Hydrogen storage in scandium doped small boron clusters (BnSc2, n=3–10): A density functional study

2019 ◽  
Vol 44 (12) ◽  
pp. 6019-6030 ◽  
Author(s):  
Shakti S. Ray ◽  
Smruti R. Sahoo ◽  
Sridhar Sahu
Keyword(s):  
Hydrogen Storage ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study ◽  
Boron Clusters

Suitability of III-V[XH4][YH4]materials for hydrogen storage: A density functional study

2009 ◽  
Vol 79 (16) ◽  
Author(s):  
Filippo Zuliani ◽  
Andreas W. Götz ◽  
Célia Fonseca Guerra ◽  
Evert Jan Baerends
Keyword(s):  
Hydrogen Storage ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study

Calcium-decorated graphene for hydrogen storage: A van der Waals density functional study

2012 ◽  
Vol 55 ◽  
pp. 180-185 ◽  
Author(s):  
V. Wang ◽  
H. Mizuseki ◽  
H.P. He ◽  
G. Chen ◽  
S.L. Zhang ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Density Functional ◽  
Van Der Waals ◽  
Functional Study ◽  
Density Functional Study
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