Structures and Electronic Properties of Anions XO- (X = Li, B, N, F, Na, Al, P, and Cl) from a Computational Study

The electronic and molecular structures of oxygen containing anion constructed by model XO- (X = Li, B, N, F, Na, Al, P, and Cl) have been studied in detail using ab initio MP2 and QCISD(T) methods with the aug-cc-pVDZ basis set. Our findings suggest that the p-donation character initiated by Cl ato...

Full description

Saved in:
Bibliographic Details
Main Authors: Liang Junxi, Su Qiong, Wang Xiaoe
Format: บทความวารสาร
Language:English
Published: Science Faculty of Chiang Mai University 2019
Online Access:http://it.science.cmu.ac.th/ejournal/dl.php?journal_id=9527
http://cmuir.cmu.ac.th/jspui/handle/6653943832/64220
Tags: Add Tag
No Tags, Be the first to tag this record!
Institution: Chiang Mai University
Language: English
Be the first to leave a comment!
You must be logged in first