por salamanca | May 25, 2023 | 2023
Do we need delocalised wavefunctions in the excited state dynamics of 1,1-difluoroethylene? Authors: S. Gómez, N. Singer, G. A. Worth, L. González Ref. Canadian Journal of Chemistry, (2023) https://doi.org/10.1139/cjc-2022-0267
por salamanca | May 24, 2023 | 2023
Rotational state-changes in C5N− by collisions with He and H2 Authors: R. Biswas, K. Giri, L. González-Sánchez, F. A. Gianturco, U. Lourderaj, N. Sathyamurthy, A. Veselinova, E. Yurtsever, R. Wester Ref. Monthly Notices of the Royal Astronomical Society, 522 (4),...
por salamanca | May 24, 2023 | 2023
Spin-Forbidden addition of molecular oxygen to stable enol intermediates-decarboxylation of 2-Methyl-1-tetralone-2-carboxylic acid Authors: P. Ortega, S. Gil-Guerrero, L. González-Sánchez, C. Sanz-Sanz and P. G. Jambrina Ref. Int. J. Mol. Sci., 24(8), 7424 (2023) ...
por salamanca | Abr 21, 2021 | 2021
DpgC‐Catalyzed Peroxidation of 3,5‐Dihydroxyphenylacetyl‐CoA (DPA‐CoA): Insights into the Spin‐Forbidden Transition and Charge Transfer Mechanisms Authors: Pablo Ortega, Alexandre Zanchet, Cristina Sanz-Sanz, Susana Gómez-Carrasco, Lola González-Sánchez, Pablo G....
por salamanca | Abr 19, 2021 | 2021
Multi and single-reference methods for the analysis of multi-state peroxidation of enolates Authors: P. Ortega, S. Gil-Guerrero, A. Veselinova, A. Zanchet, L. González-Sánchez, P. G. Jambrina, and C. Sanz-Sanz Ref. J. Chem. Phys. 154, 144303 (2021)...
