Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5383385 | Chemical Physics Letters | 2012 | 6 Pages |
Abstract
⺠ECG-NOMO is a rigorous non-Born-Oppenheimer theory. ⺠The electron-electron correlation is important for ECG-NOMO. ⺠We propose the correlation methodologies for the ECG-NOMO theory. ⺠The ECG-NOMO zero-point energies are close to the experimental results.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Hiroaki Nishizawa, Yutaka Imamura, Yasuhiro Ikabata, Hiromi Nakai,