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Oscar A. Douglas-Gallardo
Oscar A. Douglas-Gallardo
Verified email at warwick.ac.uk
Title
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Cited by
Year
Silver oxide particles/silver nanoparticles interconversion: susceptibility of forward/backward reactions to the chemical environment at room temperature
OAD Gallardo, R Moiraghi, MA Macchione, JA Godoy, MA Pérez, ...
RSC advances 2 (7), 2923-2929, 2012
1032012
Atomistic insights into chemical interface damping of surface plasmon excitations in silver nanoclusters
OA Douglas-Gallardo, M Berdakin, CG Sánchez
The Journal of Physical Chemistry C 120 (42), 24389-24399, 2016
742016
Plasmon-induced hot-carrier generation differences in gold and silver nanoclusters
OA Douglas-Gallardo, M Berdakin, T Frauenheim, CG Sánchez
Nanoscale 11 (17), 8604-8615, 2019
562019
Plasmon-driven sub-picosecond breathing of metal nanoparticles
FP Bonafé, B Aradi, M Guan, OA Douglas-Gallardo, C Lian, S Meng, ...
Nanoscale 9 (34), 12391-12397, 2017
382017
Effects of oxidation on the plasmonic properties of aluminum nanoclusters
OA Douglas-Gallardo, GJ Soldano, MM Mariscal, CG Sánchez
Nanoscale 9 (44), 17471-17480, 2017
302017
Interplay between intra-and interband transitions associated with the plasmon-induced hot carrier generation process in silver and gold nanoclusters
M Berdakin, OA Douglas-Gallardo, CG Sánchez
The Journal of Physical Chemistry C 124 (2), 1631-1639, 2019
192019
Plasmonic enhancement of molecular hydrogen dissociation on metallic magnesium nanoclusters
OA Douglas-Gallardo, CL Box, RJ Maurer
Nanoscale 13 (25), 11058-11068, 2021
112021
Physico-chemistry of a successful micro-reactor: Random coils of chitosan backbones used to synthesize size-controlled silver nanoparticles
OA Douglas-Gallardo, CA Christensen, MC Strumia, MA Pérez, ...
Carbohydrate polymers 225, 115241, 2019
112019
Electronic structure benchmark calculations of CO2 fixing elementary chemical steps in RuBisCO using the projector‐based embedding approach
OA Douglas‐Gallardo, I Shepherd, SJ Bennie, KE Ranaghan, ...
Journal of Computational Chemistry 41 (24), 2151-2157, 2020
102020
Gold nucleation inhibition by halide ions: a basis for a seed-mediated approach
R Moiraghi, OA Douglas-Gallardo, EA Coronado, VA Macagno, MA Perez
Rsc Advances 5 (25), 19329-19336, 2015
102015
NQCDynamics. jl: A Julia package for nonadiabatic quantum classical molecular dynamics in the condensed phase
J Gardner, OA Douglas-Gallardo, WG Stark, J Westermayr, SM Janke, ...
The Journal of Chemical Physics 156 (17), 2022
92022
Electronic structure benchmark calculations of inorganic and biochemical carboxylation reactions
OA Douglas‐Gallardo, DA Saez, S Vogt‐Geisse, E Vöhringer‐Martinez
Journal of computational chemistry 40 (13), 1401-1413, 2019
62019
A systematic electronic structure study of the O–O bond dissociation energy of hydrogen peroxide and the electron affinity of the hydroxyl radical
DJ Carmona, DR Contreras, OA Douglas-Gallardo, S Vogt-Geisse, ...
Theoretical Chemistry Accounts 137, 1-11, 2018
62018
Carbon dioxide fixation in ruBisCO is protonation-state-dependent and irreversible
OA Douglas-Gallardo, JA Murillo-López, J Oller, AJ Mulholland, ...
ACS Catalysis 12 (15), 9418-9429, 2022
52022
Morphological evolution of noble metal nanoparticles in chloroform: mechanism of switching on/off by protic species
OA Douglas-Gallardo, CG Gomez, MA Macchione, FP Cometto, ...
RSC advances 5 (122), 100488-100497, 2015
52015
One-step/one-pot decoration of oxide microparticles with silver nanoparticles
MA Macchione, OA Douglas-Gallardo, LA Pérez, N Passarelli, R Moiraghi, ...
Journal of colloid and interface science 428, 32-35, 2014
32014
Machine Learning Interatomic Potentials for Reactive Hydrogen Dynamics at Metal Surfaces Based on Iterative Refinement of Reaction Probabilities
WG Stark, J Westermayr, OA Douglas-Gallardo, J Gardner, S Habershon, ...
The Journal of Physical Chemistry C 127 (50), 24168-24182, 2023
12023
Importance of equivariant features in machine-learning interatomic potentials for reactive chemistry at metal surfaces
WG Stark, J Westermayr, OA Douglas-Gallardo, J Gardner, S Habershon, ...
arXiv preprint arXiv:2305.10873, 2023
12023
Communication: Photoinduced carbon dioxide binding with surface-functionalized silicon quantum dots
OA Douglas-Gallardo, CG Sánchez, E Vöhringer-Martinez
The Journal of Chemical Physics 148 (14), 2018
12018
Machine Learning Accelerated Nonadiabatic Dynamics at Metal Surfaces
J Westermayr, OA Douglas-Gallardo, SM Janke, RJ Maurer
Elsevier, 2024
2024
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Articles 1–20