Ti-Substituted Boranes as Hydrogen Storage Materials: A Computational Quest for the Ideal Combination of Stable Electronic Structure and Optimal Hydrogen Uptake

2009 ◽  
Vol 15 (24) ◽  
pp. 5910-5919 ◽  
Author(s):  
Cheng-Gen Zhang ◽  
Renwu Zhang ◽  
Zhi-Xiang Wang ◽  
Zhen Zhou ◽  
Shengbai B. Zhang ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Hydrogen Storage ◽  
Hydrogen Uptake ◽  
Hydrogen Storage Materials ◽  
Storage Materials ◽  
The Ideal

Electronic structure of nanocrystalline and polycrystalline hydrogen storage materials

2008 ◽  
Vol 33 (2) ◽  
pp. 201-210 ◽  
Author(s):  
L. Smardz ◽  
M. Jurczyk ◽  
K. Smardz ◽  
M. Nowak ◽  
M. Makowiecka ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Hydrogen Storage ◽  
Hydrogen Storage Materials ◽  
Storage Materials

Atomic and electronic structure of hydrogen-related centers in hydrogen storage materials

2009 ◽  
Vol 404 (5-7) ◽  
pp. 793-797 ◽  
Author(s):  
Chris G. Van de Walle ◽  
A. Peles ◽  
A. Janotti ◽  
G.B. Wilson-Short
Keyword(s):  
Electronic Structure ◽  
Hydrogen Storage ◽  
Hydrogen Storage Materials ◽  
Storage Materials ◽  
Atomic And Electronic Structure
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