论文信息 - Decomposition of Normal-Coordinate Vibrational Frequencies - 字舞流文

Decomposition of Normal-Coordinate Vibrational Frequencies

L'utilite de la methode est demontree via une application a quelques hydrures et cycloalcanes simples

Mark S. Gordon | Jerry A. Boatz | M. Gordon | J. Boatz

[1] L. A. Woodward. Introduction to the theory of molecular vibrations and vibrational spectroscopy , 1972 .

[2] P. Pulay,et al. Direct Use of the Gradient for Investigating Molecular Energy Surfaces , 1977 .