Alessandro Troisi
Affiliations: | Department of Chemistry | University of Liverpool, LIVERPOOL, UK. |
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Sign in to add mentorAbraham Nitzan | post-doc | 2003 | University of Liverpool, LIVERPOOL, UK. | |
((Post doc)) |
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Publications
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Vong D, Nematiaram T, Dettmann MA, et al. (2022) Quantitative Hole Mobility Simulation and Validation in Substituted Acenes. The Journal of Physical Chemistry Letters. 5530-5537 |
Nematiaram T, Troisi A. (2022) Feasibility of p-Doped Molecular Crystals as Transparent Conductive Electrodes via Virtual Screening. Chemistry of Materials : a Publication of the American Chemical Society. 34: 4050-4061 |
Omar ÖH, Nematiaram T, Troisi A, et al. (2022) Organic materials repurposing, a data set for theoretical predictions of new applications for existing compounds. Scientific Data. 9: 54 |
Xie X, Troisi A. (2021) Evaluating the Electronic Structure of Coexisting Excitonic and Multiexcitonic States in Periodic Systems: Significance for Singlet Fission. Journal of Chemical Theory and Computation |
Omar ÖH, Del Cueto M, Nematiaram T, et al. (2021) High-throughput virtual screening for organic electronics: a comparative study of alternative strategies. Journal of Materials Chemistry. C. 9: 13557-13583 |
Nematiaram T, Padula D, Troisi A. (2021) Bright Frenkel Excitons in Molecular Crystals: A Survey. Chemistry of Materials : a Publication of the American Chemical Society. 33: 3368-3378 |
Zhao K, Omar ÖH, Nematiaram T, et al. (2021) Novel thermally activated delayed fluorescence materials by high-throughput virtual screening: going beyond donor–acceptor design Journal of Materials Chemistry C. 9: 3324-3333 |
Nematiaram T, Padula D, Troisi A. (2021) Bright Frenkel Excitons in Molecular Crystals: A Survey Chemistry of Materials. 33: 3368-3378 |
Nematiaram T, Troisi A. (2020) Modeling charge transport in high-mobility molecular semiconductors: Balancing electronic structure and quantum dynamics methods with the help of experiments. The Journal of Chemical Physics. 152: 190902 |
Elliott JD, Troisi A, Carbone P. (2020) A QM/MD coupling method to model the ion-induced polarization of graphene. Journal of Chemical Theory and Computation |