3d-transition metal induced enhancement of molecular hydrogen adsorption on Mg(0001) surface: An Ab-initio study

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G. P. Das
Keyword(s):  
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Ab Initio ◽  
Molecular Hydrogen ◽  
Hydrogen Adsorption ◽  
Ab Initio Study

Ab Initio Study of Molecular Hydrogen Adsorption in Covalent Organic Framework-1

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Vol 113 (19) ◽  
pp. 8498-8504 ◽  
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Ralph H. Scheicher ◽  
C. Moysés Araújo ◽  
Andreas Blomqvist ◽  
Udomsilp Pinsook ◽  
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Keyword(s):  
Ab Initio ◽  
Molecular Hydrogen ◽  
Hydrogen Adsorption ◽  
Ab Initio Study ◽  
Covalent Organic Framework ◽  
Organic Framework

scholarly journals On the lubricity of transition metal dichalcogenides: an ab initio study

Nanoscale ◽  
2017 ◽  
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pp. 5597-5607 ◽  
Author(s):  
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Paolo Nicolini ◽  
Tomas Polcar
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Transition Metal ◽  
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Ab initio study of lithium transition metal fluorophosphate cathodes for rechargeable batteries

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Vol 21 (32) ◽  
pp. 12054 ◽  
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Kevin M. Rosso ◽  
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Jun Liu
Keyword(s):  
Transition Metal ◽  
Ab Initio ◽  
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Ab Initio Study
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