INVESTIGADORES
BEN ALTABEF Aida
artículos
Título:
The force constants in the isoelectronic serie CF3SO2X (X=F, OH, NH2, CH3): a study based on DFT calculations and experimental data
Autor/es:
L. E. FERNÁNDEZ; A. BEN ALTABEF; E. L. VARETTI
Revista:
JOURNAL OF MOLECULAR STRUCTURE
Editorial:
ELSEVIER SCIENCE BV
Referencias:
Año: 2002 vol. 612 p. 1 - 11
ISSN:
0022-2860
Resumen:
Density functional theory calculations at the B3LYP/6-31G(d,p) level of theory was performed on the members of the electronic series CF3SO2X (X= F, OH, NH2, CH3). Density functional theory calculations at the B3LYP/6-31G(d,p) level of theory was performed on the members of the electronic series CF3SO2X (X= F, OH, NH2, CH3).
