Alkali-Metal-Doped B80 as High-Capacity Hydrogen Storage Media

2008 ◽  
Vol 112 (49) ◽  
pp. 19268-19271 ◽  
Author(s):  
Yuanchang Li ◽  
Gang Zhou ◽  
Jia Li ◽  
Bin-Ling Gu ◽  
Wenhui Duan
Keyword(s):  
Alkali Metal ◽  
Hydrogen Storage ◽  
High Capacity ◽  
Storage Media ◽  
Metal Doped

Titanium-embedded graphene as high-capacity hydrogen-storage media

2011 ◽  
Vol 36 (19) ◽  
pp. 12324-12328 ◽  
Author(s):  
Shibing Chu ◽  
Leibo Hu ◽  
Xianru Hu ◽  
Mingkun Yang ◽  
Jianbo Deng
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Storage Media

Li-decorated graphyne as high-capacity hydrogen storage media: First-principles plane wave calculations

2014 ◽  
Vol 39 (30) ◽  
pp. 17104-17111 ◽  
Author(s):  
B. Xu ◽  
X.L. Lei ◽  
G. Liu ◽  
M.S. Wu ◽  
C.Y. Ouyang
Keyword(s):  
Plane Wave ◽  
Hydrogen Storage ◽  
First Principles ◽  
High Capacity ◽  
Storage Media

scholarly journals Transition-Metal-Ethylene Complexes as High-Capacity Hydrogen-Storage Media

2006 ◽  
Vol 97 (22) ◽  
Author(s):  
E. Durgun ◽  
S. Ciraci ◽  
W. Zhou ◽  
T. Yildirim
Keyword(s):  
Transition Metal ◽  
Hydrogen Storage ◽  
High Capacity ◽  
Storage Media

Ti–η2-(C2H2) and HCC–TiH as high capacity hydrogen storage media

2013 ◽  
Vol 38 (36) ◽  
pp. 16185-16192 ◽  
Author(s):  
Li-Juan Ma ◽  
Jianfeng Jia ◽  
Hai-Shun Wu ◽  
Ying Ren
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Storage Media

Metal−Diboride Nanotubes as High-Capacity Hydrogen Storage Media

Nano Letters ◽  
2007 ◽  
Vol 7 (3) ◽  
pp. 663-667 ◽  
Author(s):  
Sheng Meng ◽  
Efthimios Kaxiras ◽  
Zhenyu Zhang
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Storage Media

C7N6 monolayer as high capacity and reversible hydrogen storage media: A DFT study

2021 ◽  
Author(s):  
Song Hu ◽  
Yongliang Yong ◽  
Zijia Zhao ◽  
Ruilin Gao ◽  
Qingxiao Zhou ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Dft Study ◽  
Storage Media

Theoretical study of the structure and dehydrogenation mechanism of sodium hydrazinidoborane

2017 ◽  
Vol 16 (03) ◽  
pp. 1750020 ◽  
Author(s):  
Tong Li ◽  
Kun Wang ◽  
Jian-Guo Zhang
Keyword(s):  
Alkali Metal ◽  
Hydrogen Storage ◽  
Systematic Study ◽  
Theoretical Study ◽  
High Capacity ◽  
Calculated Rate ◽  
Dehydrogenation Mechanism

Alkali-metal hydrazinidoboranes have been recently investigated as a new stable high-capacity material for hydrogen storage, necessitating an exploration of the dehydrogenation mechanism for further developments in this field. Herein, we present a first systematic study of the structure and dehydrogenation mechanism of sodium hydrazinidoborane (NaHB) with three possible pathways considered: pathway A, corresponding to unimolecular dehydrogenation; pathway B, featuring dehydrogenation of the (NaHB)2 dimer via two different sub-pathways, and pathway C, corresponding to direct dehydrogenation (as compared to B). The calculated rate of the most probable dehydrogenation pathway (B, 3.28[Formula: see text]min[Formula: see text] is similar to that obtained experimentally (12.26[Formula: see text]min[Formula: see text], supporting the validity of our findings.

Li and Ca Co-decorated carbon nitride nanostructures as high-capacity hydrogen storage media

2011 ◽  
Vol 110 (9) ◽  
pp. 094311 ◽  
Author(s):  
Yusheng Wang ◽  
Yong Ji ◽  
Meng Li ◽  
Pengfei Yuan ◽  
Qiang Sun ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Carbon Nitride ◽  
High Capacity ◽  
Storage Media

A first-principles study of alkali-metal-decorated graphyne as oxygen-tolerant hydrogen storage media

Carbon ◽  
2015 ◽  
Vol 81 ◽  
pp. 418-425 ◽  
Author(s):  
Sang-Hoon Lee ◽  
Seung-Hoon Jhi
Keyword(s):  
Alkali Metal ◽  
Hydrogen Storage ◽  
First Principles ◽  
First Principles Study ◽  
Storage Media

Charged Fullerenes as High-Capacity Hydrogen Storage Media

Nano Letters ◽  
2007 ◽  
Vol 7 (9) ◽  
pp. 2578-2583 ◽  
Author(s):  
Mina Yoon ◽  
Shenyuan Yang ◽  
Enge Wang ◽  
Zhenyu Zhang
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Storage Media
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