正高级
Supervisor of Doctorate Candidates
Supervisor of Master's Candidates
Hits:
Impact Factor:2.976
DOI number:10.1002/jcc.26523
Affiliation of Author(s):扬州大学
Teaching and Research Group:物理化学
Journal:Journal of Computational Chemistry
Key Words:chemical bonding, natural resonance theory, resonance theory, valence bond theory, wave function analysis
Abstract:I reply to the comment by Weinhold and Glendening on the article (J. Comput. Chem. 2021, 42, 412). I provide further explanation and an additional numerical example to support my previous assertion that the present form of natural resonance theory is fundamentally flawed, at least within the DFT framework.
First Author:Yang Wang
Indexed by:SCI、
Discipline:Natural Science
Document Type:SCI
Volume:42
Issue:19
Page Number:1341-1343
Translation or Not:no
Date of Publication:2021-05-28
Included Journals:SCI
