scholarly journals Structural stability of Lanthanum-based oxygen-deficient perovskites in redox catalysis: A density functional theory study

2020 ◽  
Vol 347 ◽  
pp. 142-149 ◽  
Author(s):  
Qian Li ◽  
Yun-Xiang Deng ◽  
Yi-An Zhu ◽  
Yang Li ◽  
Zhi-Jun Sui ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Structural Stability ◽  
Density Functional ◽  
Redox Catalysis ◽  
Density Functional Theory Study ◽  
Functional Theory

Density-Functional Theory Study of the Structural, Stability and Spectrum Properties for Mg2Sin(n=1~9) Clusters

2014 ◽  
Vol 34 (3) ◽  
pp. 0316002
Author(s):  
张帅 Zhang Shuai ◽  
刘旭焱 Liu Xuyan ◽  
王卓 Wang Zhuo ◽  
李根全 Li Genquan ◽  
卢成 Lu Cheng
Keyword(s):  
Density Functional Theory ◽  
Structural Stability ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory

Density functional theory study of structural stability for gas hydrate

2018 ◽  
Vol 27 (4) ◽  
pp. 043103
Author(s):  
Ping Guo ◽  
Yi-Long Qiu ◽  
Long-Long Li ◽  
Qiang Luo ◽  
Jian-Fei Zhao ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Structural Stability ◽  
Gas Hydrate ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory
Sign in / Sign up

Export Citation Format

Share Document