| Ultrafast real-time dynamics of CO oxidation over an oxide photocatalyst M Wagstaffe, L Wenthaus, A Dominguez-Castro, S Chung, ... ACS catalysis 10 (22), 13650-13658, 2020 | 26 | 2020 |
| Photoinduced charge-transfer in chromophore-labeled gold nanoclusters: quantum evidence of the critical role of ligands and vibronic couplings A Domínguez-Castro, CR Lien-Medrano, K Maghrebi, S Messaoudi, ... Nanoscale 13 (14), 6786-6797, 2021 | 18 | 2021 |
| Insights into the interactions of biomolecules with small gold clusters: a theoretical study from a DFTB perspective A Domínguez-Castro, D Hernández, F Guzmán Theoretical Chemistry Accounts 136 (7), 84, 2017 | 17 | 2017 |
| Photoinduced Dynamics at the Interface M Wagstaffe, A Dominguez-Castro, L Wenthaus, S Palutke, D Kutnyakhov, ... Physical review letters 130 (10), 108001, 2023 | 12 | 2023 |
| Impact of vibronic coupling effects on light-driven charge transfer in pyrene-functionalized middle and large-sized metalloid gold nanoclusters from Ehrenfest dynamics A Domínguez-Castro, T Frauenheim Physical Chemistry Chemical Physics 23 (32), 17129-17133, 2021 | 12 | 2021 |
| Chemical repair of protein carbon-centred radicals: Long-distance dynamic factors R Castañeda-Arriaga, A Domínguez-Castro, JG Lee, JR Alvarez-Idaboy, ... Canadian Journal of Chemistry 94 (12), 1119-1126, 2016 | 8 | 2016 |
| DFT and machine learning for predicting hydrogen adsorption energies on rocksalt complex oxides A Domínguez-Castro Theoretical Chemistry Accounts 143 (6), 50, 2024 | 6 | 2024 |
| Adsorption on a nanoporous organic polymer for clean energy applications: A multiscale modeling study using density functional tight binding approach A Domínguez-Castro, F Guzmán, Y Novo-Fernández Computational and Theoretical Chemistry 1102, 30-37, 2017 | 6 | 2017 |
| Theoretical investigation on light-driven ultrafast dynamics at the nanoscale AD Castro Universität Bremen, 2022 | | 2022 |
Thomas FrauenheimProfessor für Computational Materials ScienceVerified email at bccms.uni-bremen.de
