SurfinPES: Performing automated analysis of activation strain, energy decomposition, and reaction force

  1. Quintal, A.
  2. Dzib, E.
  3. Murillo, F.
  4. Ortíz-Chi, F.
  5. Fernández, I.
  6. Merino, G.
Revue:
International Journal of Quantum Chemistry

ISSN: 1097-461X,  0020-7608

Année de publication: 2024

Volumen: 124

Número: 1

Type: Article

DOI: 10.1002/QUA.27194 GOOGLE SCHOLAR lock_openAccès ouvert editor
La source de données: Scopus