Geometries and electronic structures of the ground and low-lying excited states of FeCO: An ab initio study

2012 ◽  
Vol 137 (24) ◽  
pp. 244303 ◽  
Author(s):  
Tsuneo Hirano ◽  
Rei Okuda ◽  
Umpei Nagashima ◽  
Per Jensen
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Electronic Structures ◽  
Ab Initio Study

Crystal and electronic structures of superhard B2CN : An ab initio study

2012 ◽  
Vol 152 (2) ◽  
pp. 71-75 ◽  
Author(s):  
Quan Li ◽  
Dan Zhou ◽  
Hui Wang ◽  
Wanjin Chen ◽  
Baojia Wu ◽  
...  
Keyword(s):  
Ab Initio ◽  
Electronic Structures ◽  
Ab Initio Study

An ab initio study of the ground and low-lying excited states of KBe with the effect of inner-shell electrons

2013 ◽  
Vol 139 (7) ◽  
pp. 074305 ◽  
Author(s):  
Ke-La Xiao ◽  
Chuan-Lu Yang ◽  
Mei-Shan Wang ◽  
Xiao-Guang Ma ◽  
Wen-Wang Liu
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Ab Initio Study

An ab initio study of the excited states of the vinoxy radical

2006 ◽  
Vol 425 (4-6) ◽  
pp. 225-228 ◽  
Author(s):  
Katarzyna Piechowska-Strumik ◽  
Marie-Christine Bacchus-Montabonel ◽  
Yvette Suzanne Tergiman ◽  
Jozef E. Sienkiewicz
Keyword(s):  
Ab Initio ◽  
Excited States ◽  
Ab Initio Study
Sign in / Sign up

Export Citation Format

Share Document