A DFT study on the hydrogen storage performance of MoS2 monolayers doped with group 8B transition metals

2021 ◽  
Author(s):  
Shulin Yang ◽  
Yanan Liu ◽  
Gui Lei ◽  
Yulin Xie ◽  
Liping Peng ◽  
...  
Keyword(s):  
Transition Metals ◽  
Hydrogen Storage ◽  
Dft Study ◽  
Storage Performance ◽  
Mos2 Monolayers ◽  
Hydrogen Storage Performance

nA DFT study on the outstanding hydrogen storage performance of the Ti-decorated MoS2 monolayer

2021 ◽  
pp. 101329
Author(s):  
Shulin Yang ◽  
Xueting Wang ◽  
Gu Lei ◽  
Huoxi Xu ◽  
Zhao Wang ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Dft Study ◽  
Storage Performance ◽  
Mos2 Monolayer ◽  
Hydrogen Storage Performance

scholarly journals Enhanced hydrogen storage performance of graphene nanoflakes doped with Cr atoms: a DFT study

RSC Advances ◽  
2019 ◽  
Vol 9 (44) ◽  
pp. 25690-25696 ◽  
Author(s):  
Chunqi Xiang ◽  
Ao Li ◽  
Shulin Yang ◽  
Zhigao Lan ◽  
Wei Xie ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Dft Study ◽  
Graphene Nanoflakes ◽  
Storage Performance ◽  
Hydrogen Storage Performance ◽  
Graphene Nanoflake

Our study reveals that the H2 storage performance of a graphene nanoflake based material could be significantly enhanced through doping with Cr atoms.

Mg–TM (TM: Ti, Nb, V, Co, Mo or Ni) core–shell like nanostructures: synthesis, hydrogen storage performance and catalytic mechanism

2014 ◽  
Vol 2 (25) ◽  
pp. 9645-9655 ◽  
Author(s):  
Jie Cui ◽  
Jiangwen Liu ◽  
Hui Wang ◽  
Liuzhang Ouyang ◽  
Dalin Sun ◽  
...  
Keyword(s):  
Grain Size ◽  
Transition Metals ◽  
Hydrogen Storage ◽  
Catalytic Mechanism ◽  
Core Shell ◽  
Storage Performance ◽  
Nano Scale ◽  
Hydrogen Storage Performance

Magnesium coated by different transition metals (TM: Ti, Nb, V, Co, Mo, or Ni) with a grain size in the nano-scale formed a core (Mg)–shell (TM) like structure which can catalyse dehydrogenation.

A DFT study of the enhanced hydrogen storage performance of the Li-decorated graphene nanoribbons

Vacuum ◽  
2020 ◽  
Vol 171 ◽  
pp. 109011 ◽  
Author(s):  
Na Zheng ◽  
Shulin Yang ◽  
Huoxi Xu ◽  
Zhigao Lan ◽  
Zhao Wang ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Graphene Nanoribbons ◽  
Dft Study ◽  
Storage Performance ◽  
Hydrogen Storage Performance

A DFT study on the hydrogen storage performance of the Sb monolayer decorated with Li, Na or K

Vacuum ◽  
2021 ◽  
Vol 183 ◽  
pp. 109868
Author(s):  
Ping Xi ◽  
Lun Tan ◽  
Shulin Yang ◽  
Huoxi Xu ◽  
Zhigao Lan ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Dft Study ◽  
Storage Performance ◽  
Hydrogen Storage Performance

Hydrogen storage performance of platinum supported carbon nanohorns: A DFT study of reaction mechanisms, thermodynamics, and kinetics

2018 ◽  
Vol 43 (52) ◽  
pp. 23336-23345 ◽  
Author(s):  
Chompoonut Rungnim ◽  
Kajornsak Faungnawakij ◽  
Noriaki Sano ◽  
Nawee Kungwan ◽  
Supawadee Namuangruk
Keyword(s):  
Hydrogen Storage ◽  
Reaction Mechanisms ◽  
Dft Study ◽  
Carbon Nanohorns ◽  
Thermodynamics And Kinetics ◽  
Storage Performance ◽  
Hydrogen Storage Performance

Hydrogen storage performance of methyl-substituted mesoporous silica with tailored textural characteristics

2021 ◽  
Author(s):  
Alfonso Policicchio ◽  
Ana-Maria Putz ◽  
Giuseppe Conte ◽  
Sara Stelitano ◽  
Carlo Poselle Bonaventura ◽  
...  
Keyword(s):  
Mesoporous Silica ◽  
Hydrogen Storage ◽  
Textural Characteristics ◽  
Storage Performance ◽  
Hydrogen Storage Performance
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