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Leonardo Evaristo de Sousa
Leonardo Evaristo de Sousa
Department of Energy Conversion and Storage, Technical University of Denmark
Verifierad e-postadress på dtu.dk
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Revealing the internal heavy chalcogen atom effect on the photophysics of the dibenzo [a, j] phenazine-cored donor–acceptor–donor triad
S Goto, Y Nitta, NO Decarli, LE de Sousa, P Stachelek, N Tohnai, ...
Journal of Materials Chemistry C 9 (39), 13942-13953, 2021
392021
Unified framework for photophysical rate calculations in tadf molecules
LE de Sousa, P de Silva
Journal of Chemical Theory and Computation 17 (9), 5816-5824, 2021
362021
The regioisomeric effect on the excited-state fate leading to room-temperature phosphorescence or thermally activated delayed fluorescence in a dibenzophenazine-cored donor …
T Hosono, NO Decarli, PZ Crocomo, T Goya, LE de Sousa, N Tohnai, ...
Journal of Materials Chemistry C 10 (12), 4905-4913, 2022
302022
Tuning penta-Graphene electronic properties through engineered Line Defects
RM Santos, LE Sousa, DS Galvão, LA Ribeiro
Scientific reports 10 (1), 8014, 2020
272020
Kinetic Monte Carlo model for the COVID-19 epidemic: Impact of mobility restriction on a COVID-19 outbreak
LE de Sousa, PHO Neto, DAS Filho
Physical Review E 102 (3), 032133, 2020
242020
On the physical origins of charge separation at donor–acceptor interfaces in organic solar cells: Energy bending versus energy disorder
LE de Sousa, V Coropceanu, DA da Silva Filho, G Sini
Advanced Theory and Simulations 3 (4), 1900230, 2020
232020
Fast predictions of exciton diffusion length in organic materials
LE de Sousa, FT Bueno, GM e Silva, DA da Silva Filho, ...
Journal of Materials Chemistry C 7 (14), 4066-4071, 2019
212019
A DFT study of a set of natural dyes for organic electronics
IT Lima, L Sousa, RS Freitas, LAR Junior, RT de Sousa Júnior, ...
Journal of molecular modeling 23, 1-9, 2017
202017
Ultrafast direct generation of quasiparticles in graphene nanoribbons
MM Fischer, LAR Junior, WF da Cunha, LE de Sousa, GM e Silva, ...
Carbon 158, 553-558, 2020
182020
Triplet-to-singlet exciton transfer in hyperfluorescent OLED materials
LE de Sousa, L dos Santos Born, PH de Oliveira Neto, P de Silva
Journal of Materials Chemistry C 10 (12), 4914-4922, 2022
172022
Dual-photofunctional organogermanium compound based on donor–acceptor–donor architecture
A Nyga, T Kaihara, T Hosono, M Sipala, P Stachelek, N Tohnai, ...
Chemical Communications 58 (39), 5889-5892, 2022
162022
Role of exciton density in organic materials: Diffusion length, lifetime, and quantum efficiency
LE de Sousa, FT Bueno, L Ribeiro, LA Ribeiro Junior, DA da Silva Filho, ...
Chemistry of Materials 31 (17), 6818-6823, 2019
162019
Modeling the emission spectra of organic molecules: A competition between franck–condon and nuclear ensemble methods
LE de Sousa, LA Ribeiro, ALA Fonseca, DA da Silva Filho
The Journal of Physical Chemistry A 120 (27), 5380-5388, 2016
162016
Smooth gap tuning strategy for cove-type graphene nanoribbons
TSA Cassiano, FF Monteiro, LE de Sousa, GM e Silva, ...
RSC advances 10 (45), 26937-26943, 2020
152020
Exciton diffusion in organic nanofibers: A monte carlo study on the effects of temperature and dimensionality
LE de Sousa, DA da Silva Filho, RT de Sousa Jr, PH de Oliveira Neto
Scientific reports 8 (1), 14066, 2018
142018
Modeling temperature dependent singlet exciton dynamics in multilayered organic nanofibers
LE de Sousa, PH de Oliveira Neto, J Kjelstrup-Hansen, DA da Silva Filho
The Journal of Chemical Physics 148 (20), 2018
102018
Photophysics of solvated molecules: Computational protocol combining nuclear ensemble and nonequilibrium state-specific solvation methods
LE de Sousa, P de Silva
The Journal of Physical Chemistry A 127 (39), 8200-8208, 2023
92023
Diabatic decomposition perspective on the role of charge transfer and local excitations in thermally activated delayed fluorescence
LE de Sousa, P de Silva
Journal of Chemical Theory and Computation 18 (9), 5459-5470, 2022
92022
Charge transport in cove-type graphene nanoribbons: The role of quasiparticles
TSA Cassiano, LE de Sousa, LAR Junior, GM e Silva, PH de Oliveira Neto
Synthetic Metals 287, 117056, 2022
92022
A New Entry to Purely Organic Thermally Activated Delayed Fluorescence Emitters Based on Pyrido[2,3‐b]pyrazine‐Dihydrophenazasilines Donor‐Acceptor Dyad
T Goya, P Zimmermann Crocomo, T Hosono, S Minakata, LE de Sousa, ...
Asian Journal of Organic Chemistry 11 (3), e202100780, 2022
92022
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Artiklar 1–20