Publications

Found 14 results
Filters: Author is Coropceanu, Veaceslav  [Clear All Filters]
2019
S. Thomas, Li, H., Dasari, R., Evans, A., Dichtel, W. R., Marder, S. R., Coropceanu, V., and Brédas, J. - L., “Design and Synthesis of Two-Dimensional Covalent Organic Frameworks with Four-Arm Cores: Prediction of Remarkable Ambipolar Charge-Transport Properties”, ChemRxiv, vol. 2, pp. 1-17, 2019.
2018
X. - K. Chen, Coropceanu, V., and Brédas, J. - L., “Assessing the nature of the charge-transfer electronic states in organic solar cells”, Nature Communications, vol. 9, no. 1, 2018.
D. Qian, Zheng, Z., Yao, H., Tress, W., Hopper, T. R., Chen, S., Li, S., Liu, J., Chen, S., Zhang, J., Liu, X. - K., Gao, B., Ouyang, L., Jin, Y., Pozina, G., Buyanova, I. A., Chen, W. M., äs, O., Coropceanu, V., Bredas, J. - L., Yan, H., Hou, J., Zhang, F., Bakulin, A. A., and Gao, F., “Design rules for minimizing voltage losses in high-efficiency organic solar cells”, Nature Materials, vol. 17, no. 8, pp. 703 - 709, 2018.
R. N. Goud, Zhang, X., Bredas, J. - L., Coropceanu, V., and Matzger, A. J., “Discovery of Non-linear Optical Materials by Function-Based Screening of Multi-component Solids”, Chem, vol. 4, no. 1, pp. 150 - 161, 2018.
B. Xu, Yi, X., Huang, T. - Y., Zheng, Z., Zhang, J., Salehi, A., Coropceanu, V., Ho, C. Hoi Yi, Marder, S. R., Toney, M. F., Bredas, J. - L., So, F., and Reynolds, J. R., “Donor Conjugated Polymers with Polar Side Chain Groups: The Role of Dielectric Constant and Energetic Disorder on Photovoltaic Performance”, Advanced Functional Materials, vol. 28, no. 46, p. 1803418, 2018.
C. Kin Lo, Gautam, B. R., Selter, P., Zheng, Z., Oosterhout, S. D., Constantinou, I., Knitsch, R., Wolfe, R. M. W., Yi, X., Bredas, J. - L., So, F., Toney, M. F., Coropceanu, V., Hansen, M. Ryan, Gundogdu, K., and Reynolds, J. R., “Every Atom Counts: Elucidating the Fundamental Impact of Structural Change in Conjugated Polymers for Organic Photovoltaics”, Chemistry of Materials, vol. 30, no. 9, pp. 2995 - 3009, 2018.
Z. Tu, Yi, Y., Coropceanu, V., and Bredas, J. - L., “Impact of Phonon Dispersion on Nonlocal Electron-Phonon Couplings in Organic Semiconductors: The Naphthalene Crystal as a Case Study”, The Journal of Physical Chemistry Part C: Energy Conversion and Storage, Optical and Electronic Devices, Interfaces, Nanomaterials, and Hard Matter, C: Energy Conversion and Storage; Energy and Charge Transport, vol. 122, pp. 44-49, 2018.
2017
Z. Zheng, Tummala, N. Rajesh, Fu, Y. - T., Coropceanu, V., and Bredas, J. - L., “Charge-Transfer States in Organic Solar Cells: Understanding the Impact of Polarization, Delocalization, and Disorder”, ACS Applied Materials & Interfaces, vol. 9, no. 21, pp. 18095 - 18102, 2017.
P. K. Samanta, Kim, D., Coropceanu, V., and Bredas, J. - L., “Up-Conversion Intersystem Crossing Rates in Organic Emitters for Thermally Activated Delayed Fluorescence: Impact of the Nature of Singlet vs Triplet Excited States”, Journal of the American Chemical Society, vol. 139, no. 11, pp. 4042 - 4051, 2017.
2016
R. L. Gieseking, Ravva, M. Kumar, Coropceanu, V., and Bredas, J. - L., “Benchmarking Density Functional Theory Approaches for the Description of Symmetry Breaking in Long Polymethine Dyes”, The Journal of Physical Chemistry C, vol. 120, no. 18, pp. 9975 - 9984, 2016.
S. Sweetnam, Vandewal, K., Cho, E., Risko, C., Coropceanu, V., Salleo, A., Bredas, J. - L., and McGehee, M. D., “Characterizing the Polymer:Fullerene Intermolecular Interactions”, Chemistry of Materials, vol. 28, no. 5, pp. 1446 - 1452, 2016.
Z. Zheng, Bredas, J. - L., and Coropceanu, V., “Description of the Charge Transfer States at the Pentacene/C 60 Interface: Combining Range-Separated Hybrid Functionals with the Polarizable Continuum Model”, The Journal of Physical Chemistry Letters, vol. 7, no. 13, pp. 2616 - 2621, 2016.
N. Rajesh Tummala, Elroby, S. A., Aziz, S. G., Risko, C., Coropceanu, V., and Bredas, J. - L., “Packing and Disorder in Substituted Fullerenes”, The Journal of Physical Chemistry C, vol. 120, no. 31, pp. 17242 - 17250, 2016.
G. Conboy, Spencer, H. J., Angioni, E., Kanibolotsky, A. L., Findlay, N. J., Coles, S. J., Wilson, C., Pitak, M. B., Risko, C., Coropceanu, V., Bredas, J. - L., and Skabara, P. J., “To bend or not to bend – are heteroatom interactions within conjugated molecules effective in dictating conformation and planarity?”, Materials Horizons, vol. 3, no. 4, pp. 333 - 339, 2016.