scholarly journals First-Principles Study of Hydrogen Storage of Sc-Modified Semiconductor Covalent Organic Framework-1

ACS Omega ◽  
2021 ◽  
Author(s):  
Wei Shangguan ◽  
Hui Zhao ◽  
Jian-Qing Dai ◽  
Jinming Cai ◽  
Cuixia Yan
Keyword(s):  
Hydrogen Storage ◽  
First Principles ◽  
Covalent Organic Framework ◽  
First Principles Study ◽  
Organic Framework

First-Principles Study of Molecular Carbon Dioxide Adsorption in Covalent Organic Framework-112

2019 ◽  
Vol 11 (3) ◽  
pp. 317-324 ◽  
Author(s):  
Wei-Chao Zhang ◽  
Shu-Ting Zhang ◽  
Zhi Sun ◽  
Wei-Feng Sun ◽  
Li-Yong Zhang ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
First Principles ◽  
Carbon Dioxide Adsorption ◽  
Covalent Organic Framework ◽  
First Principles Study ◽  
Organic Framework

scholarly journals The first-principles study on the elasticity of V-based solid solution hydrogen storage materials

2009 ◽  
Vol 58 (10) ◽  
pp. 7044
Author(s):  
Zhou Jing-Jing ◽  
Chen Yun-Gui ◽  
Wu Chao-Ling ◽  
Pang Li-Juan ◽  
Zheng Xin ◽  
...  
Keyword(s):  
Solid Solution ◽  
Hydrogen Storage ◽  
First Principles ◽  
Hydrogen Storage Materials ◽  
Storage Materials ◽  
First Principles Study

scholarly journals Effects of nanostructures on the hydrogen storage properties of MgH2 - A first principles study

2022 ◽  
pp. e00643
Author(s):  
K. Iyakutti ◽  
V.J. Surya ◽  
R. Lavanya ◽  
V. Vasu ◽  
R. Rajeswarapalanichamy ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
First Principles ◽  
Hydrogen Storage Properties ◽  
First Principles Study ◽  
Storage Properties

Hydrogen Storage for Mobile Applications: First-Principles Study of SrAlH3

2020 ◽  
pp. 231-237
Author(s):  
Y. Bouhadda ◽  
K. Benyelloul ◽  
K. Khodja ◽  
N. Fenineche ◽  
M. Bououdina
Keyword(s):  
Hydrogen Storage ◽  
First Principles ◽  
Mobile Applications ◽  
First Principles Study

Hydrogen storage on bare Cu atom and Cu-functionalized boron-doped graphene: A first principles study

2017 ◽  
Vol 42 (7) ◽  
pp. 4233-4243 ◽  
Author(s):  
Omar Faye ◽  
Ubong Eduok ◽  
Jerzy Szpunar ◽  
Barbara Szpunar ◽  
Almoustapha Samoura ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
First Principles ◽  
First Principles Study ◽  
Boron Doped ◽  
Doped Graphene
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