Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5443903 | Solid State Sciences | 2017 | 6 Pages |
Abstract
Charge density around TM atoms exhibited directional distribution to N atoms, indicating directional TMâN bond was covalent. The increase with positive value in charge density in the space between TM and N atoms also indicated covalent property of TMâN bond. Charge density at TM atom sites decreased and charge density at N atom sites increased after bonding, indicating ionic property of TMâN bond.295
Keywords
Related Topics
Physical Sciences and Engineering
Materials Science
Ceramics and Composites
Authors
Xin Tan, Xuan li, Yangyang Wang, Xuejie Liu, Changyong Yu, Yuan Ren,