge Separation in Organic Semiconductors. Science, 335, 1340-1344.
Peer Reviewed verified by ORBi

Rand, B. P., Cheyns, D., Vasseur, K., Giebink, N. C., Mothy, S., Yi, Y., Coropceanu, V., Beljonne, D., Cornil, J., Brédas, J. L., & Genoe, J. (01 January 2012). The impact of Molecular Orientation on the Photovoltaic Properties of a Phthalocyanine/Fullerene Heterojunction. Advanced Functional Materials, 22, 2987-2995.
Peer Reviewed verified by ORBi

Xu, H., Saletra, W. J., Iavicoli, P., Van Averbeke, B., Ghijsens, E., Mali, K. S., Schenning, A. P. H. J., Beljonne, D., Lazzaroni, R., Amabilino, D. B., & De Feyter, S. (01 January 2012). Pasteurian Segregation on a Surface Imaged in Situ at the Molecular Level. Angewandte Chemie, 51, 11981-11985.
Peer reviewed

Mityashin, A., Olivier, Y., Van Regemorter, T., Rolin, C., Verlaak, S., Martinelli, N., Beljonne, D., Cornil, J., Genoe, J., & Heremans, P. (01 January 2012). Unraveling the Mechanism of Molecular Doping in Organic Semiconductors. SHS Web of Conferences, 78, 1535-1539.
Peer reviewed

Sprafke, J. K., Kondratuk, D. V., Wykes, M., Thompson, A. L., Hoffmann, M., Drevinskas, R., Chen, W. H., Yong, C. K., Kärnbratt, J., Bullock, J. E., Malfois, M., Wasielewski, M. R., Albinsson, B., Herz, L., Zigmantas, D., Beljonne, D., & Anderson, H. L. (01 January 2012). Belt-Shaped PI- Systems: Relating Geometry to Electronic Structure in a Six-Porphyrin Nanoring. Journal of the American Chemical Society, 133, 17262-17273.
Peer Reviewed verified by ORBi

Nénon, S., Méreau, R., Salman, S., Castet, F., Van Regemorter, T., Clima, S., Beljonne, D., & Cornil, J. (01 January 2012). Structural and Electronic Properties of the TTF/ZnO(10-10) Interface: Insights from Modelling. Journal of Physical Chemistry Letters, 3, 58-63.
Peer reviewed

Iavicoli, P., Xu, H., Keszthelyi, T., Telegdi, J., Wurst, K., Vanaverbeke, B., Saletra, W. J., Minoia, A., Beljonne, D., Lazzaroni, R., & De Feyter, S. (19 December 2011). Organization of the Enantiomeric and Racemic Forms of an Amphiphilic Resorcinol Derivative at the Air-Water and Graphite-1-Phenyloctane Interfaces. Chirality, 24, 155-166.
Peer Reviewed verified by ORBi

Hayer, A., Van Regemorter, T., Höfer, B., Mak, C., Beljonne, D., & Köhler, A. (2011). On the Formation Mechanism for Electrically Generated Exciplexes in a Carbazole-Pyridine Copolymer. Journal of Polymer Science. Part A-1, Polymer Chemistry. doi:10.1002/polb.23011
Peer Reviewed verified by ORBi

Hayer, A., Van Regemorter, T., Höfer, B., Mak, C. S. K., Beljonne, D., & Köhler, A. (13 December 2011). On the Formation Mechanism for Electrically Generated Exciplexes in a Carbazole-Pyridine Copolymer. Journal of Polymer Science. Part A-1, Polymer Chemistry, 50, 361-369.
Peer Reviewed verified by ORBi

Huang, Y. S., Gierschner, J., Schmidtke, J. P., Friend, R. H., & Beljonne, D. (14 November 2011). Tuning Interchain and Intrachain Interactions in polyfluorene Copolymers. Physical Review. B, Condensed Matter, 84, 205311.
Peer Reviewed verified by ORBi

Guo, Z., De Cat, I., Vanaverbeke, B., Wang, G., Lin, J., Xu, H., Lazzaroni, R., Beljonne, D., Meijer, E. W., Schenning, A. P. H. J., & De Feyter, S. (18 October 2011). Nucleoside-Assisted Self-Assembly of Oligo(p-phenylenevinylene)s at Liquid/Solid Interface; Chiralty and Nanostructures. Journal of the American Chemical Society, 133, 17764-17771.
Peer Reviewed verified by ORBi

Diliën, H., Marin, L., Botek, E., Champagne, B., Lemaur, V., Beljonne, D., Lazzaroni, R., Cleij, T. J., Maes, W., Lutsen, L., Vanderzande, D., & Adriaensens, P. J. (06 September 2011). Fingerprints for Structural Defects in Poly(thienylene vinylene) (PTV): A Joint Theoretical-Experimental NMR Study on Model Molecules. Journal of Physical Chemistry B, 115, 12040-12050.
Peer Reviewed verified by ORBi

Beljonne, D. (03 September 2011). Organic photovoltaic cells: how do they work? Paper presented at CFN Summer School 2011 on molecular nanostructures 03/09/2011->06/09/2011, Bad Herrenhalb, Germany.

Sukul, P. K., Asthana, D., Mukhopadhyay, P., Summa, D., Muccioli, L., Zannoni, C., Beljonne, D., Rowan, A. E., & Malik, S. (02 September 2011). Assemblies of Perylene Diimide Derivatives with Melanine into Luminescent Hydrogels. Chemical Communications, 47, 11858-11860.
Peer Reviewed verified by ORBi

Beljonne, D. (27 June 2011). Excitation Transport and Dissociation at Interfaces: Implications for Organic Solar Cells. Paper presented at CECAM conference 'Spectroscopy and quantum phenomena in large molecular aggregates 27/06/2011->30/06/2011, Bremen, Germany.

Wang, L., Beljonne, D., Chen, L., & Shi, Q. (07 June 2011). Mixed Quantum-Classical Simulations of Charge Transport in Organic Materials: Numerical Benchmark of the Su-Schrieffer-Heeger Model. Journal of Chemical Physics, 134, 244116.
Peer Reviewed verified by ORBi

Arago, J., Sancho Garcia, J. C., Orti, E., & Beljonne, D. (06 June 2011). Ab Initio Modeling of Donor-Acceptor Intercations and Charge-Transfer Excitations in Molecular Complexes: The Case of Terthiophene-Tetracyanoquinodimethane. Journal of Chemical Theory and Computation, 7, 2068-2077.
Peer reviewed

Paquin, F., Latini, G., Sakowicz, M., Karsenti, P. L., Wang, L., Beljonne, D., Stingelin, N., & Silva, C. (13 May 2011). Charge Separation in Semicrystalline Polymeric Semiconductors by Photoexcitation: Is the Mechanism Intrinsic or Extrinsic? Physical Review Letters, 106, 197401.
Peer Reviewed verified by ORBi

Danila, I., Riobé, F., Piron, F., Puigmarti-Luis, J., Wallis, J. D., Linares, M., Beljonne, D., Amabilino, D. B., & Avarvari, N. (25 April 2011). Hierarchical Chiral Expression from the Nano to Mesoscale in Synthetic Supramolecular Helical Fibers of a nonamphiphilic C3-Symmetrical PI-Functional Molecule. Journal of the American Chemical Society, 133, 8344-8353.
Peer Reviewed verified by ORBi

Yamagata, H., Norton, J., Hontz, E., Olivier, Y., Beljonne, D., Brédas, J.-L., Silbey, R. J., & Spano, F. C. (25 April 2011). The nature of Singlet Excitons in Oligoacene Molecular Crystals. Journal of Chemical Physics, 134, 204703.
Peer Reviewed verified by ORBi

Beljonne, D. (21 March 2011). Exciton Transport and Dissociation at Organic Interfaces. Paper presented at 2011 APS March Meeting, 21/03/2011->24/03/2011, Dallas, United States - Texas.

Idé, J., Méreau, R., Ducasse, L., Castet, F., Olivier, Y., Martinelli, N., Cornil, J., & Beljonne, D. (01 March 2011). Supramolecular Organization and Charge Transport Properties of Self-Assembled PI-PI Stacks of Perylene Diimide Dyes. Journal of Physical Chemistry B, 115, 5593-5603.
Peer Reviewed verified by ORBi

Papadopoulos, T. A., Muccioli, L., Athanasopoulos, S., Walker, A. B., Zannoni, C., & Beljonne, D. (07 February 2011). Does Supramolecular Ordering Influence Exciton Transport in Conjugated Systems? Insight from Atomistic Stimulations. Journal of Chemical Sciences, 2, 1025.
Peer Reviewed verified by ORBi

Yin, S., Leen, V., Jackers, C., Beljonne, D., Van Averbeke, B., & Van Der Auweraer, M. (01 January 2011). Oligo(p-phenylene ethynylene)-BODIPY Derivatives: Synthesis, Energy Transfer, and Quantum-Chemical Calculations. Chemistry, 17, 13247-13257.
Peer Reviewed verified by ORBi

Zalewski, L., Brovelli, S., Bonini, M., Mativetsky, J. M., Wykes, M., Orgiu, E., Breiner, T., Kastler, M., Dötz, F., Meinardi, F., Anderson, H. L., Beljonne, D., Cacialli, F., & Samori, P. (01 January 2011). Self-Assembled Conjugated Thiophene-Based Rotaxana Architectures: Structural, Computational and Spectroscopic Insights into Molecular Aggregation. Advanced Materials, 21, 834-844.
Peer reviewed

Oberhumer, P. M., Huang, Y. S., James, D. T., Tu, G., Beljonne, D., Cornil, J., Albert-Seifried, S., Kim, J. S., Huck, W. T. S., Greenham, N. C., Hodgkiss, J., & Friend, R. H. (01 January 2011). Tuning the Electronic Coupling in a low Bandgap Donor-Acceptor Copolymer via the Placement of Side-Chains. Journal of Chemical Physics, 134, 114901.
Peer Reviewed verified by ORBi

Beljonne, D. (15 December 2010). Beyond Förster resonance energy transfer in biological and nanoscale systems. Paper presented at Pacifichem 2010 International Chemical Congress, 15/12/2010->20/12/2010, Honolulu, United States - Hawaii.

Glowe, J. F., Perrin, M., Beljonne, D., Karsenti, L., Hayes, S. C., Gardebien, F., & Silva, C. (2010). Charge Transfer Excitons in Supramolecular Semiconductor Nanostructures. In Functional Supramolecular Architectures for Organic Electronics and Nanotechnology edited by F.cacialli and P.Samori (Wiley VCH) (pp. 551-566).

Beljonne, D., Cornil, J., Castet, F., Muccioli, L., Zannoni, C., & Brédas, J.-L. (04 October 2010). Electronic Processes at Organic/Organic Interfaces: Insight from Modelling and Implications for Opto-Electronic Devices. Chemistry of Materials, 23, 591-609.
Peer Reviewed verified by ORBi

Martinelli, N., Idé, J., Sanchez-Carrera, R. S., Coropceanu, V., Brédas, J. L., Ducasse, L., Castet, F., Cornil, J., & Beljonne, D. (07 September 2010). Influence of Structural Dynamics on Polarisation Energies in Anthracene Single Crystals. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 114, 20678-20685.
Peer Reviewed verified by ORBi

Liedtke, A., O' Neill, M., Kelly, S. M., Kidney, S. P., Van Averbeke, B., Boudard, P., Beljonne, D., & Cornil, J. (22 June 2010). Optical Properties of Light-Emitting Nematic Liquid Crystals: A joint Experimental and Theoretical Study. Journal of Physical Chemistry B, 114, 11975-11982.
Peer Reviewed verified by ORBi

Beljonne, D. (23 May 2010). Electronic structure at organic: organic interfaces. Implications for Organic Solar cells. Paper presented at Symposium on functional Pi systems, FP19, 23/05/2010->28/05/2010, Atlanta, United States - Georgia.

Emelianova, E., Athanasopoulos, S., Silbey, R. J., & Beljonne, D. (20 May 2010). 2D Excitons as Primary Energy Carriers in Organic Crystals: The Case of Oligoacenes. Physical Review Letters, 104 (20), 206405. doi:10.1103/PhysRevLett.104.206405
Peer Reviewed verified by ORBi

Beljonne, D. (12 May 2010). Electronic excitation migration in conjugated molecules and polymers: Förster and beyond. Paper presented at Quantum dynamics workshop, 12/054/2010->14/05/2010, Dublin, Ireland.

Beljonne, D. (02 May 2010). Excitation Transport and Dissociation at Interfaces: Implications for Organic solar Cells. Paper presented at International workshop on molecular material, 02/05/2010->05/05/2010, Sanxenxo, Spain.

Beljonne, D. (02 May 2010). Excitation Transport and Dissociation at Interfaces: Implications for Organic Solar Cells. Paper presented at CECAM conference 'Spectroscopy and quantum phenomena in large molecular aggregates 27/06/2011->30/06/2011, Bremen, Germany.

Zalewski, L., Wykes, M., Brovelli, S., Bonini, M., Breiner, T., Kastler, M., Dötz, F., Beljonne, D., Anderson, H. L., Cacialli, F., & Samori, P. (06 April 2010). A Conjugated Thiophene-Based Rotaxane: Synthesis, Spectroscopy, and Modeling. Chemistry, 16 (13), 3933-3941. doi:10.1002/chem.200903353
Peer Reviewed verified by ORBi

Linares, M., Beljonne, D., Cornil, J., Lancaster, K., Brédas, J.-L., Verlaak, S., Mityashin, A., Heremans, P., Fuchs, A., Lennartz, C., Idé, J., Méreau, R., Aurel, P., Ducasse, L., & Castet, F. (25 February 2010). On the Interface Dipole at the Pentacene-Fullerene Heterojunction: A Theoretical Study. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 114 (7), 3215-3224. doi:10.1021/jp910005g
Peer Reviewed verified by ORBi

Palermo, V., Schwartz, E., Finlayson, C. E., Liscio, A., Otten, M. B. J., Trapani, S., Müllen, K., Beljonne, D., Friend, R. H., Nolte, R. J. M., Rowan, A. E., & Samori, P. (23 February 2010). Macromolecular Scaffolding: The Relationship Between Nanoscale Architecture and Function in Multichromophoric Arrays for Organic Electronics. Advanced Materials, 22 (8), 81-88. doi:10.1002/adma.200903672
Peer reviewed

Glowe, J. F., Perrin, M., Beljonne, D., Hayes, S. C., Gardebien, F., & Silva, C. (05 January 2010). Charge-Transfer Excitons in Strongly Coupled Organic Semiconductors. Physical Review. B, Condensed Matter, 81 (4), 041201. doi:10.1103/PhysRevB.81.041201
Peer Reviewed verified by ORBi

Leen, V., Qin, W., Yang, W., Cui, J., Xu, C., Tang, X., Liu, W., Robeyns, K., Van Meervelt, L., Beljonne, D., Lazzaroni, R., Tonnele, C., Boens, N., & Dehaen, W. (01 January 2010). Synthesis Spectroscopy Crystal Structure Determination and Quantum Chemical Calculations of BODIPY Dyes with Increasing Conformational Restriction and Concomitant Red-Shifted Visible Absorption and Fluorescence Spectra. Chemistry: An Asian Journal, 5, 2016-2026.
Peer Reviewed verified by ORBi

Martinelli, N., Olivier, Y., Muccioli, L., Minoia, A., Brocorens, P., Ruiz Delgado, M. C., Zannoni, C., Beljonne, D., Lazzaroni, R., Brédas, J. L., & Cornil, J. (2010). Charge Transport in Organic Semiconductors: A Multiscale Modelling. In Functional Supramolecular Architectures for Organic Electronics and Nanotechnology (pp. 3-37).

Curutchet, C., Feist, F. A., Van Averbeke, B., Mennucci, B., Jacob, J., Müllen, K., Basché, T., & Beljonne, D. (01 January 2010). Superexchange-Mediated Electronic Energy Transfer in a Model Dyad. Physical Chemistry Chemical Physics, 12, 7378-7385.
Peer Reviewed verified by ORBi

Verlaak, S., Beljonne, D., Cheyns, D., Rolin, C., Linares, M., Castet, F., Cornil, J., & Heremans, P. (09 December 2009). Electronic Structure and Geminate Pair Energetics at Organic/Organic Interfaces: The Case of Pentacene/C60 Heterojunction. Advanced Functional Materials, 19 (23), 3809-3814. doi:10.1002/adfm.200901233
Peer Reviewed verified by ORBi

Van Averbeke, B., & Beljonne, D. (07 December 2009). Energy Transport along Conjugated Polymer Chains with Extended Radiative Lifetimes: A Theoretical Study. Chemphyschem: A European Journal of Chemical Physics and Physical Chemistry, 10 (17), 3061-3068. doi:10.1002/cphc.200900432
Peer Reviewed verified by ORBi

Athanasopoulos, S., Emelianova, E., Walker, A. B., & Beljonne, D. (19 November 2009). Exciton Diffusion in Energetically Disordered Organic Materials. Physical Review. B, Condensed Matter, 80 (19), 195209. doi:10.1103/PhysRevB.80.195209
Peer Reviewed verified by ORBi

Singh, J., Bittner, E. R., Beljonne, D., & Scholes, G. D. (17 November 2009). Fluorescence Depolarization in Poly[2-methoxy-5-((2-ethylhexyl)oxy)-1-4-phenylenevinylene]: Sites versus Eigenstates Hopping. Journal of Chemical Physics, 131 (19), 194905. doi:10.1063/1.3259549
Peer Reviewed verified by ORBi

Ghizdavu, L., Pierard, F., Rickling, S., Aury, S., Surin, M., Beljonne, D., Lazzaroni, R., Murat, P., Defrancq, E., Moucheron, C., & Kirsch-De Mesmaeker, A. (29 October 2009). Photooxidizing Ru(II) complexes for irreversible and specific photo-crosslinkings in oligonucleotides duplexes. Inorganic Chemistry, 48, 10988-10994. doi:10.1021/ic901007w
Peer Reviewed verified by ORBi

Martinelli, N. G., Savini, M., Muccioli, L., Olivier, Y., Castet, F., Zannoni, C., Beljonne, D., & Cornil, J. (23 October 2009). An Atomistic Description of Polymer Dielectrics/Pentacene Interfaces: Influence of Electrostatic Interactions on Charge Mobility Values. Advanced Functional Materials, 19 (20), 3254-3261. doi:10.1002/adfm.200901077
Peer Reviewed verified by ORBi

Martinelli, N. G., Olivier, Y., Ruiz Delgado, M. C., Pigg, K. R., da Silva Filho, D. A., Sanchez-Carrera, R. S., Venuti, E., Della Valle, R. G., Brédas, J.-L., Beljonne, D., & Cornil, J. (14 September 2009). Influence of Intermolecular Vibrations on the Electronic Coupling and Charge-Transport Properties of Organic Semiconductors: A Molecular Dynamics and Quantum-Chemical Study of the Anthracene and Perfluoropentacene Single Crystals. Chemphyschem: A European Journal of Chemical Physics and Physical Chemistry, 10 (13), 2265-2273. doi:10.1002/cphc.200900298
Peer Reviewed verified by ORBi

Beljonne, D. (08 September 2009). Modeling Exciton diffusion and dissociation at organic : organic interfaces. Paper presented at European Conference on Molecular Electronics 'ECME', Copenhagen, Denmark.

Beljonne, D. (24 August 2009). Beyond Förster resonance energy transfer in biological and nanoscale systems. Paper presented at EPSRC symposium workshop on quantum simulations, 24/08/2009->28/08/2009, Warwick, United Kingdom.

Viani, L., Poulsen Tolbod, L., Jazdzyk, M., Patrinoiu, G., Cordella, F., Mura, A., Bongiovanni, G., Botta, C., Beljonne, D., Cornil, J., Hanack, M., Egelhaaf, H. J., & Gierschner, J. (06 August 2009). Spatial Control of 3D Energy Transfer in Supramolecular Nanostructured Host-Guest Architectures. Journal of Physical Chemistry B, 113 (31), 10566-10570. doi:10.1021/jp904415z
Peer Reviewed verified by ORBi

Srinivasan, G., Villanueva-Garibay, J. A., Müller, K., Oelkrug, D., Milian Medina, B., Beljonne, D., Cornil, J., Wykes, M., Viani, L., Gierschner, J., Martinez-Alvarez, R., Jazdzyk, M., Hanack, M., & Egelhaaf, H. J. (07 July 2009). Dynamics of Guest Molecules in PHTP Inclusion Compounds as Probed by Solid-State NMR and Fluorescence Spectroscopy. Physical Chemistry Chemical Physics, 11 (25), 4996-5009. doi:10.1039/b820604j
Peer Reviewed verified by ORBi

Qin, W., Leen, V., Dehaen, W., Cui, J., Xu, C., Tang, X., Liu, W., Rohand, T., Beljonne, D., Van Averbeke, B., Clifford, N. J., Driesen, K., Binnemans, K., Van Der Auweraer, M., & Boens, N. (01 July 2009). 3,5-Dianilino Substituted Difluoroboron Dipyrromethene: Synthesis, Spectroscopy, Photophysics, Crystal Structure, Electrochemistry, and Quantum-Chemical Calculations. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 113 (27), 11731-11740. doi:10.1021/jp9017822
Peer Reviewed verified by ORBi

Hennebicq, E., Beljonne, D., Curutchet, C., Scholes, G. D., & Silbey, R. J. (01 June 2009). Shared-Mode Assisted Resonant Energy Transfer in the Weak Coupling Regime. Journal of Chemical Physics, 130 (21), 214505. doi:10.1063/1.3140273
Peer Reviewed verified by ORBi

Beljonne, D., Curutchet, C., Scholes, G. D., & Silbey, R. J. (14 May 2009). Beyond Förster Resonance Energy Transfer in Biological and Nanoscale Systems. Journal of Physical Chemistry B, 113 (19), 6583-6599. doi:10.1021/jp900708f
Peer Reviewed verified by ORBi

Braeken, E., Marsal, P., Vandendriessche, A., Smet, M., Dehaen, W., Vallée, R. A. L., Beljonne, D., & Van Der Auweraer, M. (06 April 2009). Investigation of Probe Molecule- Polymer Interactions. Chemical Physics Letters, 472 (1-3), 48-54. doi:10.1016/j.cplett.2009.02.083
Peer Reviewed verified by ORBi

Van Averbeke, B., & Beljonne, D. (26 March 2009). Conformational Effects on Excitation Transport along Conjugated Polymer Chains. Journal of Physical Chemistry. A, 113 (12), 2677-2682. doi:10.1021/jp810815d
Peer Reviewed verified by ORBi

Beljonne, D. (22 March 2009). Modeling exciton diffussion and dissociation at organic: organic interfaces: New insights. Paper presented at DPG spring meeting, 22/03/2009->27/03/2009, Dresden, Germany.

Schwartz, E., Palermo, V., Finlayson, C. E., Huang, Y. S., Otten, M. B. J., Liscio, A., Trapani, S., Gonzalez-Valls, I., Brocorens, P., Cornelissen, J. J. L. M., Peneva, K., Müllen, K., Spano, F. C., Yartsev, A., Westenhoff, S., Friend, R. H., Beljonne, D., Nolte, R. J. M., Samori, P., & Rowan, A. E. (02 March 2009). Helter Skelter-Like Perylene Polyisocyanopeptides. Chemistry, 15 (11), 2536-2547. doi:10.1002/chem.200801746
Peer Reviewed verified by ORBi

Dkhissi, A., Beljonne, D., & Lazzaroni, R. (01 March 2009). Atomic Scale Modeling of Interfacial Structures of PEDOT/PSS. Synthetic Metals, 159 (5-6), 546-549. doi:10.1016/j.synthmet.2008.11.022
Peer Reviewed verified by ORBi

Linares, M., Minoia, A., Brocorens, P., Beljonne, D., & Lazzaroni, R. (01 March 2009). Expression of Chirality in Molecular Layers at Surfaces: Insights from Modelling. Chemical Society Reviews, 38 (3), 806-816. doi:10.1039/B801638K
Peer Reviewed verified by ORBi

De Leener, C., Hennebicq, E., Sancho Garcia, J. C., & Beljonne, D. (05 February 2009). Modeling the Dynamics of Chromophores in Conjugated Polymers: The Case of Poly(2-methoxy-5-(2'-ethylhexyl)oxy 1,4-phenylenevinylene) (MEH-PPV). Journal of Physical Chemistry B, 113 (5), 1311-1322. doi:10.1021/jp8029902
Peer Reviewed verified by ORBi

Gierschner, J., Huang, Y. S., Vanaverbeke, B., Cornil, J., Friend, R. H., & Beljonne, D. (28 January 2009). Excitonic versus Electronic Couplings in Molecular Assemblies: The Importance of Non Nearest-Neighbour Interactions. Journal of Chemical Physics, 130 (4), 044105. doi:10.1063/1.3065267
Peer Reviewed verified by ORBi

Dykstra, T. E., Hennebicq, E., Beljonne, D., Gierschner, J., Claudio, G., Bittner, E. R., Knoester, J., & Scholes, G. D. (22 January 2009). Conformational Disorder and Ultrafast Exciton Relaxation in PPV-family Conjugated Polymers. Journal of Physical Chemistry B, 113 (38), 656-667. doi:10.1021/jp807249b
Peer Reviewed verified by ORBi

Finlayson, C. E., Friend, R. H., Otten, M. B. J., Schwartz, E., Cornelissen, J. J. L. M., Nolte, R. J. M., Rowan, A. E., Samori, P., Palermo, V., Liscio, A., Peneva, K., Müllen, L., Trapani, S., & Beljonne, D. (22 December 2008). Electronic Transport Properties of Ensembles of Perylene-Substituted Poly-isocyanopeptide Arrays. Advanced Functional Materials, 18 (24), 3947-3955. doi:10.1002/adfm.200800943
Peer Reviewed verified by ORBi

Fron, E., Schweitzer, G., Osswald, P., Würthner, F., Marsal, P., Beljonne, D., Müllen, K., De Schryver, F. C., & Van Der Auweraer, M. (01 December 2008). Photophysical Study of Bay Substituted Perylenediimides. Photochemical and Photobiological Sciences, 7 (12), 1509-1521. doi:10.1039/b813737d
Peer Reviewed verified by ORBi

Qin, W., Leen, V., Rohand, T., Dehaen, W., Dedecker, P., Van Der Auweraer, M., Robeyns, K., Van Meervelt, L., Beljonne, D., Van Averbeke, B., Clifford, J. N., Driesen, K., Binnemans, K., & Boens, N. (07 November 2008). Synthesis, Spectroscopy, Crystal Structure, Electrochemistry, Quantum Chemical and Molecular Dynamics Calculations of a 3-Anilino Difluoroboron Dipyrromethene Dye. Journal of Physical Chemistry. A, 113, 439-447.
Peer Reviewed verified by ORBi

Beljonne, D. (15 October 2008). Nature and dynamics of charge and energy carriers in conjugated materials. Paper presented at Workshop 'Flexible Organic and Hybrid Organic-Inorganic solar cells, Bordeaux, France.

Kim, J. S., Lu, L., Sreearunothai, P., Seeley, A., Yim, K. H., Petroezza, A., Murphy, C. E., Beljonne, D., Cornil, J., & Friend, R. H. (01 October 2008). Optoelectronic and Charge Transport Properties at Organic/Organic Semiconductor Interfaces : Comparison between Polyfluorene-Based Polymer Blend and Copolymer. Journal of the American Chemical Society, 130 (39), 13120-13131. doi:10.1021/ja803766j
Peer Reviewed verified by ORBi

Hippius, C., van Stokkum, I. H. M., Zangrando, E., Williams, R. M., Wykes, M., Beljonne, D., & Würthner, F. (18 September 2008). Ground- and Excited-State Pinched Cone Equilibria in Calix[4]arenes Bearing Two Perylene Bisimide Dyes. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 112 (37), 14626-14638. doi:10.1021/jp804068b
Peer Reviewed verified by ORBi

Linares, M., Iavicoli, P., Psychogyopoulou, K., Beljonne, D., De Feyter, S., Amabilino, D. B., & Lazzaroni, R. (02 September 2008). Chiral Expression at the Solid-Liquid Interface: A Joint Experimental and Theoretical Study of the Self-Assembly of Chiral Porphyrins on Graphite. Langmuir, 24 (17), 9566-9574. doi:10.1021/la8017419
Peer Reviewed verified by ORBi

Athanasopoulos, S., Hennebicq, E., Beljonne, D., & Walker, A. B. (31 July 2008). Trap Limited Exciton Transport in Conjugated Polymers. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 112 (30), 11532-11538. doi:10.1021/jp802704z
Peer Reviewed verified by ORBi

Beljonne, D. (21 July 2008). Electronic Processes in Organic Material discussion Leader. Paper presented at Gordon Conference, 21/07/2008->25/07/2008, Mount Holyoke, United States.

Spano, F. C., Meskers, S. C. J., Hennebicq, E., & Beljonne, D. (14 July 2008). Using Circularly Polarized Luminescence to Probe Exciton Coherence in Disordered Helical Aggregates. Journal of Chemical Physics, 129 (2), 024704. doi:10.1063/1.2943647
Peer Reviewed verified by ORBi

Qin, W., Baruah, M., Sliwa, M., Van Der Auweraer, M., De Borggraeve, W. M., Beljonne, D., Van Averbeke, B., & Boens, N. (10 July 2008). Ratiometric, Fluorescent BODIPY Dye with Aza Crown Ether Functionality: Synthesis, Solvatochromism, and Metal Ion Complex Formation. Journal of Physical Chemistry. A, 112 (27), 6104-6114. doi:10.1021/jp800261v
Peer Reviewed verified by ORBi

Beljonne, D. (12 June 2008). Interfacial excited states at polymer semiconductor interfaces: experiment and theory. Paper presented at Conference 'Trends in Organic Electronics and Hybrid Photovoltaics, 12/06/2008->14/06/2008, Eforie, Romania.

Huang, Y. S., Westenhoff, S., Avilov, I. V., Sreearunothai, P., Hodgkiss, J. M., Deleener, C., Friend, R. H., & Beljonne, D. (01 June 2008). Electronic Structures of Interfacial States Formed at Polymeric Semiconductor Heterojunctions. Nature Materials, 7 (6), 483-489. doi:10.1038/nmat2182
Peer Reviewed verified by ORBi

Beljonne, D. (05 May 2008). Nature and Dynamics of charge and energy carriers in conjugated materials. Paper presented at Colloque Acfas 'Processus Physiques et chimiques associés aux surfaces, interfaces et nanostructures, 05/05/2008->06/05/2008, Québec, Canada.

Linares, M., Scifo, L., Demadrille, R., Brocorens, P., Beljonne, D., Lazzaroni, R., & Grevin, B. (01 May 2008). Two-Dimensional Self-Assemblies of Thiophene-Fluorenone Conjugated Oligomers on Graphite: A Joint STM and Molecular Modeling Study. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 112 (17), 6850-6859. doi:10.1021/jp711047x
Peer Reviewed verified by ORBi

Beljonne, D. (07 April 2008). Probing excitation delocalization in supramolecular chiral stacks by means of optical spectroscopy: Experiment and modeling. Paper presented at Conference SPIE Photonics Europe 'Organics Optoelectronics and Photonics, 07/04/2008->10/04/2008, Strasbourg, France.

Curutchet, C., Mennucci, B., Scholes, G. D., & Beljonne, D. (27 March 2008). Does Förster Theory Predict the Rate of Electronic Energy Transfer for a Model Dyad at Low Temperature ? Journal of Physical Chemistry B, 112 (12), 3759-3766. doi:10.1021/jp7106507
Peer Reviewed verified by ORBi

Aloshyna, M., Milian Medina, B., Poulsen, L., Moreau, J., Beljonne, D., Cornil, J., Di Silvestro, G., Cerminara, M., Meinardi, F., Tubino, R., Detert, H., Schrader, S., Egelhaaf, H. J., Botta, C., & Gierschner, J. (25 March 2008). Oligophenylenevinylenes in Spatially Confined Nanochannels: Monitoring Intermolecular Interactions by UV/Vis and Raman Spectroscopy. Advanced Functional Materials, 18 (6), 915-921. doi:10.1002/adfm.200700647
Peer Reviewed verified by ORBi

Castet, F., Aurel, P., Fritsch, A., Ducasse, L., Liotard, D., Linares, M., Cornil, J., & Beljonne, D. (24 March 2008). Electronic Polarization Effects on Charge Carriers in Anthracene: A Valence Bond Study. Physical Review. B, Condensed Matter, 77 (11), 115210, 1-14. doi:10.1103/PhysRevB.77.115210
Peer Reviewed verified by ORBi

Difley, S., Beljonne, D., & Van Voorhis, T. (19 March 2008). On the Singlet-Triplet Splitting of Geminate Electron-Hole Pairs in Organic Semiconductors. Journal of the American Chemical Society, 130 (11), 3420-3427. doi:10.1021/ja076125m
Peer Reviewed verified by ORBi

Beigbeder, A., Linares, M., Devalckenaere, M., Degée, P., Claes, M., Beljonne, D., Lazzaroni, R., & Dubois, P. (01 March 2008). CH-p interactions as the driving force for silicone-based nanocomposites with exceptional rheological and thermal properties. Advanced Materials, 20 (5), 1003-1007. doi:10.1002/adma.200701497
Peer reviewed

Dkhissi, A., Beljonne, D., Lazzaroni, R., Louwet, F., & Groenendaal, B. (01 March 2008). Modeling of the Solid-State Packing of Charged Chains (PEDOT) in the Presence of the Counterions (TSA) and the Solvent (DEG). Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 119 (4), 305-312. doi:10.1007/s00214-007-0384-5
Peer Reviewed verified by ORBi

Bacchiocchi, C., Hennebicq, E., Orlandi, S., Muccioli, L., Beljonne, D., & Zannoni, C. (14 February 2008). Reduced Distributed Monopole Model for the Efficient Prediction of Energy Transfer in Condensed Phases. Journal of Physical Chemistry B, 112 (6), 1752-1760. doi:10.1021/jp076732w
Peer Reviewed verified by ORBi

Van Averbeke, B., Beljonne, D., & Hennebicq, E. (11 February 2008). Energy Transport along Conjugated Polymer Chains: Through-Space or Through-Bond? Advanced Functional Materials, 18 (3), 492-498. doi:10.1002/adfm.200700574
Peer Reviewed verified by ORBi

Ahn, T. S., Müller, A. M., Al-Kaysi, R. O., Spano, F. C., Norton, J. E., Beljonne, D., & Brédas, J.-L. (07 February 2008). Experimental and Theoretical Study of Temperature Dependent Exciton Delocalization and Relaxation in Anthracene Thin Films. Journal of Chemical Physics, 128 (5), 054505. doi:10.1063/1.2822310
Peer Reviewed verified by ORBi

Brédas, J.-L., Cornil, J., Beljonne, D., Lazzaroni, R., & Leclère, P. (2008). Molekulare Electronik/ Neuroelektronik/ Verformbare elektronische Werkstoffe/ Herstellung von Nanostrukturen. In Nanotechnologie edited by M.Wautelet (Oldenbourg Verlag) (pp. 81-166).

Viville, P., Godfroid, T., Dauchot, J.-P., Cornil, J., Beljonne, D., & Lazzaroni, R. (01 January 2008). Surfaces Plastiques Berceaux de Lumière Surfaces Plastiques Moissonneuses de Lumière. Élement: le Magazine de l'Université de Mons, 1, 11-12.

Daniel, C., Westenhoff, S., Makereel, F., Friend, R. H., Beljonne, D., Herz, L. M., & Silva, C. (27 December 2007). Monte Carlo Simulation of Exciton Bimolecular Annihilation Dynamics in Supramolecular Semiconductor Architectures. Journal of Physical Chemistry. C, Nanomaterials and interfaces, 111 (51), 19111-19119. doi:10.1021/jp0573644
Peer Reviewed verified by ORBi

Schmidt, K., Brovelli, S., Coropceanu, V., Beljonne, D., Cornil, J., Bazzini, C., Caronna, T., Tubino, R., Meinardi, F., Shuai, Z., & Brédas, J.-L. (25 October 2007). Intersystem Crossing Processes in Non-Planar Aromatic Heterocyclic Molecules. Journal of Physical Chemistry. A, 111 (42), 10490-10499. doi:10.1021/jp075248q
Peer Reviewed verified by ORBi

Margineanu, A., Hotta, J. I., Van Der Auweraer, M., Ameloot, M., Stefan, A., Beljonne, D., Engelborghs, Y., Herrmann, A., Müllen, K., De Schryver, F. C., & Hofkens, J. (15 October 2007). Visualization of Membrane Rafts Using a Perylene Monoimide Derivative and Fluorescence Lifetime Imaging. Biophysical Journal, 93 (8), 2877-2891. doi:10.1529/biophysj.106.100743
Peer Reviewed verified by ORBi

Beljonne, D. (02 October 2007). Singlet excitation transport in conjugated materials: Beyond Förster. Paper presented at Workshop on Energy flow dynamics in biomaterial systems, 02/10/2007->05/10/2007, Paris, France.

Beljonne, D. (17 September 2007). Probing excitation delocalization in supramolecular stacks by means of optical spectroscopy. Paper presented at International Conference 'Chirality at the nanoscale, 17/09/2007->21/09/20017, Sitges, Spain.

Qin, W., Rohand, T., Dehaen, W., Clifford, J. N., Driesen, K., Beljonne, D., Van Averbeke, B., Van Der Auweraer, M., & Boens, N. (06 September 2007). Boron Dipyrromethene Analogs with Phenyl, Styryl, and Ethynylphenyl Substituents: Synthesis, Photophysics, Electrochemistry, and Quantum-Chemical Calculations. Journal of Physical Chemistry. A, 111 (35), 8588-8597. doi:10.1021/jp073547+
Peer Reviewed verified by ORBi

Fron, E., Schweitzer, G., Jacob, J., Van Vooren, A., Beljonne, D., Müllen, K., Hofkens, J., Van Der Auweraer, M., & De Schryver, F. C. (25 June 2007). Singlet-Singlet Annihilation Leading to a Charge-Transfer Intermediate in Chromophore-End-Capped Pentaphenylenes. Chemphyschem: A European Journal of Chemical Physics and Physical Chemistry, 8 (9), 1386-1393. doi:10.1002/cphc.200700136
Peer Reviewed verified by ORBi

Spano, F. C., Meskers, S. C. J., Hennebicq, E., & Beljonne, D. (06 June 2007). Probing Excitation Delocalization in Supramolecular Chiral Stacks by Means of Circularly Polarized Light: Experiment and Modeling. Journal of the American Chemical Society, 129 (22), 7044-7054. doi:10.1021/ja067321g
Peer Reviewed verified by ORBi

Van Vooren, A., Lemaur, V., Ye, A., Beljonne, D., & Cornil, J. (04 June 2007). Impact of Bridging Units on the Dynamics of Charge Generation and Recombination in Organic Solar Cells. Chemphyschem: A European Journal of Chemical Physics and Physical Chemistry, 8 (8), 1240-1249. doi:10.1002/cphc.200700130
Peer Reviewed verified by ORBi

Vallée, R. A. L., Baruah, M., Hofkens, J., De Schryver, F. C., Boens, N., Van Der Auweraer, M., & Beljonne, D. (14 May 2007). Fluorescence Lifetime Fluctuations of Single Molecules Probe the Local Environment of Oligomers around the Glass Transition Temperature. Journal of Chemical Physics, 126 (18), 184902. doi:10.1063/1.2728902
Peer Reviewed verified by ORBi

Bell, T. D. M., Stefan, A., Lemaur, V., Bernhardt, S., Müllen, K., Cornil, J., Beljonne, D., Hofkens, J., Van Der Auweraer, M., & De Schryver, F. C. (01 May 2007). Non-conjugated, Phenyl Assisted Coupling in Through Bond Electron Transfer in a Perylenemonoimide-Triphenylamine System. Photochemical and Photobiological Sciences, 6 (4), 406-415. doi:10.1039/B617913D
Peer Reviewed verified by ORBi

Beljonne, D. (25 March 2007). Nature and dynamics of electronic excitations in conjugated polymers. Paper presented at ACS conference, '30 years of conducting polymers, Chicago, United States - Illinois.

B. Milian Medina, B., Beljonne, D., Egelhaaf, H. J., & Gierschner, J. (15 March 2007). Effect of Fluorination on the Electronic Structure and Optical Excitations of p-Conjugated Molecules. Journal of Chemical Physics, 126 (11), 111101, 1-6. doi:10.1063/1.2713096
Peer Reviewed verified by ORBi

Feast, W. J., Cacialli, F., Koch, A. T. H., Daik, R., Lartigau, C., Friend, R. H., Beljonne, D., & Brédas, J.-L. (07 March 2007). Control of Luminescence in Conjugated Polymers Through Control of Chain Microstructure. Journal of Materials Chemistry B, 17 (9), 907-912. doi:10.1039/B615408P
Peer reviewed

Fron, E., Bell, T. D. M., Van Vooren, A., Schweitzer, G., Cornil, J., Beljonne, D., Toele, P., Jacob, J., Müllen, K., Hofkens, J., Van Der Auweraer, M., & De Schryver, F. C. (24 January 2007). CT-CT Annihilation in Rigid Perylene End-Capped Pentaphenylenes. Journal of the American Chemical Society, 129 (3), 610-619. doi:10.1021/ja064794e
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Coropceanu, V., da Silva Filho, D. A., Geskin, V. M., Lazzaroni, R., Leclère, P., & Brédas, J.-L. (2007). On the Transport, Optical, and Self-Assembly Properties of pi-Conjugated Materials: A Combined Theoretical/Experimental Insight. In Handbook of Conducting Polymers (pp. 1-46). Boca Raton, United States: CRC Press.

Poulsen, L., Jazdzyk, M., Communal, J. E., Sancho-Garcia, J. C., Mura, A., Bongiovanni, G., Beljonne, D., Cornil, J., Hanack, M., Egelhaaf, H. E., & Gierschner, J. (01 January 2007). Three-Dimensional Energy Transport in Highly Luminescent Condensed Media: A Combined Quantitative Experimental and Theoretical Study. Journal of the American Chemical Society, 129, 8585-8593.
Peer Reviewed verified by ORBi

Brédas, J.-L., Cornil, J., Beljonne, D., Lazzaroni, R., & Leclère, P. (2007). L'électronique Moléculaire/ La Neuroélectronique/ L'Electronique Plastique/ Fabrication des Nanostructures. In A. Decroly, R. Lazzaroni, & M. Wautelet (Ed.), Les Nanotechnologies Deuxième édition edited by M. Wautelet (Dunod) (pp. 75-167). DUNOD.

Beljonne, D., & Cornil, J. (01 January 2007). Les Senseurs Chimiques et Biologiques Basés sur des Polymères Conjugués. Chimie Nouvelle, 96, 85-91.
Peer reviewed

Cornil, J., Beljonne, D., & Lazzaroni, R. (01 January 2007). Les Ecrans d'Affichage Flexibles. Journal des Ingénieurs, 103, 6-12.
Peer reviewed

Beljonne, D., & Cornil, J. (10 September 2006). Senseurs Chimiques et Biologiques Basés sur des Polymères Conjugués. Techniques de l'Ingénieur, RE69, 1-13.
Peer reviewed

Beljonne, D. (13 August 2006). A short glimpse into polarization effects: Theory and applications. Poster session presented at Gordon Conference on 'Electron Donor Acceptor Interactions, 13/08/2006->17/08/2006, Salve Regina, United States - Rhode Island.

Hennebicq, E., Deleener, C., Brédas, J.-L., Scholes, G. D., & Beljonne, D. (07 August 2006). Chromophores in Phenylenevinylene-Based Conjugated Polymers: Role of Conformational Kinks and Chemical Defects. Journal of Chemical Physics, 125 (5), 054901. doi:10.1063/1.2221310
Peer Reviewed verified by ORBi

Zhu, L., Yi, Y., Shuai, Z., Brédas, J.-L., Beljonne, D., & Zojer, E. (28 July 2006). Structure-Property Relationships for Three-Photon Absorption in Stilbene-Based Dipolar and Quadrupolar Chromophores. Journal of Chemical Physics, 125 (4), 044101. doi:10.1063/1.2216699
Peer Reviewed verified by ORBi

Engel, E., Schmidt, K., Beljonne, D., Brédas, J.-L., Assa, J., Fröb, H., Leo, K., & Hoffmann, M. (29 June 2006). Transient Absorption Spectroscopy and Quantum-Chemical Studies of Matrix-Isolated Perylene Derivatives. Physical Review. B, Condensed Matter, 73 (24), 245216. doi:10.1103/PhysRevB.73.245216
Peer Reviewed verified by ORBi

Baruah, M., Qin, W., Flors, C., Hofkens, J., Vallée, R. A. L., Beljonne, D., Van Der Auweraer, M., De Borggraeve, W. M., & Boens, N. (11 May 2006). Solvent and pH Dependent Fluorescent Properties of a Dimethylaminostyryl Borondipyrromethene Dye in Solution. Journal of Physical Chemistry. A, 110 (1855), 5998-6009. doi:10.1021/jp054878u
Peer Reviewed verified by ORBi

Hukka, T. I., Hoivonen, T., Hennebicq, E., Brédas, J.-L., Janssen, R. A. J., & Beljonne, D. (01 May 2006). Pathways for Resonant Energy Transfer in Oligo(phenylenevinylene)-Fullerene Dyads: An Atomistic Model. Advanced Materials, 18 (10), 1301-1306. doi:10.1002/adma.200600155
Peer reviewed

Beljonne, D. (03 April 2006). Energy transport in conjugated polymers: an atomistic model. Paper presented at Photonics Europe Symposium 'Organics Opto-electronics and Photonics', 03/04/2006->07/04/2006, Strasbourg, France.

Sreearunothai, P., Morteani, A. C., Avilov, I. V., Cornil, J., Beljonne, D., Friend, R. H., Phillips, R. T., Silva, C., & Herz, L. M. (24 March 2006). Influence of Copolymer Interface Orientation on the Optical Emission of Polymeric Semiconductor Heterojunctions. Physical Review Letters, 96 (11), 117403. doi:10.1103/PhysRevLett.96.117403
Peer Reviewed verified by ORBi

Burquel, A., Lemaur, V., Beljonne, D., Lazzaroni, R., & Cornil, J. (16 March 2006). Pathways for Photoinduced Charge Generation and Recombination at Donor-Acceptor Heterojunctions: The Case of Oligophenylenevinylene-Perylene Bisimide Complexes. Journal of Physical Chemistry. A, 110 (10), 3447-3453. doi:10.1021/jp055719d
Peer Reviewed verified by ORBi

Wiesenhofer, H., Zojer, E., List, E. J. W., Scherf, U., Brédas, J.-L., & Beljonne, D. (01 February 2006). Molecular Origin of the Temperature-Dependent Energy Migration in a Rigid-Rod Ladder-Phenylene Molecular Host. Advanced Materials, 18 (3), 310-314. doi:10.1002/adma.200501473
Peer reviewed

Beckers, E. H. A., Meskers, S. C. J., Schenning, A. P. H. J., Chen, Z., Würthner, F., Marsal, P., Beljonne, D., Cornil, J., & Janssen, R. A. J. (18 January 2006). The Influence of the Intermolecular Orientation on the Photoinduced Charge Transfer Kinetics in Self-Assembled Aggregates of Donor-Acceptor Arrays. Journal of the American Chemical Society, 128 (2), 649-657. doi:10.1021/ja0568042
Peer Reviewed verified by ORBi

Beljonne, D. (27 November 2005). Nature and dynamics of electronic excitations in conjugated polymers and energy migration in conjugated materials: an tomistic picture. Paper presented at 2005 MRS Fall Meeting, 27/11/2005->02/12/2005, Boston, United States - Massachusetts.

Coe, B. J., Beljonne, D., Vogel, H., Garin, J., & Orduna, J. (10 November 2005). Theoretical Analyses of the Effects on the Linear and Quadratic Nonlinear Optical Properties of N-Arylation of Pyridinium Groups in Stilbazonium Dyes. Journal of Physical Chemistry. A, 109 (44), 10052-10057. doi:10.1021/jp053721z
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Lazzaroni, R. (10 November 2005). Les Ecrans d'Affichage Enroulables. Techniques de l'Ingenieur, IN-22, 1-7.

Tant, J., Geerts, Y., Lehmann, M., De Cupere, V., Zucchi, G., Laursen, B. W., Björnholm, T., Lemaur, V., Marcq, V., Burquel, A., Hennebicq, E., Gardebien, F., Viville, P., Beljonne, D., Lazzaroni, R., & Cornil, J. (03 November 2005). Liquid Crystalline Metal-Free Phthalocyanines Designed for Charge and Exciton Transport. Journal of Physical Chemistry B, 109 (43), 20315-20323. doi:10.1021/jp054778o
Peer Reviewed verified by ORBi

Geskin, V. M., Grozema, F. C., Siebbeles, L. D. A., Beljonne, D., Brédas, J.-L., & Cornil, J. (03 November 2005). Impact of the Computational Method on the Geometric and Electronic Properties of Oligo(phenylenevinylene)s Radical Cations. Journal of Physical Chemistry B, 109 (43), 20237-20243. doi:10.1021/jp0519417
Peer Reviewed verified by ORBi

Gierschner, J., Ehni, M., Egelhaaf, H. J., Milian Medina, B., Beljonne, D., Benmansour, H., & Bazan, G. C. (08 October 2005). Solid-State Optical Properties of Linear Polyconjugated Molecules: p-Stack Contra Herringbone. Journal of Chemical Physics, 123 (14), 144914. doi:10.1063/1.2062028
Peer Reviewed verified by ORBi

Baruah, M., Qin, W., Vallée, R. A. L., Beljonne, D., Rohand, T., Dehaen, W., & Boens, N. (29 September 2005). A Highly Potassium-Selective Ratiometric Fluorescent Indicator Based on BODIPY Azacrown Ether Excitable with Visible Light. Organic Letters, 7 (20), 4377-4380. doi:10.1021/ol051603o
Peer Reviewed verified by ORBi

Beljonne, D. (18 September 2005). Nature and Dynamics of charge and energy carriers in conjugated materials. Paper presented at International Polymer Materials Engineering Conference, IPMEC'05, 18/09/2005->21/09/2005, Shanghai, China.

Vallée, R. A. L., Marsal, P., Braeken, E., Habuchi, S., De Schryver, F. C., Van Der Auweraer, M., Beljonne, D., & Hofkens, J. (31 August 2005). Single Molecule Spectroscopy as a Probe for Dye-Polymer Interactions. Journal of the American Chemical Society, 127 (34), 12011-12020. doi:10.1021/ja051016y
Peer Reviewed verified by ORBi

Beljonne, D., Hennebicq, E., Daniel, C., Herz, L. M., Silva, C., Scholes, G. D., Hoeben, F. J. M., Jonkheijm, P., Schenning, A. P. H. J., Meskers, S. C. J., Phillips, R. T., Friend, R. H., & Meijer, E. W. (02 June 2005). Excitation Migration along Oligophenylenevinylene-based Chiral Stacks: Delocalization Effects on Transport Dynamics. Journal of Physical Chemistry B, 109 (21), 10594-10604. doi:10.1021/jp050792p
Peer Reviewed verified by ORBi

Lim, S., Friend, R. H., Rees, I. D., Li, J., Ma, Y., Robinson, K., Holmes, A. B., Hennebicq, E., Beljonne, D., & Cacialli, F. (01 June 2005). Suppression of Green Emission in a New Class of Blue-Emitting Polyfluorene Copolymers with Twisted Biphenyl Moeities. Advanced Functional Materials, 15 (6), 981-988. doi:10.1002/adfm.200400457
Peer Reviewed verified by ORBi

Beljonne, D., Shuai, Z., Ye, A., & Brédas, J.-L. (01 May 2005). Charge-Recombination Processes in Oligomer- and Polymer-Based Light-Emitting Diodes: A Molecular Picture. Journal of the Society for Information Display, 13 (5), 419-427. doi:10.1889/1.1927734
Peer Reviewed verified by ORBi

Lemaur, V., Steel, M. C., Beljonne, D., Brédas, J.-L., & Cornil, J. (27 April 2005). Photoinduced Charge Generation and Recombination Dynamics in Model Donor/Acceptor Pairs for Solar Cell Applications: A Full Quantum-Chemical Treatment. Journal of the American Chemical Society, 127 (16), 6077-6086. doi:10.1021/ja042390l
Peer Reviewed verified by ORBi

Beljonne, D. (22 April 2005). Polymer-based (bio) chemical sensors. Paper presented at NanoWal conference 'Theoretical Modeling at the Heart of nanotechnologies, Mons, Belgium.

Hennebicq, E., Pourtois, G., Scholes, G. D., Herz, J. M., Russell, D. M., Silva, C., Setayesh, S., Grimsdale, A. C., Müllen, K., Brédas, J.-L., & Beljonne, D. (06 April 2005). Exciton Migration in Rigid-Rod Conjugated Polymers: An Improved Förster Model. Journal of the American Chemical Society, 127 (12), 4744-4762. doi:10.1021/ja0488784
Peer Reviewed verified by ORBi

Ford, T. A., Avilov, I. V., Beljonne, D., & Greenham, N. C. (29 March 2005). Enhanced Triplet Exciton Generation in Polyfluorene Blends. Physical Review. B, Condensed Matter, 71 (12), 125212-125218. doi:10.1103/PhysRevB.71.125212
Peer Reviewed verified by ORBi

Sancho Garcia, J. C., Brédas, J.-L., Beljonne, D., Cornil, J., Martinez-Alvarez, R., Hanack, M., Poulsen, L., Gierschner, J., Mack, H. G., Egelhaaf, H. J., & Oelkrug, D. (24 March 2005). Design of p-Conjugated Organic Materials for One-Dimensional Energy Transport in Nanochannels. Journal of Physical Chemistry B, 109 (11), 4872-4880. doi:10.1021/jp045364i
Peer Reviewed verified by ORBi

Wasserberg, D., Marsal, P., Meskers, S. C. J., Janssen, R. A. J., & Beljonne, D. (17 March 2005). Phosphorescence and Triplet State Energies of Oligothiophenes. Journal of Physical Chemistry B, 109 (10), 4410-4415. doi:10.1021/jp0457085
Peer Reviewed verified by ORBi

Heimel, G., Daghofer, M., Gierschner, J., List, E. J. W., Grimsdale, A. C., Müllen, K., Beljonne, D., Brédas, J.-L., & Zojer, E. (01 February 2005). Breakdown of the Mirror Image Symmetry in the Optical Absorption/Emission Spectra of Oligo(para-phenylen)s. Journal of Chemical Physics, 122 (5), 054501-1 - 054501-11. doi:10.1063/1.1839574
Peer Reviewed verified by ORBi

Vallée, R. A. L., Van Der Auweraer, M., De Schryver, F. C., Beljonne, D., & Orrit, M. (14 January 2005). A Microscopic Model for the Fluctuations of Local Field and Spontaneous Emission of Single Molecules in Disordered Media. Chemphyschem: A European Journal of Chemical Physics and Physical Chemistry, 6 (1), 81-91. doi:10.1002/cphc.200400439
Peer Reviewed verified by ORBi

Cornil, J., Lemaur, V., Steel, M. C., Dupin, H., Burquel, A., Beljonne, D., & Brédas, J.-L. (2005). Electronic Structure of Organic Photovoltaic Materials: Modelling of Exciton Dissociation and Charge Recombination Processes. In Organic Photovoltaics: Mechanisms, Materials, and Devices (pp. 161-182).

Wiesenhofer, H., Hennebicq, E., Beljonne, D., Brédas, J.-L., & Zojer, E. (01 January 2005). Limitations of the Förster Description of Singlet Exciton Migration: the Illustrative Example of Energy Transfer to Ketonic Defects in Ladder Type Poly(para-phenylenes). Advanced Functional Materials, 15 (1), 155-160. doi:10.1002/adfm.200400108
Peer Reviewed verified by ORBi

Brédas, J.-L., Beljonne, D., Coropceanu, V., & Cornil, J. (01 October 2004). Electro-Active PI-Conjugated Oligomers and Polymers: A Molecular Picture of Charge-Transfer Processes. Educación Química, 15, 61-69.
Peer Reviewed verified by ORBi

Beljonne, D. (27 September 2004). Organic conjugated materials: from fundamentals to applications. Paper presented at Cintelliq - OSC - 04 Workshop on Organic Semiconductors, 27/09/2004->28/09/2004, Cambridge, United Kingdom.

Ye, A., Shuai, Z., Kwon, O., Brédas, J.-L., & Beljonne, D. (22 September 2004). Optical Properties of Singly Charged Conjugated Oligomers: A Coupled-Cluster Equation of Motion Study. Journal of Chemical Physics, 121, 5567-5578.
Peer Reviewed verified by ORBi

Beljonne, D. (22 September 2004). Energy transfer in conjugated polymers, molecules and clusters: an atomistic model. Paper presented at Symposium 'Frontiers in Polymer Science22/09/2004->24/09/2004, Leuven, Belgium.

Avilov, I., Marsal, P., Brédas, J.-L., & Beljonne, D. (16 September 2004). Quantum-chemical design of host materials for full-color triplet emission. Advanced Materials, 16, 1624-1629.
Peer reviewed

Zhu, L., Yang, X., Yi, Y., Xuan, P., Shuai, Z., Chen, D., Zojer, E., Brédas, J.-L., & Beljonne, D. (15 September 2004). Three-photon absorption in anthracene-porphyrin-anthracene triads: a quantum-chemical study. Journal of Chemical Physics, 121, 11060-11067.
Peer Reviewed verified by ORBi

Masuo, S., Vosch, T., Cotlet, M., Tinnefeld, P., Habuchi, S., Bell, T. D. M., Oesterling, I., Beljonne, D., Champagne, B., Müllen, K., Sauer, M., Hofkens, J., & De Schryver, F. C. (03 August 2004). Multichromophoric dendrimers as single photon sources: A single molecule study. Journal of Physical Chemistry B, 108, 16686-16696.
Peer Reviewed verified by ORBi

Beljonne, D. (25 July 2004). Energy transfer in conjugated polymers and supramolecular assemblies: An improved Förster model. Paper presented at Gordon conference 'Electronic Processes in Organic Materials, 25/07/2004->30/07/2004, Mount Holyoke College, South Hadley, United States.

Beljonne, D. (05 July 2004). Pathways for singlet excitation transfer in conjugated polymers. Paper presented at MACRO 2004 'Polymers for energy, electronic, optoelectronic and optical applications, 05/07/2004->10/07/2004, Paris, France.

Beljonne, D., Ye, A., Shuai, Z., & Brédas, J.-L. (01 July 2004). Chain-Lenght Dependence of Singlet and Triplet Formation Rates in Organic Light-Emitting Diodes. Advanced Functional Materials, 14, 684-692.
Peer Reviewed verified by ORBi

Marsal, P., Avilov, I., da Silva Filho, D. A., Brédas, J.-L., & Beljonne, D. (19 June 2004). Molecular Hosts for Triplet Emission in Light Emitting Diodes: A Quantum-Chemical Study. Chemical Physics Letters, 392, 521-528.
Peer Reviewed verified by ORBi

Daniel, C., Herz, L. M., Beljonne, D., Hoeben, F. J. M., Jonkheijm, P., Schenning, A. P. H. J., Meijer, E. W., Phillips, R. T., & Silva, C. (02 June 2004). Resonance Energy Transfer Dynamics in Hydrogen-Bonded Oligo-p-phenylenevinylene Nanostructures. Synthetic Metals, 147, 29-35.
Peer Reviewed verified by ORBi

Beljonne, D. (24 May 2004). Exciton formation and dissociation in conjugated polymers: a quantum-chemical view. Paper presented at E-MRS spring meeting 2004 'Supramolecular Approaches to Organic Electronics and Nanotechnology, Strasbourg, France.

Beljonne, D. (31 March 2004). Organic conjugated materials: from fundamentals to applications. Paper presented at Journées thématiques de Chimie Théorique, 31/03/2004->01/04/2004, Marseille, France.

Zojer, E., Beljonne, D., Pacher, P., & Brédas, J.-L. (01 January 2004). Two-Photon Absorption in Quadrupolar PI-Conjugated Molecules: Influence of the Nature of the Conjugated Bridge and the Donor-Acceptor Separation. Chemistry, 10, 2668-2680.
Peer Reviewed verified by ORBi

Sancho Garcia, J. C., Poulsen, L., Gierschner, J., Martinez-Alvarez, R., Hennebicq, E., Hanack, M., Egelhaaf, H. E., Oelkrug, D., Beljonne, D., Brédas, J.-L., & Cornil, J. (01 January 2004). Theoretical Characterization and Design of End-substituted Distyrylbenzenes as Excitation Shuttles in One-dimensional Channels. Advanced Materials, 16, 1193-1197.
Peer reviewed

Brédas, J.-L., Beljonne, D., Coropceanu, V., & Cornil, J. (01 January 2004). Charge-Transfer and Energy-Transfer Processes in PI-Conjugated Oligomers and Polymers: A Molecular Description. Chemical Reviews, 104, 4971-5003.
Peer Reviewed verified by ORBi

Köhler, A., & Beljonne, D. (01 January 2004). The singlet-triplet exchange energy in conjugated polymers. Advanced Functional Materials, 14, 11-18.
Peer Reviewed verified by ORBi

Dkhissi, A., Beljonne, D., Lazzaroni, R., & Brédas, J.-L. (01 January 2004). The effects of sulfon on the structural and optical properties in the low-bandgap polymer poly(3,4-ethylenedioxythiophene. Journal of Molecular Structure: Theochem, 709, 195-199.
Peer Reviewed verified by ORBi

Pourtois, G., Beljonne, D., Moucheron, C., Schumm, S., Kirsch-De Mesmaeker, A., Lazzaroni, R., & Brédas, J.-L. (01 January 2004). Photophysical Properties of Ruthenium (II) Polyzaazomatic Compunds: A Theoretical Insight. Journal of the American Chemical Society, 126, 683-692.
Peer Reviewed verified by ORBi

Beljonne, D. (15 September 2003). Quantum-chemical modelling of photoinduced charge separation and energy transfer in conjugated materials. Paper presented at CECAM conference 'Modelling Electronic Processes in Molecular Scale Devices, 15/09/2003->17/09/2003, co-organizer of the conference, Lyon, France.

Beljonne, D. (10 September 2003). Intra and inter chain energy transfer in an end-capped conjugated polymer. Paper presented at European Conference on Molecular Electronics 'ECME'7', 10/09/2003->14/09/2003, Avignon, France.

Fang, Y., Gao, S., Yang, X., Shuai, Z., & Beljonne, D. (08 September 2003). Charge-Transfer States and White Emission in Organic Light-Emitting Diodes: A Theoretical Investigation. Synthetic Metals, 141, 43-49.
Peer Reviewed verified by ORBi

Beljonne, D. (11 August 2003). Quantum-chemical modelling of charge and energy transfer in supramolecular assemblies. Paper presented at Conference 'Excited state processes in electronic and bio nano-materials, 11/08/2003->16/08/2003, Los Alamos, United States - New Mexico.

Beljonne, D. (17 June 2003). Intra- and inter-chain energy transfer in an end-capped conjugated polymer. Paper presented at Workshop 'Optical Spectroscopy of Conjugated Polymers and Molecules, Sheffield, United Kingdom.

Beljonne, D. (17 June 2003). Intra and inter chain energy transfer in an end-capped conjugated polymer. Paper presented at Workshop 'Optical Spectroscopy of conjugated polymers and molecules, Sheffield, United Kingdom.

Beljonne, D. (14 April 2003). A semiempirical Exciton Approach for the Optical Propertyies of Crystals. Paper presented at Workshop 'Exciting 2003', 14/04/2003->16/04/2003, Louvain-la-Neuve, Belgium.

Lemaur, V., Hennebicq, E., Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 2003). Quantum Chemistry as a Tool to Probe Electronic and Optical Processes in Organic Materials. Chimie Nouvelle, 82, 73-78.

Cornil, J., Gueli, I., Dkhissi, A., Sancho Garcia, J. C., Hennebicq, E., Calbert, J. P., Lemaur, V., Beljonne, D., & Brédas, J.-L. (01 January 2003). Electronic and Optical Properties of Polyfluorene and Fluorene-Based Copolymers: A Quantum-Chemical Characterization. Journal of Chemical Physics, 118, 6615-6623.
Peer Reviewed verified by ORBi

Sun, H., Zhao, Z., Spano, F. C., Beljonne, D., Cornil, J., Shuai, Z., & Brédas, J.-L. (01 January 2003). Absorption and Emission in Quaterthienyl Thin Films. Advanced Materials, 15, 818-822.
Peer reviewed

Neuteboom, E. E., Meskers, S. C. J., van Hal, P. A., van Duren, J. K. J., Meijer, E. W., Janssen, R. A. J., Dupin, H., Pourtois, G., Cornil, J., Lazzaroni, R., Brédas, J.-L., & Beljonne, D. (01 January 2003). Alternating Oligo(p-phenylene vinylene) - Perylene Bisimide Copolymers: Synthesis, Photophysics, and Photovoltaic Properties of a New Class of Donor-Acceptor Materials. Journal of the American Chemical Society, 125, 8625-8638.
Peer Reviewed verified by ORBi

Brédas, J.-L., Cornil, J., Beljonne, D., Lazzaroni, R., & Leclère, P. (2003). L'Electronique Moléculaire / La Neuroélectronique / L'Electronique Plastique / Fabrication des Nanostructures. In M. Wautelet (Ed.), Les Nanotechnologies (pp. 75-154). Dunod 2014.

Beljonne, D. (21 July 2002). Exctation transfer in a conjugated polymer end-capped with perylene guest molecules and charge transfer in conjugated molecular wires and DNA: a theoretical insight. Poster session presented at Gordon conference on electronic processes in organic materials, 21/07/2002->26/07/2002, Salve Regina University, Newport, United States - Rhode Island.

Brédas, J.-L., Beljonne, D., Cornil, J., Calbert, J. P., Shuai, Z., & Silbey, R. (01 January 2002). Electronic Structure of pi-conjugated Oligomers and Polymers: A Quantum-Chemical Approach to Transport Properties. Synthetic Metals, 125, 107-116.
Peer Reviewed verified by ORBi

Pourtois, G., Beljonne, D., Cornil, J., Ratner, M. A., & Brédas, J.-L. (01 January 2002). Photoinduced Electron-Transfer Processes Along Molecular Wires Based on Phenylenevinylene Oligomers: A Quantum-Chemical Insight. Journal of the American Chemical Society, 124, 4436-4447.
Peer Reviewed verified by ORBi

Beljonne, D. (16 December 2001). Two-photon Absorption of conjugated materials: role of symmetry and dimensionality. Paper presented at International Conference on nonlinear optics, ICONO'6, Tucson, United States - Arizona.

Beljonne, D. (19 January 2001). Charge generation and transport in organic materials: a quantum-chemical flavor. Paper presented at Organic Photonic Materials and Devices III- SPIE's symposium on integrated optics, 19/01/2001->25/01/2001, San José, United States.

Beljonne, D., Perry, J. W., Marder, S. R., & Brédas, J.-L. (01 January 2001). Quantum-chemical design of two-photon absorbing organic chromophores. Nonlinear Optics, Quantum Optics: Concepts in Modern Optics, 27, 47-63. doi:10.1088/1748-0221/5/03/T03014
Peer Reviewed verified by ORBi

Cornil, J., Calbert, J. P., Beljonne, D., Silbey, R., & Brédas, J.-L. (01 January 2001). Interchain Interactions in pi-Conjugated Oligomers and Polymers: A Primer. Synthetic Metals, 119, 1-6.
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Calbert, J. P., & Brédas, J.-L. (01 January 2001). Charge Transport in Conjugated Materials: Insight from Quantum-Chemical Calculations. Proceedings of SPIE: The International Society for Optical Engineering, 4279, 147-152.

Beljonne, D., Shuai, Z., Cornil, J., Calbert, J. P., & Brédas, J.-L. (01 January 2001). On the Luminescence Efficiency of Polymer Light-Emitting Diodes: A Quantum-chemical Investigation. Journal of Photochemistry and Photobiology A: Chemistry, 144, 57-62.
Peer Reviewed verified by ORBi

Beljonne, D., Shuai, Z., Cornil, J., Dos Santos, D. A., & Brédas, J.-L. (2001). On the Nature of Electronic Excitations in Luminescent Conjugated Polymers: A Quantum-Chemical Flavor. In Encyclopedia of Materials: Science and Technology, Elsevier Science (pp. 7943-7947). Elsevier Science.

Beljonne, D., Cornil, J., Sirringhaus, H., Brown, P. J., Shkunov, M., Friend, R. H., & Brédas, J.-L. (01 January 2001). Optical Signature of Delocalized Polarons in Conjugated Polymers. Advanced Functional Materials, 11, 229-234.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Calbert, J. P., & Brédas, J.-L. (01 January 2001). Interchain Interactions in Organic pi-Conjugated Materials: Impact on Electronic Structure, Optical Response, and Charge Transport. Advanced Materials, 13, 1053-1067.
Peer reviewed

Hendrickx, E., Van Steenwinckel, D., Samyn, C., Beljonne, D., Brédas, J.-L., & Persoons, A. (01 October 2000). Effect of the Chromophore Donor Group and Ferrocene Doping on the Dynamic Range, Gain, and Phase Shift in Photorefractive Polymers. Journal of Chemical Physics, 113, 5439-5447.
Peer Reviewed verified by ORBi

Muccini, M., Schneider, M., Taliani, C., Sokolowski, M., Umbach, E., Beljonne, D., Cornil, J., & Brédas, J.-L. (01 September 2000). Effect of Wave-Function Delocalization on the Exciton Splitting in Organic Conjugated Materials. Physical Review. B, Condensed Matter, 62, 6296-6300.
Peer Reviewed verified by ORBi

Beljonne, D. (02 July 2000). Two-photon absorption in conjugated materials: role of molecular dimensionality. Paper presented at Second International Symposium on Optical Power Limiting, 02/07/2000->05/02/2000, Venice, Italy.

Beljonne, D. (04 May 2000). Charge separation and recombination in conjugated polymers: a quantum-chemical flavor. Paper presented at Symposium 'Photoionisation and charge transfer in large molecules, clusters and condensed matter, München, Germany.

Cornil, J., Calbert, J. P., Beljonne, D., Silbey, R., & Brédas, J.-L. (07 April 2000). Charge Transport versus Optical Properties in Semiconducting Crystalline Organic Thin Films. Advanced Materials, 12, 978-983.
Peer reviewed

Beljonne, D., Cornil, J., Silbey, R., Millié, P., & Brédas, J.-L. (08 March 2000). Interchain Interactions in Conjugated Materials: The Exciton Model Versus the supermolecular Approach. Journal of Chemical Physics, 112, 4749-4758.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Dos Santos, D. A., Calbert, J. P., Shuai, Z., & Brédas, J.-L. (2000). A Theoretical Insight into the Solid-State Optical Properties of Luminescent Materials: The Supermolecular Approach. Comptes Rendus de l'Académie des Sciences. Série IV, Physique, Astrophysique, 403-408.
Peer reviewed

Beljonne, D. (15 February 2000). Singlet and triplet exciton formation cross sections in polymer LEDs. Paper presented at Fourth international topical conference on optical probes of conjugated polymers and photonic crystals, 15/02/2000->19/02/2000, Salt Lake City, United States.

Cornil, J., Calbert, J. P., Beljonne, D., Dos Santos, D. A., & Brédas, J.-L. (2000). Influence of Structural Organization on Optical and Transport Properties in Organic Materials. In S. P. Ermer, J. R. Reynolds, J. W. Perry, A. K. Y. Jen, & Z. Bao (Eds.), Electrical, Optical and Magnetic Properties of Organic Solid-State Materials V (pp. 1.4.1-7). Materials Research Society Symposium Proceedings.

Shuai, Z., Beljonne, D., Brédas, J.-L., & Silbey, R. (01 January 2000). Singlet and triplet exciton formation rates in conjugated polymer light-emitting diodes. Physical Review Letters, 84, 131-134.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Dos Santos, D. A., Calbert, J. P., & Brédas, J.-L. (01 January 2000). Intermolecular Interactions in Electroluminescent Conjugated Materials. Thin Solid Films, 363, 72-75.
Peer Reviewed verified by ORBi

Beljonne, D. (09 December 1999). Two-photon absorption in conjugated materials: structure/property relationships. Paper presented at International Workshop on molecular design of photonic materials 'MDPM'99, 09/12/1999->10/12/1999, Takarazuka, Japan.

Beljonne, D. (18 October 1999). On the luminescence quantum efficiency of polymer-based light emitting diodes: a quantum chemical study. Paper presented at Workshop 'the future of plastic electronic and optoelectronics, 18/10/1999->19/10/1999, Brugge, Belgium.

Beljonne, D. (23 August 1999). Design of organic conjugated chromophores with large two-photon absorption cross sections. Paper presented at ACS Fall'99 symposium 'Theory and modeling of electronic and nonlinear optical materials, 23/08/1999->26/08/1999, New Orleans, United States - Louisiana.

Shuai, Z., Beljonne, D., Silbey, R., & Brédas, J.-L. (24 March 1999). Singlet and Triplet Exciton Formation Rates in Conjugated Polymer Light-Emitting Diodes. Physical Review Letters, 84, 131-134.
Peer Reviewed verified by ORBi

Brédas, J.-L., Dos Santos, D. A., Cornil, J., Beljonne, D., & Shuai, Z. (1999). Electronic Structure of Isolated and Interacting -Conjugated Oligomer and Polymer Chains: A Quantum-Chemical Approach to Optical and Charge-Transfer Phenomena. In J.-L. Brédas (Ed.), Conjugated Polymers, Oligomers, and Dendrimers: From Polyacetylene to DNA (pp. 133-160). Francqui Symposium Library.

Marder, S. R., Perry, J. W., McCord-Maughon, D., Dickinson, M. E., Fraser, S. E., Beljonne, D., & Brédas, J.-L. (1999). Design and applications of two-photon absorbing organic chromophores. In conjugated oligomers, polymers and dendrimers: from polyacetylene to DNA (pp. 395-424). De Boeck.

Brédas, J.-L., Beljonne, D., Cornil, J., & Dos Santos, D. A. (01 January 1999). Electroluminescence in Semiconducting Conjugated Polymers and Oligomers: A Quantum-Chemical Perspective. International Journal of Polymeric Materials, 44, 341-355.
Peer Reviewed verified by ORBi

Brédas, J.-L., Cornil, J., Beljonne, D., Dos Santos, D. A., & Shuai, Z. (01 January 1999). Excited-State Electronic Structure of Conjugated Oligomers and Polymers: A Quantum-Chemical Approach. Accounts of Chemical Research, 32, 267-276.
Peer Reviewed verified by ORBi

Beljonne, D., Kogej, T., Marder, S. R., Perry, J. W., & Brédas, J.-L. (01 January 1999). Theoretical Design of Organic Chromophores with Large Two-Photon Absorption Cross-sections. Nonlinear Optics, Quantum Optics: Concepts in Modern Optics, 21, 461-480.
Peer Reviewed verified by ORBi

Beljonne, D., Shuai, Z., Cornil, J., Dos Santos, D. A., & Brédas, J.-L. (01 January 1999). On the Nature of Electronic Excitations in Poly(paraphenylenevinylene): A Quantum-Chemical Investigation. Journal of Chemical Physics, 111, 2829-2841.
Peer Reviewed verified by ORBi

Beljonne, D., Langeveld-Voss, B. M. W., Shuai, Z., Janssen, R. A. J., Meijer, E. W., & Brédas, J.-L. (01 January 1999). Exciton coupling in oligothiophenes: a combined experimental/theoretical study. Synthetic Metals, 102, 912-913.
Peer Reviewed verified by ORBi

Cornil, J., Dos Santos, D. A., Beljonne, D., Shuai, Z., & Brédas, J.-L. (1999). Gas Phase to Solid State Evolution of the Electronic and Optical Properties of Conjugated Chains: A Theoretical Investigation. In G. Hadziioannou & P. van Hutten (Eds.), Semiconducting Polymers (pp. 87-114). Wiley-VCH.

Beljonne, D. (12 July 1998). Investigation of exciton coupling in oligothiophenes by circular dichroism spectroscopy. Poster session presented at Participation to the meeting 'International Conference on Science and Technology of Synthetic Metals, 12/07/1998->18/07/1998, Montpellier, France.

Beljonne, D. (07 July 1998). A quantum chemical description of excited states in conjugated materials: implications for optics and nonlinear optics. Paper presented at Adriatico research conference on organic semiconductors, 07/07/1998->10/07/1998, Triestre, Italy.

Köhler, A., Dos Santos, D. A., Beljonne, D., Shuai, Z., Brédas, J.-L., Friend, R. H., Moratti, S. C., Holmes, A. B., Kraus, A., & Müllen, K. (01 January 1998). Charge separation in localized and delocalized electronic states in polymeric semiconductors. Nature, 392, 903-906.
Peer Reviewed verified by ORBi

Kogej, T., Beljonne, D., Meyers, F., Perry, J. W., Brédas, J.-L., & Marder, S. R. (01 January 1998). Mechanism for enhancement of two-photon absorption in donor-acceptor conjugated chromophores. Chemical Physics Letters, 298, 1-6.
Peer Reviewed verified by ORBi

Beljonne, D., Dos Santos, D. A., Cornil, J., & Brédas, J.-L. (01 January 1998). Theoretical Investigation of the Singlet and Triplet Excitations in Cyano-Substituted Oligo(phenylene vinylene)s. Annual Technical Conference / Society Plastic Engineers, 2, 1291-1295.

Blake, I. M., Anderson, H. L., Beljonne, D., Brédas, J.-L., & Clegg, W. (01 January 1998). Synthesis, crystal structure and electronic structure of a 5,15-dialkyllideneporphyrin: a TCNQ/porphyrin hybrid. Journal of the American Chemical Society, 120, 10764-10765.
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Heeger, A. J., & Brédas, J.-L. (1998). The low-lying excited states of luminescent conjugated polymers: Theoretical insight into the nature of the photogenerated species and intersystem crossing processes. In Photonic and Optoelectronic Polymers. ACS, Washington DC.

Beljonne, D. (01 January 1998). Investigation of exciton coupling in oligothiophenes by circular dichroism spectroscopy. Advanced Materials, 10, 1343-1348.
Peer reviewed

Brédas, J.-L., Cornil, J., Dos Santos, D. A., Beljonne, D., & Shuai, Z. (1998). Electronic Structure and Optical Response of Electroluminescent Conjugated Polymers. In L. Chiang, L. Dalton, A. Jen, J. R. Reynolds, & M. Rubner (Eds.), Electrical, Optical and Magnetic Properties of Organic Solid-State Materials IV (pp. 293-304). Materials Research Society Symposium Proceedings.

Albota, M., Beljonne, D., Brédas, J.-L., Ehrlich, J. E., Fu, J.-Y., Heikal, A. A., Hess, S., Kogej, T., Levin, M. D., Marder, S. R., McCord-Maughon, D., Perry, J. W., Röckel, H., Rumi, M., Subramaniam, G., Webb, W. W., & Xu, C. (01 January 1998). Design of organic molecules with large two-photon absorption cross sections. Science, 281, 1653-1655.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Parente, V., Lazzaroni, R., & Brédas, J.-L. (1998). Geometric and Electronic Structure and Optical Response of Oligo- and Polythiophenes: Relation to their Use in Electro-Optic and Photonic Devices. In Handbook of Oligo- and Polythiophenes (pp. 317-360). Wiley.

Koch, A. T. H., Beljonne, D., Harrisson, N. T., Brédas, J.-L., Haylett, N., Daik, R., Feast, W. J., & Friend, R. H. (01 January 1998). The effect of phenyl-di-substitution of PPV on its photophysical and photostability properties. Optical Materials, 9, 145-149.
Peer Reviewed verified by ORBi

Beljonne, D., Kauranen, M., Shuai, Z., Verbiest, T., Brédas, J.-L., & Persoons, A. (01 January 1998). Electro-optic response of chiral helicenes in isotropic media. Journal of Chemical Physics, 108, 1301-1304.
Peer Reviewed verified by ORBi

Muccini, M., Lunedei, E., Beljonne, D., Cornil, J., Brédas, J.-L., & Taliani, C. (01 January 1998). Polarized Absorption and Davydov Splitting in -Sexithienyl Single Crystals at 4.2 K. Journal of Chemical Physics, 109, 10513-10520.
Peer Reviewed verified by ORBi

Dos Santos, D. A., Beljonne, D., Cornil, J., & Brédas, J.-L. (01 January 1998). Electronic Structure of Singlet and Triplet Excited States in Cyano-Substituted Oligo(phenylene vinylene)s. Chemical Physics, 227, 1-10.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Brédas, J.-L. (1998). A Quantum Chemical Approach to Conjugated Oligomers: The Case of Oligothiophenes. In K. Mullen & G. Wegner (Eds.), Electronic Materials - The Oligomer Approach (pp. 432-446). Wiley.

Beljonne, D. (07 September 1997). Theoretical investigation of twphoton absorption in substituted oligo (phenylene vinylene)s. Poster session presented at Participation to the meeting 'European Conference on Materials for Electronics (ECME97), 07/09/1997->10/09/1997, Cambridge, United Kingdom.

Beljonne, D. (30 June 1997). Excited-state electronic structure and nonlinear optical response of large conjugated oligomers. Paper presented at Workshop 'nonlinear optical properties of polymers and related topics, 30/06/1997->01/07/1997, Bayreuth, Germany.

Colbert, M. C. B., Lewis, J., Long, N. J., Raithby, P. R., White, A. J. P., Williams, D. J., Payne, N. N., Yellowlees, L., Beljonne, D., & Friend, R. H. (01 January 1997). The synthesis and characterization of dinuclear metal - alpha- acetylides and mononuclear metal - alpha - allenylidenes. Organometallics, 17, 3034-3043.
Peer Reviewed verified by ORBi

Brédas, J.-L., Beljonne, D., Cornil, J., Lazzaroni, R., & Dos Santos, D. A. (01 January 1997). Electronic Structure of Luminescent Conjugated Polymers: Relevance to Polymer-based Light-Emitting Diodes. Annual Technical Conference / Society of Plastic Engineers, 2, 1404-1408.

Brédas, J.-L., Gueskine, V., Dos Santos, D. A., Beljonne, D., & Cornil, J. (1997). Organic Molecular Wires: Theoretical Analysis of the Electronic Coupling to Metal Electrodes and of the Influence of Derivatization. In S. Joachim & S. Roth (Eds.), Atomic and Molecular Wires, NATO-ASI Series E: Applied Sciences. Kluwer.

Cross, G. H., Healy, D., Szablewski, M., Bloor, D., Malagoli, M., Kojeg, T., Beljonne, D., & Brédas, J.-L. (01 January 1997). Highly polar chromophores in poled polymer films characterized by second-harmonic generation. Chemical Physics Letters, 268, 36-42.
Peer Reviewed verified by ORBi

Beljonne, D. (01 January 1997). The dominant one-and two-photon excited states in the nonlinear optical response of octatetraene: Ab initio versus semiempirical theoretical descriptions. Chemical Physics Letters, 279, 1-8.
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Shuai, Z., Brédas, J.-L., Rohlfing, F., Bradley, D. D. C., Ricci, V., Torruelas, W., & Stegeman, G. I. (01 January 1997). General Model for the Description of the Third-order Optical Nonlinearities in Conjugated Systems: Application to the β-carotene Molecule. Physical Review. B, Condensed Matter, 55, 1505-1516.
Peer Reviewed verified by ORBi

Dos Santos, D. A., Beljonne, D., Cornil, J., & Brédas, J.-L. (01 January 1997). Spatial Extent of the Singlet and Triplet Excitons in Cyano-substituted Oligo(phenylenevinylene)s. Synthetic Metals, 84 (1025-1026).
Peer Reviewed verified by ORBi

Brédas, J.-L., Beljonne, D., Cornil, J., Dos Santos, D. A., & Shuai, Z. (01 January 1997). Electroluminescence in Semiconducting Conjugated Polymers and Oligomers: A Quantum-chemical Approach. Philosophical Transactions. Mathematical, Physical and Engineering Sciences, 355 (735-747).
Peer Reviewed verified by ORBi

Cornil, J., Dos Santos, D. A., Beljonne, D., & Brédas, J.-L. (01 January 1997). Cyano-Substituted Polyparaphenylene Vinylene: Description of the Nature of the Lowest Singlet and Triplet Excited States. Proceedings of SPIE: The International Society for Optical Engineering, 3148, 72-81.

Cornil, J., Beljonne, D., Heller, C. M., Campbell, I. H., Laurich, B. K., Smith, D. L., Bradley, D. D. C., Mullen, K., & Brédas, J.-L. (01 January 1997). Photoluminescence Spectra of Oligo(paraphenylenevinylene)s: A Joint Theoretical and Experimental Characterization. Chemical Physics Letters, 278, 139-145.
Peer Reviewed verified by ORBi

Beljonne, D., O'Keefe, G. E., Hamer, P. J., Friend, R. H., Anderson, H. L., & Brédas, J.-L. (01 January 1997). Investigation of the linear and nonlinear optical response of edgelinked conjugated zinc porphyrin oligomers by optical spectroscopy and configuration interaction techniques. Journal of Chemical Physics, 106, 9439-9460.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 1997). Towards a Coherent Description of the Nature of the Photogenerated Species in the Lowest-lying One-photon Allowed Excited State of Isolated Conjugated Chains. Synthetic Metals, 84, 1029-1030.
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Dos Santos, D. A., Shuai, Z., & Brédas, J.-L. (1997). Excited States in Polyparaphenylene Vinylene and Related Oligomers: Theoretical Investigation of Their Relation to Electrical and Optical Properties. In N. S. Sariciftci (Ed.), Primary Photoexcitations in Conjugated Polymers: Molecular Exciton versus Semiconductor Band Model (pp. 559-586). World Scientific Publishing Company.

Brédas, J.-L., Cornil, J., Meyers, F., & Beljonne, D. (1997). Electronic Structure and Optical Response of Highly Conducting and Semiconducting Conjugated Polymers and Oligomers. In T. A. Skotheim, J. R. Reynolds, & R. L. Elsenbaumer (Eds.), Handbook of Conducting Polymers, 2nd Edition. Marcel Dekker.

Köhler, A., Dos Santos, D. A., Beljonne, D., Shuai, Z., Brédas, J.-L., Friend, R. H., Moratti, S. C., & Holmes, A. B. (01 January 1997). UV photocurrent spectroscopy in poly(p-phenylene vinylene) and derivatives. Synthetic Metals, 84, 675-676.
Peer Reviewed verified by ORBi

Brédas, J.-L., Gueskine, V., Dos Santos, D. A., Beljonne, D., & Cornil, J. (1997). Organic Molecular Wires: Theoretical Analysis of the Electronic Coupling to Metal Electrodes and of the Influence of Derivatization. In S. Joachim & S. Roth (Eds.), Atomic and Molecular Wires, NATO-ASI Series E: Applied Sciences (pp. 47-59). Kluwer.

Beljonne, D. (14 September 1996). Electronic excitations in organic conjugated systems: a theoretical study. Paper presented at International conference on organic electroluminescent materials, 14/09/1996->17/09/1996, Rochester, United States - New York.

Beljonne, D. (28 July 1996). Toward a general description of the nature of the photogenerated species in the lowest-lying one-photon allowed excited state of isolated conjugated chains. Poster session presented at International conference on science and technology of synthetic metals (ICSM'96), 28/07/1996->02/08/1996, Snowird, United States - Utah.

Beljonne, D. (28 July 1996). Spatial extent of the singlet and triplet excitons in cyano-substituted oligo (phenylene vinylene)s. Paper presented at International conference on science and technology of synthetic metals (ICSM'96),28/07/1996->02/09/1996, Snowird, United States - Utah.

Beljonne, D. (21 July 1996). Spatial extent of the singlet and triplet excitons in cyano-substituted oligo (phenylene vinylene)s. Poster session presented at Meeting 3Electronic Processes in Organic Materials, 21/07/1996->26/07/1996, Proctor Academy, United States.

Beljonne, D. (04 June 1996). Electronics with molecular materials: from synthesis to Device. Paper presented at Meeting 'Electronics with molecular materials: from synthesis to device', 04/06/1996->05/06/1996, London, United Kingdom.

Beljonne, D. (14 April 1996). Theoretical description of the excited states in conjugated organic compounds. Relation to the electroluminescence and photoconduction properties. Paper presented at Electro-Optical Properties of Polymers and Related Subjects, Bayreuth, Germany.

CHEN, G., Mukamel, S., Beljonne, D., & Brédas, J.-L. (01 January 1996). The coupled harmonic oscillator and the sum-over-state pictures for the optical response of octatetraene. Journal of Chemical Physics, 104, 5406-5414.
Peer Reviewed verified by ORBi

Suzuki, Y. Y., Beljonne, D., & Brédas, J.-L. (01 January 1996). Two-band tight binding model for push-pull polyenes. Journal of Chemical Physics, 104, 7270-7283. doi:10.1088/1748-0221/5/03/T03013
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Dos Santos, D. A., & Brédas, J.-L. (01 January 1996). Poly(p-phenylenevinylene) as Active Layer in Light-Emitting Diodes: A Theoretical Investigation of the Effects of Derivatization. Synthetic Metals, 76 (101-104).
Peer Reviewed verified by ORBi

Shuai, Z., Beljonne, D., Brédas, J.-L., Saxena, A., & Bishop, A. R. (01 January 1996). Electroabsorption in poly(paraphenylene vinylene) and PtI: Exciton vs Band descriptions. Solid State Communications, 97, 1063-1067.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Martin, S., Bradley, D. D. C., Hagler, T. W., Cha, M., Torruelas, W., Stegeman, G. I., & Brédas, J.-L. (1996). Vibronic Contributions in Frequency-dependent Linear and Nonlinear Optical Processes: A Joint Experimental and Theoretical Study. In F. Kajzar, V. M. Agranovich, & C. Y. Lee (Eds.), Photoactive Organic Materials: Science and Application. Kluwer.

Beljonne, D., Cornil, J., Friend, R. H., & Brédas, J.-L. (01 January 1996). Theoretical Investigation of the Lowest Singlet and Triplet States in Oligo(phenylenevinylene)s and Oligothiophenes. Synthetic Metals, 76, 61-65.
Peer Reviewed verified by ORBi

Coomber, A. T., Beljonne, D., Friend, R. H., Brédas, J.-L., Charlton, A., Underhill, A. E., Kurmoo, M., & Day, P. (01 January 1996). Ferromagnetism and intermolecular interactions in NH4Ni (mnt)2.H2O. Nature, 380, 144-146.
Peer Reviewed verified by ORBi

Beljonne, D., Brédas, J.-L., CHEN, G., & Mukamel, S. (01 January 1996). Linear and nonlinear optical response of dimethyl-amino-nitro-stilbene (DNSA): the coupled harmonic oscillator representation versus the sum-over-states picture. Chemical Physics, 210, 353-366.
Peer Reviewed verified by ORBi

Beljonne, D., Wittmann, H. F., Köhler, A., Graham, S., Younus, M., Lewis, J., Raithby, P. R., Khan, M. S., Friend, R. H., & Brédas, J.-L. (01 January 1996). Spatial extent of the singlet and triplet excitons in transition metal-contaning polynes. Journal of Chemical Physics, 105, 3868-3877.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 1996). Towards a Better Understanding of Polymer-Based Light-Emitting Diodes: A Theoretical Insight into the Basic Phenomena. Synthetic Metals, 78, 209-217.
Peer Reviewed verified by ORBi

Beljonne, D., Colbert, M. C. B., Raithby, P. R., Friend, R. H., & Brédas, J.-L. (01 January 1996). Electronic properties of dinuclear ruthenium-acetylide complexes: Electrochemical and theoretical characterization. Synthetic Metals, 81, 179-183.
Peer Reviewed verified by ORBi

Beljonne, D., Meyers, F., & Brédas, J.-L. (01 January 1996). Excited states in bis-substituted polyenes: configuration interaction description of the vertical excitation energies and nonlinear optical properties. Synthetic Metals, 80, 211-222.
Peer Reviewed verified by ORBi

Beljonne, D., Cornil, J., Brédas, J.-L., Friend, R. H., & Janssen, R. A. J. (01 January 1996). Influence of Chain Length and Derivatization on the Lowest Singlet and Triplet States and Intersystem Crossing in Oligothiophenes. Journal of the American Chemical Society, 118, 6453-6461.
Peer Reviewed verified by ORBi

Rohlfing, F., Bradley, D. D. C., Eberhardt, A., Mullen, K., Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 1996). Electroabsorption Spectroscopy of β-carotene and α,ω-bis(1,1-dimethylheptyl)-1,3,5,7,9,11,13,15-hexadecaocatene. Synthetic Metals, 76, 35-38.
Peer Reviewed verified by ORBi

Beljonne, D. (18 December 1995). Theoretical description of the excited states in conjugated organic systems: implications for light emitting diodes and nonlinear optics. Paper presented at Colloquim 'Large-scale computations and their application to advanced materials, Mons, Belgium.

Beljonne, D. (26 October 1995). Nonlinear optical response of conjugated systems: electronic origin and vibronic structure. Paper presented at Workshop 'Quantum chemistry in Belgium: Current Aspects and Trends for the future, 26/10/1995->27/10/1995, Namur , Belgium.

Beljonne, D. (22 May 1995). Poly (p-phenylene Vinylene) as active layers in light-emitting diodes: a theoretical investigation of the effects of derivatization. Paper presented at European materials reserach society (E-MRS) spring meeting, 22/05/1995->24/05/1995, Strasbourg, France.

Beljonne, D., Shuai, Z., Friend, R. H., & Brédas, J.-L. (01 January 1995). Theoretical investigation of the lowest singlet and triplet states in poly(paraphenylene vinylene) oligomers. Journal of Chemical Physics, 102, 2042-2049.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Brédas, J.-L., & Heeger, A. J. (1995). The Low-lying Excited States of Luminescent Conjugated Polymers: A Theoretical Insight into the Nature of the Photogenerated Species and Intersystem-Crossing Processes. In Photonic and Optoelectronic Polymers (pp. 308-321). ACS, Washington DC.

Cornil, J., Beljonne, D., Shuai, Z., Hagler, T. W., Campbell, I. H., Mullen, K., Spangler, C. W., Bradley, D. D. C., & Brédas, J.-L. (01 January 1995). Vibronic Structure in the Optical Absorption Spectra of Phenylene Vinylene Oligomers: A Joint Experimental and Theoretical Study. Chemical Physics Letters, 247, 425-432.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Shuai, Z., Bradley, D. D. C., & Brédas, J.-L. (1995). The Lowest Excited States in Oligo(phenylenevinylene)s: A Theoretical Investigation of Optical Absorption Spectra and Geometry Relaxation Phenomena. In Polymers and Other Advanced Materials: Emerging Technologies and Business Opportunities (pp. 327-334). Plenum Press.

Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 1995). Nature of Optical Transitions in Conjugated Oligomers. II. Theoretical Characterization of Neutral and Doped Oligothiophenes. Journal of Chemical Physics, 103 (842-849).
Peer Reviewed verified by ORBi

Beljonne, D., Brédas, J.-L., Cha, M., Torruellas, W. E., Stegeman, G. I., Horsthuis, W. H. G., & Möhlmann, G. R. (01 January 1995). Two-photon absorption and third-harmonic generation of di-alkyl-amino-nitro-stilbene dans: a joint experimental and theoretical study. Journal of Chemical Physics, 103, 7834-7843.
Peer Reviewed verified by ORBi

Beljonne, D., Dehu, C., & Brédas, J.-L. (01 January 1995). Theoretical investigation of the third-order nonlinear optical properties of oligothiophenes and derivatives: Conjugation-lenght and frequency-dispersion analysis. Nonlinear Optics, Quantum Optics: Concepts in Modern Optics, 9, 37-47.
Peer Reviewed verified by ORBi

Cornil, J., Dos Santos, D. A., Beljonne, D., & Brédas, J.-L. (01 January 1995). Electronic Structure of Phenylene Vinylene Oligomers: Influence of Donor/Acceptor Substitutions. Journal of Physical Chemistry, 99, 5604-5611.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 1995). Nature of Optical Transitions in Conjugated Oligomers. I. Theoretical Characterization of Neutral and Doped Oligo(phenylenevinylene)s. Journal of Chemical Physics, 103, 834-841.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., & Brédas, J.-L. (01 January 1995). Poly(p-Phenylene Vinylene) in Light Emitting Diodes: Nature of the Lowest Singlet and Triplet Excited States and Effects of Derivatization. Polymeric Materials: Science and Engineering, 72, 459-460.

Beljonne, D. (20 December 1994). Poly (p-phenylene vinylene) in light emitting diodes: effects of derivatization and theoretical investigation of the lowest singlet and triplet states in oligo (phenylene vinylene)s and oligothiophenes. Poster session presented at Conference on condensed matter and materials physics, 20/12/1994->22/12/1994, Warwick, United Kingdom.

Beljonne, D., & Brédas, J.-L. (01 January 1994). Theoretical investigation of two-photon absorption and third-harmonic generation in a long thiophene oligomer: alpha-heptathiophene. Journal of the Optical Society of America. B, Optical Physics, 11, 1380-1387.
Peer Reviewed verified by ORBi

Adant, C., Beljonne, D., & Brédas, J.-L. (01 January 1994). Theoretical investigation of the nonlinear optical properties of oligomers of polyarylenemethylidene, a low band gap material. Journal of Chemical Physics, 101, 1-7.
Peer Reviewed verified by ORBi

Cornil, J., Beljonne, D., Friend, R. H., & Brédas, J.-L. (01 January 1994). Optical Absorptions in Poly(paraphenylene vinylene) and Poly(2,5-dimethoxy-1,4-paraphenylene vinylene) Oligomers. Chemical Physics Letters, 223, 82-88.
Peer Reviewed verified by ORBi

Dannetun, P., Lögdlund, M., Fahlman, M., Fauquet, C., Beljonne, D., Brédas, J.-L., Bässler, H., & Salaneck, W. R. (01 January 1994). The evolution of charge-induced gap states in degenerate and non degenerate conjugated molecules and polymers as studied by photoelectron spectroscopy. Synthetic Metals, 67, 81-86.
Peer Reviewed verified by ORBi

Beljonne, D., & Brédas, J.-L. (01 January 1994). Theoretical study of pyrrole oligomers: Electronic excitations, relaxation energies and nonlinear optical properties. Physical Review. B, Condensed Matter, 50, 2841-2849.
Peer Reviewed verified by ORBi

Beljonne, D., Shuai, Z., & Brédas, J.-L. (01 January 1994). Theoretical evolution of the third-order molecular polarizabilities as a function of chain length in thiophene and pyrrole oligomers. International Journal of Quantum Chemistry, 52, 39-48.
Peer Reviewed verified by ORBi

Beljonne, D. (28 June 1993). Theoretical study of conjugated oligomers: electronic excitations, relaxation energies, and nonlinear optical properties. Paper presented at First Congress of the international society for theoretical chemical physics, 28/06/1993->03/07/1993, Girona, Spain.

Beljonne, D., Shuai, Z., & Brédas, J.-L. (01 January 1993). Theoretical study of thiophene oligomers: Electronic excitations, relaxation energies and nonlinear optical properties. Journal of Chemical Physics, 98, 8819-8828.
Peer Reviewed verified by ORBi

Fahlman, M., Beljonne, D., Lögdlund, M., Friend, R. H., Holmes, A. B., Brédas, J.-L., & Salaneck, W. R. (01 January 1993). Experimental and theoretical studies of the electronic structure of Na-doped poly(paraphenylenevinylene). Chemical Physics Letters, 214, 327-332.
Peer Reviewed verified by ORBi

Brédas, J.-L., Adant, C., Beljonne, D., Meyers, F., & Shuai, Z. (01 January 1993). Influence of molecular arcitecture and chain length on the nonlinear optical response of conjugated oligomers and polymers. Synthetic Metals, 55, 3933-3940.
Peer Reviewed verified by ORBi

Shuai, Z., Beljonne, D., & Brédas, J.-L. (01 January 1992). Nonlinear optical processes in short polyenes: Configuration interaction description of two-photon absorption and third-harmonic generation. Journal of Chemical Physics, 97, 1132-1137.
Peer Reviewed verified by ORBi

Shuai, Z., Beljonne, D., & Brédas, J.-L. (01 January 1992). Nonlinear optical processes in conjugated polymers: Configuration interaction description of linear polyenes and VEH/SOS evalaution of polyarylene vinylenes. Synthetic Metals, 51, 123-133.
Peer Reviewed verified by ORBi

Beljonne, D. (24 June 1991). Organic materials for photonics. Paper presented at Conference on organic materials for photonics, 24/06/1991->28/06/1991, Obereggen, Italy.

Brédas, J.-L., Beljonne, D., Shuai, Z., & Toussaint, J. M. (01 January 1991). Theoretical investigation of the effect of doping on the electronic properties of polyparaphenylene vinylene. Synthetic Metals, 43, 3743-3746.
Peer Reviewed verified by ORBi

Shuai, Z., Beljonne, D., & Brédas, J.-L. (01 January 1991). SSH-Hamiltonian description of the electronic structure and vibrational properties of polyparaphenylene vinylene. Solid State Communications, 78, 477-480.
Peer Reviewed verified by ORBi

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