Article ISI SCOPUS
JOURNAL OF MOLECULAR MODELING  (2015)

New insights into steric and electronic effects in a series of phosphine ligands from the perspective of local quantum similarity using the Fukui function

Morales-Bayuelo, A; Caballero, J

Keywords: Density functional theory; Molecular quantum similarity; Phosphine ligand; Reactivity descriptor

Más información

Título según WOS: New insights into steric and electronic effects in a series of phosphine ligands from the perspective of local quantum similarity using the Fukui function
Título según SCOPUS: New insights into steric and electronic effects in a series of phosphine ligands from the perspective of local quantum similarity using the Fukui function
Título de la Revista: JOURNAL OF MOLECULAR MODELING
Volumen: 21
Número: 3
Editorial: Springer
Fecha de publicación: 2015
Idioma: English
DOI:

10.1007/s00894-015-2600-x
Notas: ISI, SCOPUS