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Jump to: Brain Korea 21 (Project) | China Scholarship Council (CSC) | China. Guo jia ke xue ji shu bu [Ministry of Science and Technology] (CMST) | Deutsche Forschungsgemeinschaft (DFG) | Engineering and Physical Sciences Research Council (EPSRC) | Engineering and Physical Sciences Research Council (EPSRC) | European Research Council | European Research Council (ERC) | European Research Council (ERC) | Fonds national de la recherche scientifique (Belgium) (FNRS) | Germany. Bundesministerium fΓΌr Bildung und Forschung [Germany. Federal Ministry of Education and Research] (BMBF) | Gordon and Betty Moore Foundation | Great Britain. Royal Commission for the Exhibition of 1851 | Guo jia zi ran ke xue ji jin wei yuan hui (China) [National Natural Science Foundation of China] (NSFC) | Italy. Ministero dell'istruzione, dell'universitΓ e della ricerca [ Ministry of Education, Universities and Research (Italy)] (MIUR) | Korean Science and Engineering Foundation (KOSEF) | Leverhulme Trust (LT) | Marie Curie Intra-European Fellowship (IEF) | Max-Planck-Gesellschaft zur FΓΆrderung der Wissenschaften [Max Planck Society] | Monash-Warwick Alliance | Royal Society (Great Britain) | Seventh Framework Programme (European Commission) (FP7) | Technology Strategy Board (Great Britain) | University of Warwick Institute of Advanced Study Scholarship | University of Warwick. Centre for Scientific Computing
Number of items: 98.
Brain Korea 21 (Project)
Vehoff, Thorsten, Chung, Yeon Sook, Johnston, K. (Karen), Troisi, Alessandro, Yoon, Do Y. and Andrienko, Denis (2010) Charge transport in self-assembled semiconducting organic layers : role of dynamic and static disorder. Journal of Physical Chemistry C, Vol.114 (No.23). pp. 10592-10597. doi:10.1021/jp101738g ISSN 1932-7447.
China Scholarship Council (CSC)
Kuzmich, Alina, Padula, Daniele, Ma, Haibo and Troisi, Alessandro (2017) Trends in the electronic and geometric structure of non-fullerene based acceptors for organic solar cells. Energy & Environmental Science, 10 (2). 395-401 . doi:10.1039/C6EE03654F ISSN 1754-5692.
China. Guo jia ke xue ji shu bu [Ministry of Science and Technology] (CMST)
Ma, Haibo, Qin, Ting and Troisi, Alessandro (2014) Electronic excited states in amorphous MEH-PPV polymers from large-scale first principles calculations. Journal of Chemical Theory and Computation, Volume 10 (Number 3). pp. 1272-1282. doi:10.1021/ct4010799 ISSN 1549-9618.
Deutsche Forschungsgemeinschaft (DFG)
Vehoff, Thorsten, Baumeier, Bjoern, Troisi, Alessandro and Andrienko, Denis (2010) Charge transport in organic crystals : role of disorder and topological connectivity. Journal of the American Chemical Society, Vol.132 (No.33). pp. 11702-11708. doi:10.1021/ja104380c ISSN 0002-7863.
Vehoff, Thorsten, Chung, Yeon Sook, Johnston, K. (Karen), Troisi, Alessandro, Yoon, Do Y. and Andrienko, Denis (2010) Charge transport in self-assembled semiconducting organic layers : role of dynamic and static disorder. Journal of Physical Chemistry C, Vol.114 (No.23). pp. 10592-10597. doi:10.1021/jp101738g ISSN 1932-7447.
Troisi, Alessandro, Cheung, David L. and Andrienko, Denis (2009) Charge transport in semiconductors with multiscale conformational dynamics. Physical Review Letters, Vol.102 (No.11). article no.116602 . doi:10.1103/PhysRevLett.102.116602 ISSN 0031-9007.
Engineering and Physical Sciences Research Council (EPSRC)
Knee, George C., Rowe, Patrick, Smith, Luke, Troisi, Alessandro and Datta, Animesh (2017) Structure-dynamics relation in physically-plausible multi-chromophore systems. The Journal of Physical Chemistry Letters, 8 (10). pp. 2328-2333. doi:10.1021/acs.jpclett.7b00829 ISSN 1948-7185.
Kuzmich, Alina, Padula, Daniele, Ma, Haibo and Troisi, Alessandro (2017) Trends in the electronic and geometric structure of non-fullerene based acceptors for organic solar cells. Energy & Environmental Science, 10 (2). 395-401 . doi:10.1039/C6EE03654F ISSN 1754-5692.
Troisi, Alessandro and Shaw, Alex (2016) Very large Ο-conjugation despite strong nonplanarity : a path for designing new semiconducting polymers. The Journal of Physical Chemistry Letters, 7 (22). pp. 4689-4694. doi:10.1021/acs.jpclett.6b02367 ISSN 1948-7185.
Ip, Chung Man and Troisi, Alessandro (2016) A computational study of the competing reaction mechanisms of the photo-catalytic reduction of CO2 on anatase(101). Physical Chemistry Chemical Physics, 18 (36). pp. 25010-25021. doi:10.1039/C6CP02642G ISSN 1463-9076.
Ip, Chung Man, Eleuteri, Antonio and Troisi, Alessandro (2014) Predicting with confidence the efficiency of new dyes in dye sensitized solar cells. Physical Chemistry Chemical Physics, 16 (36). pp. 19106-19110. doi:10.1039/c4cp03124e ISSN 1463-9076.
Maggio, Emanuele and Troisi, Alessandro (2013) Theory of the charge recombination reaction at the semiconductorβadsorbate interface in the presence of defects. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Volume 117 (Number 46). pp. 24196-24205. doi:10.1021/jp4080515 ISSN 1932-7447.
McMahon, David Paul, Cheung, David L., Goris, Ludwig, DacuΓ±a, Javier, Salleo, Alberto and Troisi, Alessandro (2011) Relation between microstructure and charge transport in polymers of different regioregularity. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.115 (No.39). pp. 19386-19393. doi:10.1021/jp207026s ISSN 1932-7447.
Chang, Jui-Fen, Sakanoue, Tomo, Olivier, Yoann, Uemura, Takafumi, Dufourg-Madec, Marie-Beatrice, Yeates, Stephen, Cornil, JΓ©rΓ΄me, Takeya, Jun, Troisi, Alessandro and Sirringhaus, Henning (2011) Hall-effect measurements probing the degree of charge-carrier delocalization in solution-processed crystalline molecular semiconductors. Physical Review Letters, Vol.107 (No.6). Article 066601 . doi:10.1103/PhysRevLett.107.066601 ISSN 0031-9007.
Liu, Tao and Troisi, Alessandro (2011) Absolute rate of charge separation and recombination in a molecular model of the P3HT/PCBM interface. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.115 (No.5). pp. 2406-2415. doi:10.1021/jp109130y ISSN 1932-7447.
Chmel, Nikola Paul, Clarkson, Guy J., Troisi, Alessandro, Turner, S. S. and Scott, Peter (2011) Chiral semiconductor phases : the optically pure D3[MIII(S,S-EDDS)]2(D = TTF, TSF) family. Inorganic Chemistry, Vol.50 (No.9). pp. 4039-4046. doi:10.1021/ic102522k ISSN 0020-1669.
McMahon, David Paul and Troisi, Alessandro (2011) Persistence time of charge carriers in defect states of molecular semiconductors. Physical Chemistry Chemical Physics, Vol.13 (No.21). p. 10241. doi:10.1039/c1cp20192a ISSN 1463-9076.
Liu, Tao, Cheung, David L. and Troisi, Alessandro (2011) Structural variability and dynamics of the P3HT/PCBM interface and its effects on the electronic structure and the charge-transfer rates in solar cells. Physical Chemistry Chemical Physics, Vol.13 (No.48). pp. 21461-21470. doi:10.1039/c1cp23084k ISSN 1463-9076.
Martsinovich, Natalia and Troisi, Alessandro (2011) Theoretical studies of dye-sensitised solar cells : from electronic structure to elementary processes. Energy & Environmental Science, Vol.4 (No.11). pp. 4473-4495. doi:10.1039/c1ee01906f ISSN 1754-5692.
Martsinovich, Natalia and Troisi, Alessandro (2011) Theoretical studies of dye-sensitised solar cells: from electronic structure to elementary processes. Energy & Environmental Science, 4 (11). p. 4473. doi:10.1039/c1ee01906f ISSN 1754-5692.
Vehoff, Thorsten, Baumeier, Bjoern, Troisi, Alessandro and Andrienko, Denis (2010) Charge transport in organic crystals : role of disorder and topological connectivity. Journal of the American Chemical Society, Vol.132 (No.33). pp. 11702-11708. doi:10.1021/ja104380c ISSN 0002-7863.
McMahon, David Paul and Troisi, Alessandro (2010) Organic semiconductors : impact of disorder at different timescales. ChemPhysChem, Vol.11 (No.10). pp. 2067-2074. ISSN 1439-4235 doi:10.1002/cphc.201000182
Vehoff, Thorsten, Chung, Yeon Sook, Johnston, K. (Karen), Troisi, Alessandro, Yoon, Do Y. and Andrienko, Denis (2010) Charge transport in self-assembled semiconducting organic layers : role of dynamic and static disorder. Journal of Physical Chemistry C, Vol.114 (No.23). pp. 10592-10597. doi:10.1021/jp101738g ISSN 1932-7447.
McMahon, David Paul and Troisi, Alessandro (2010) Evaluation of the external reorganization energy of polyacenes. Journal of Physical Chemistry Letters, Vol.1 (No.6). pp. 941-946. doi:10.1021/jz1001049 ISSN 1948-7185.
Fortuna, S. (Sara), Cheung, David L. and Troisi, Alessandro (2010) Hexagonal lattice model of the patterns formed by hydrogen-bonded molecules on the surface. Journal of Physical Chemistry B, Vol.114 (No.5). pp. 1849-1858. doi:10.1021/jp9098649 ISSN 1520-6106.
Martsinovich, Natalia, Jones, Daniel R. and Troisi, Alessandro (2010) Electronic structure of TiO2 surfaces and effect of molecular adsorbates using different DFT implementations. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.114 (No.51). pp. 22659-22670. doi:10.1021/jp109756g ISSN 1932-7447.
Troisi, Alessandro (2010) Quantum dynamic localization in the Holstein Hamiltonian at finite temperatures. Physical Review B (Condensed Matter and Materials Physics), Vol.82 (No.24). article no. 245202 . doi:10.1103/PhysRevB.82.245202 ISSN 1098-0121.
Jones, Daniel R. and Troisi, Alessandro (2010) A method to rapidly predict the charge injection rate in dye sensitized solar cells. Physical Chemistry Chemical Physics, Vol.12 (No.18). pp. 4625-4634. doi:10.1039/b926157e ISSN 1463-9076.
McMahon, David Paul and Troisi, Alessandro (2009) An ad hoc tight binding method to study the electronic structure of semiconducting polymers. Chemical Physics Letters, Vol.480 (No.4-6). pp. 210-214. doi:10.1016/j.cplett.2009.09.032 ISSN 0009-2614.
Cheung, David L., McMahon, David Paul and Troisi, Alessandro (2009) A realistic description of the charge carrier wave function in microcrystalline polymer semiconductors. Journal of the American Chemical Society, Vol.131 (No.31). pp. 11179-11186. doi:10.1021/ja903843c ISSN 0002-7863.
Cheung, David L., McMahon, David Paul and Troisi, Alessandro (2009) Computational study of the structure and charge-transfer parameters in low-molecular-mass P3HT. Journal of Physical Chemistry B, Vol.113 (No.28). pp. 9393-9401. doi:10.1021/jp904057m ISSN 1520-6106.
Troisi, Alessandro and Cheung, David L. (2009) Transition from dynamic to static disorder in one-dimensional organic semiconductors. Journal of Chemical Physics, Vol.131 (No.1). article no. 014703 . doi:10.1063/1.3167406 ISSN 0021-9606.
Sleigh, Jack P., McMahon, David Paul and Troisi, Alessandro (2009) Effect of the intermolecular thermal motions on the tail of the electronic density of states in polyacene crystals. Applied Physics A, Vol.95 (No.1 Sp. Iss. SI). pp. 147-152. doi:10.1007/s00339-008-5002-4 ISSN 0947-8396.
Troisi, Alessandro, Cheung, David L. and Andrienko, Denis (2009) Charge transport in semiconductors with multiscale conformational dynamics. Physical Review Letters, Vol.102 (No.11). article no.116602 . doi:10.1103/PhysRevLett.102.116602 ISSN 0031-9007.
Rahimi, Maryam and Troisi, Alessandro (2009) Probing local electric field and conformational switching in single-molecule break junctions. Physical Review B (Condensed Matter and Materials Physics), Vol.79 (No.11). article no. 113413 . doi:10.1103/PhysRevB.79.113413 ISSN 1098-0121.
Cheung, David L. and Troisi, Alessandro (2009) Molecular structure and phase behaviour of hairy-rod polymers. Physical Chemistry Chemical Physics, Vol.11 (No.12). pp. 2105-2112. doi:10.1039/b818428c ISSN 1463-9076.
Troisi, Alessandro (2008) Inelastic electron tunnelling in saturated molecules with different functional groups : correlations and symmetry considerations from a computational study. Journal of Physics-Condensed Matter, Vol.20 (No.37). Article: 374111. doi:10.1088/0953-8984/20/37/374111 ISSN 0953-8984.
Cheung, David L. and Troisi, Alessandro (2008) Modelling charge transport in organic semiconductors : from quantum dynamics to soft matter. Physical Chemistry Chemical Physics, Vol.10 (No.39). pp. 5941-5952. ISSN 1463-9076 doi:10.1039/b807750a
Engineering and Physical Sciences Research Council (EPSRC)
Ambrosio, Francesco, Martsinovich, Natalia and Troisi, Alessandro (2012) Effect of the anchoring group on electron injection : theoretical study of phosphonated dyes for dye-sensitized solar cells. Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.116 (No.3). pp. 2622-2629. doi:10.1021/jp209823t ISSN 1932-7447.
European Research Council
Martsinovich, Natalia and Troisi, Alessandro (2011) Theoretical studies of dye-sensitised solar cells: from electronic structure to elementary processes. Energy & Environmental Science, 4 (11). p. 4473. doi:10.1039/c1ee01906f ISSN 1754-5692.
European Research Council (ERC)
Knee, George C., Rowe, Patrick, Smith, Luke, Troisi, Alessandro and Datta, Animesh (2017) Structure-dynamics relation in physically-plausible multi-chromophore systems. The Journal of Physical Chemistry Letters, 8 (10). pp. 2328-2333. doi:10.1021/acs.jpclett.7b00829 ISSN 1948-7185.
Lee, Myeong H. and Troisi, Alessandro (2017) Vibronic enhancement of excitation energy transport : interplay between local and non-local exciton-phonon interaction. Journal of Chemical Physics, 146 (7). 075101. ISSN 0021-9606.
Kuzmich, Alina, Padula, Daniele, Ma, Haibo and Troisi, Alessandro (2017) Trends in the electronic and geometric structure of non-fullerene based acceptors for organic solar cells. Energy & Environmental Science, 10 (2). 395-401 . doi:10.1039/C6EE03654F ISSN 1754-5692.
Troisi, Alessandro and Shaw, Alex (2016) Very large Ο-conjugation despite strong nonplanarity : a path for designing new semiconducting polymers. The Journal of Physical Chemistry Letters, 7 (22). pp. 4689-4694. doi:10.1021/acs.jpclett.6b02367 ISSN 1948-7185.
Ip, Chung Man and Troisi, Alessandro (2016) A computational study of the competing reaction mechanisms of the photo-catalytic reduction of CO2 on anatase(101). Physical Chemistry Chemical Physics, 18 (36). pp. 25010-25021. doi:10.1039/C6CP02642G ISSN 1463-9076.
Lee, Myeong H. and Troisi, Alessandro (2016) Quantum dynamics of a vibronically coupled linear chain using a surrogate Hamiltonian approach. The Journal of Chemical Physics, 144 (21). 214106. doi:10.1063/1.4953043 ISSN 0021-9606.
AragΓ³, Juan and Troisi, Alessandro (2016) Regimes of exciton transport in molecular crystals in the presence of dynamic disorder. Advanced Functional Materials, 26 (14). pp. 2316-2325. doi:10.1002/adfm.201503888 ISSN 1616-301X.
Fornari, Rocco P., AragΓ³, Juan and Troisi, Alessandro (2016) Exciton dynamics in phthalocyanine molecular crystals. The Journal of Physical Chemistry C, 120 (15). pp. 7987-7996. doi:10.1021/acs.jpcc.6b01298 ISSN 1932-7447.
Do, Hainam and Troisi, Alessandro (2015) Developing accurate molecular mechanics force fields for conjugated molecular systems. Physical Chemistry Chemical Physics, 17 (38). pp. 25123-25132. doi:10.1039/C5CP04328J ISSN 1463-9076.
Lee, Myeong H., AragΓ³, Juan and Troisi, Alessandro (2015) Charge dynamics in organic photovoltaic materials : interplay between quantum diffusion and quantum relaxation. The Journal of Physical Chemistry Part C, 119 (27). pp. 14989-14998. doi:10.1021/acs.jpcc.5b03989 ISSN 1932-7447.
Fornari, Rocco P., AragΓ³, Juan and Troisi, Alessandro (2015) A very general rate expression for charge hopping in semiconducting polymers. The Journal of Chemical Physics, 142 (18). 184105. doi:10.1063/1.4920945 ISSN 0021-9606.
AragΓ³, Juan and Troisi, Alessandro (2015) Excitonic couplings between molecular crystal pairs by a multistate approximation. The Journal of Chemical Physics, 142 (16). 164107. doi:10.1063/1.4919241 ISSN 0021-9606.
AragΓ³, Juan and Troisi, Alessandro (2015) Dynamics of the excitonic coupling in organic crystals. Physical Review Letters, 114 (2). 026402. doi:10.1103/PhysRevLett.114.026402 ISSN 0031-9007.
Ambrosio, Francesco and Troisi, Alessandro (2014) Singlet fission in linear chains of molecules. The Journal of Chemical Physics, 141 (20). 204703. doi:10.1063/1.4902135 ISSN 0021-9606.
Ma, Haibo and Troisi, Alessandro (2014) Modulating the exciton dissociation rate by up to more than two orders of magnitude by controlling the alignment of LUMO + 1 in organic photovoltaics. The Journal of Physical Chemistry C, 118 (47). pp. 27272-27280. doi:10.1021/jp5098102 ISSN 1932-7447.
Ma, Haibo, Qin, Ting and Troisi, Alessandro (2014) Electronic excited states in amorphous MEH-PPV polymers from large-scale first principles calculations. Journal of Chemical Theory and Computation, Volume 10 (Number 3). pp. 1272-1282. doi:10.1021/ct4010799 ISSN 1549-9618.
Maggio, Emanuele and Troisi, Alessandro (2013) Theory of the charge recombination reaction at the semiconductorβadsorbate interface in the presence of defects. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Volume 117 (Number 46). pp. 24196-24205. doi:10.1021/jp4080515 ISSN 1932-7447.
McMahon, David Paul, Cheung, David L. and Troisi, Alessandro (2011) Why holes and electrons separate so well in polymer/fullerene photovoltaic cells. Journal of Physical Chemistry Letters, Vol.2 (No.21). pp. 2737-2741. doi:10.1021/jz201325g ISSN 1948-7185.
McMahon, David Paul, Cheung, David L., Goris, Ludwig, DacuΓ±a, Javier, Salleo, Alberto and Troisi, Alessandro (2011) Relation between microstructure and charge transport in polymers of different regioregularity. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.115 (No.39). pp. 19386-19393. doi:10.1021/jp207026s ISSN 1932-7447.
Martsinovich, Natalia and Troisi, Alessandro (2011) High-throughput computational screening of chromophores for dye-sensitized solar cells. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.115 (No.23). pp. 11781-11792. doi:10.1021/jp2026847 ISSN 1932-7447.
Liu, Tao and Troisi, Alessandro (2011) Absolute rate of charge separation and recombination in a molecular model of the P3HT/PCBM interface. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.115 (No.5). pp. 2406-2415. doi:10.1021/jp109130y ISSN 1932-7447.
Troisi, Alessandro (2011) Charge transport in high mobility molecular semiconductors : classical models and new theories. Chemical Society Reviews, Vol.40 (No.5). pp. 2347-2358. doi:10.1039/c0cs00198h ISSN 0306-0012.
McMahon, David Paul and Troisi, Alessandro (2011) Persistence time of charge carriers in defect states of molecular semiconductors. Physical Chemistry Chemical Physics, Vol.13 (No.21). p. 10241. doi:10.1039/c1cp20192a ISSN 1463-9076.
Liu, Tao, Cheung, David L. and Troisi, Alessandro (2011) Structural variability and dynamics of the P3HT/PCBM interface and its effects on the electronic structure and the charge-transfer rates in solar cells. Physical Chemistry Chemical Physics, Vol.13 (No.48). pp. 21461-21470. doi:10.1039/c1cp23084k ISSN 1463-9076.
Martsinovich, Natalia and Troisi, Alessandro (2011) Theoretical studies of dye-sensitised solar cells : from electronic structure to elementary processes. Energy & Environmental Science, Vol.4 (No.11). pp. 4473-4495. doi:10.1039/c1ee01906f ISSN 1754-5692.
Cheung, David L. and Troisi, Alessandro (2010) Theoretical study of the organic photovoltaic electron acceptor PCBM : morphology, electronic structure, and charge localization. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.114 (No.48). pp. 20479-20488. doi:10.1021/jp1049167 ISSN 1932-7447.
European Research Council (ERC)
Ambrosio, Francesco, Martsinovich, Natalia and Troisi, Alessandro (2012) Effect of the anchoring group on electron injection : theoretical study of phosphonated dyes for dye-sensitized solar cells. Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.116 (No.3). pp. 2622-2629. doi:10.1021/jp209823t ISSN 1932-7447.
Fonds national de la recherche scientifique (Belgium) (FNRS)
Chang, Jui-Fen, Sakanoue, Tomo, Olivier, Yoann, Uemura, Takafumi, Dufourg-Madec, Marie-Beatrice, Yeates, Stephen, Cornil, JΓ©rΓ΄me, Takeya, Jun, Troisi, Alessandro and Sirringhaus, Henning (2011) Hall-effect measurements probing the degree of charge-carrier delocalization in solution-processed crystalline molecular semiconductors. Physical Review Letters, Vol.107 (No.6). Article 066601 . doi:10.1103/PhysRevLett.107.066601 ISSN 0031-9007.
Germany. Bundesministerium fΓΌr Bildung und Forschung [Germany. Federal Ministry of Education and Research] (BMBF)
Vehoff, Thorsten, Baumeier, Bjoern, Troisi, Alessandro and Andrienko, Denis (2010) Charge transport in organic crystals : role of disorder and topological connectivity. Journal of the American Chemical Society, Vol.132 (No.33). pp. 11702-11708. doi:10.1021/ja104380c ISSN 0002-7863.
Vehoff, Thorsten, Chung, Yeon Sook, Johnston, K. (Karen), Troisi, Alessandro, Yoon, Do Y. and Andrienko, Denis (2010) Charge transport in self-assembled semiconducting organic layers : role of dynamic and static disorder. Journal of Physical Chemistry C, Vol.114 (No.23). pp. 10592-10597. doi:10.1021/jp101738g ISSN 1932-7447.
Gordon and Betty Moore Foundation
Rahimi, Maryam and Troisi, Alessandro (2009) Probing local electric field and conformational switching in single-molecule break junctions. Physical Review B (Condensed Matter and Materials Physics), Vol.79 (No.11). article no. 113413 . doi:10.1103/PhysRevB.79.113413 ISSN 1098-0121.
Great Britain. Royal Commission for the Exhibition of 1851
Knee, George C., Rowe, Patrick, Smith, Luke, Troisi, Alessandro and Datta, Animesh (2017) Structure-dynamics relation in physically-plausible multi-chromophore systems. The Journal of Physical Chemistry Letters, 8 (10). pp. 2328-2333. doi:10.1021/acs.jpclett.7b00829 ISSN 1948-7185.
Guo jia zi ran ke xue ji jin wei yuan hui (China) [National Natural Science Foundation of China] (NSFC)
Ma, Haibo and Troisi, Alessandro (2014) Modulating the exciton dissociation rate by up to more than two orders of magnitude by controlling the alignment of LUMO + 1 in organic photovoltaics. The Journal of Physical Chemistry C, 118 (47). pp. 27272-27280. doi:10.1021/jp5098102 ISSN 1932-7447.
Ma, Haibo, Qin, Ting and Troisi, Alessandro (2014) Electronic excited states in amorphous MEH-PPV polymers from large-scale first principles calculations. Journal of Chemical Theory and Computation, Volume 10 (Number 3). pp. 1272-1282. doi:10.1021/ct4010799 ISSN 1549-9618.
Italy. Ministero dell'istruzione, dell'universitΓ e della ricerca [ Ministry of Education, Universities and Research (Italy)] (MIUR)
Cannazza, Giuseppe, Carrozzo, Marina M., Battisti, Umberto, Braghiroli, Daniela, Parenti, Carlo, Troisi, Alessandro and Troisi, Luigino (2010) Determination of kinetic parameters of enantiomerization of benzothiadiazines by DCXplorer. Chirality, Vol.22 (No.9). pp. 789-797. doi:10.1002/chir.20838 ISSN 0899-0042.
Korean Science and Engineering Foundation (KOSEF)
Vehoff, Thorsten, Chung, Yeon Sook, Johnston, K. (Karen), Troisi, Alessandro, Yoon, Do Y. and Andrienko, Denis (2010) Charge transport in self-assembled semiconducting organic layers : role of dynamic and static disorder. Journal of Physical Chemistry C, Vol.114 (No.23). pp. 10592-10597. doi:10.1021/jp101738g ISSN 1932-7447.
Leverhulme Trust (LT)
McMahon, David Paul, Cheung, David L., Goris, Ludwig, DacuΓ±a, Javier, Salleo, Alberto and Troisi, Alessandro (2011) Relation between microstructure and charge transport in polymers of different regioregularity. The Journal of Physical Chemistry Part C: Nanomaterials, Interfaces and Hard Matter, Vol.115 (No.39). pp. 19386-19393. doi:10.1021/jp207026s ISSN 1932-7447.
Troisi, Alessandro (2011) Charge transport in high mobility molecular semiconductors : classical models and new theories. Chemical Society Reviews, Vol.40 (No.5). pp. 2347-2358. doi:10.1039/c0cs00198h ISSN 0306-0012.
Troisi, Alessandro (2011) The speed limit for sequential charge hopping in molecular materials. Organic Electronic, Vol.12 (No.12). pp. 1988-1991. doi:10.1016/j.orgel.2011.08.020 ISSN 1566-1199.
Fortuna, S. (Sara) and Troisi, Alessandro (2010) Agent-based modeling for the 2D molecular self-organization of realistic molecules. Journal of Physical Chemistry B, Vol.114 (No.31). pp. 10151-10159. doi:10.1021/jp103950m ISSN 1520-6106.
Martsinovich, Natalia and Troisi, Alessandro (2010) Modeling the self-assembly of benzenedicarboxylic acids using Monte Carlo and molecular dynamics simulations. Journal of Physical Chemistry C, Vol.114 (No.10). pp. 4376-4388. doi:10.1021/jp911671b ISSN 1932-7447.
Fortuna, S. (Sara), Cheung, David L. and Troisi, Alessandro (2010) Hexagonal lattice model of the patterns formed by hydrogen-bonded molecules on the surface. Journal of Physical Chemistry B, Vol.114 (No.5). pp. 1849-1858. doi:10.1021/jp9098649 ISSN 1520-6106.
Troisi, Alessandro (2010) Quantum dynamic localization in the Holstein Hamiltonian at finite temperatures. Physical Review B (Condensed Matter and Materials Physics), Vol.82 (No.24). article no. 245202 . doi:10.1103/PhysRevB.82.245202 ISSN 1098-0121.
Fortuna, S. (Sara), Colard, Catheline A. L., Troisi, Alessandro and Bon, Stefan Antonius Franciscus (2009) Packing patterns of silica nanoparticles on surfaces of armored polystyrene latex particles. Langmuir, Vol.25 (No.21). pp. 12399-12403. doi:10.1021/la9010289 ISSN 0743-7463.
Fortuna, S. (Sara) and Troisi, Alessandro (2009) An artificial intelligence approach for modeling molecular self-assembly : agent-based simulations of rigid molecules. Journal of Physical Chemistry B, Vol.113 (No.29). pp. 9877-9885. doi:10.1021/jp9030442 ISSN 1520-6106.
Bhattacharyay, A. and Troisi, Alessandro (2008) Self-assembly of sparsely distributed molecules : an efficient cluster algorithm. Chemical Physics Letters, Vol.458 (No.1-3). pp. 210-213. doi:10.1016/j.cplett.2008.04.052 ISSN 0009-2614.
Marie Curie Intra-European Fellowship (IEF)
Lee, Myeong H., AragΓ³, Juan and Troisi, Alessandro (2015) Charge dynamics in organic photovoltaic materials : interplay between quantum diffusion and quantum relaxation. The Journal of Physical Chemistry Part C, 119 (27). pp. 14989-14998. doi:10.1021/acs.jpcc.5b03989 ISSN 1932-7447.
Max-Planck-Gesellschaft zur FΓΆrderung der Wissenschaften [Max Planck Society]
Vehoff, Thorsten, Chung, Yeon Sook, Johnston, K. (Karen), Troisi, Alessandro, Yoon, Do Y. and Andrienko, Denis (2010) Charge transport in self-assembled semiconducting organic layers : role of dynamic and static disorder. Journal of Physical Chemistry C, Vol.114 (No.23). pp. 10592-10597. doi:10.1021/jp101738g ISSN 1932-7447.
Monash-Warwick Alliance
Knee, George C., Rowe, Patrick, Smith, Luke, Troisi, Alessandro and Datta, Animesh (2017) Structure-dynamics relation in physically-plausible multi-chromophore systems. The Journal of Physical Chemistry Letters, 8 (10). pp. 2328-2333. doi:10.1021/acs.jpclett.7b00829 ISSN 1948-7185.
Royal Society (Great Britain)
Troisi, Alessandro (2008) Inelastic electron tunnelling in saturated molecules with different functional groups : correlations and symmetry considerations from a computational study. Journal of Physics-Condensed Matter, Vol.20 (No.37). Article: 374111. doi:10.1088/0953-8984/20/37/374111 ISSN 0953-8984.
Seventh Framework Programme (European Commission) (FP7)
AragΓ³, Juan and Troisi, Alessandro (2016) Regimes of exciton transport in molecular crystals in the presence of dynamic disorder. Advanced Functional Materials, 26 (14). pp. 2316-2325. doi:10.1002/adfm.201503888 ISSN 1616-301X.
Fornari, Rocco P., AragΓ³, Juan and Troisi, Alessandro (2016) Exciton dynamics in phthalocyanine molecular crystals. The Journal of Physical Chemistry C, 120 (15). pp. 7987-7996. doi:10.1021/acs.jpcc.6b01298 ISSN 1932-7447.
Fornari, Rocco P., AragΓ³, Juan and Troisi, Alessandro (2015) A very general rate expression for charge hopping in semiconducting polymers. The Journal of Chemical Physics, 142 (18). 184105. doi:10.1063/1.4920945 ISSN 0021-9606.
AragΓ³, Juan and Troisi, Alessandro (2015) Excitonic couplings between molecular crystal pairs by a multistate approximation. The Journal of Chemical Physics, 142 (16). 164107. doi:10.1063/1.4919241 ISSN 0021-9606.
AragΓ³, Juan and Troisi, Alessandro (2015) Dynamics of the excitonic coupling in organic crystals. Physical Review Letters, 114 (2). 026402. doi:10.1103/PhysRevLett.114.026402 ISSN 0031-9007.
Technology Strategy Board (Great Britain)
Chang, Jui-Fen, Sakanoue, Tomo, Olivier, Yoann, Uemura, Takafumi, Dufourg-Madec, Marie-Beatrice, Yeates, Stephen, Cornil, JΓ©rΓ΄me, Takeya, Jun, Troisi, Alessandro and Sirringhaus, Henning (2011) Hall-effect measurements probing the degree of charge-carrier delocalization in solution-processed crystalline molecular semiconductors. Physical Review Letters, Vol.107 (No.6). Article 066601 . doi:10.1103/PhysRevLett.107.066601 ISSN 0031-9007.
University of Warwick Institute of Advanced Study Scholarship
Kuzmich, Alina, Padula, Daniele, Ma, Haibo and Troisi, Alessandro (2017) Trends in the electronic and geometric structure of non-fullerene based acceptors for organic solar cells. Energy & Environmental Science, 10 (2). 395-401 . doi:10.1039/C6EE03654F ISSN 1754-5692.
University of Warwick. Centre for Scientific Computing
Cheung, David L., McMahon, David Paul and Troisi, Alessandro (2009) Computational study of the structure and charge-transfer parameters in low-molecular-mass P3HT. Journal of Physical Chemistry B, Vol.113 (No.28). pp. 9393-9401. doi:10.1021/jp904057m ISSN 1520-6106.
This list was generated on Sat Apr 20 00:01:28 2024 BST.