Hydrogen storage of platinum atoms adsorbed on graphene: First-principles plane wave calculations

Applied Mechanics and Materials

Volumn 246-247, Issue , 2013, Pages 1057-1060

  Yelu, He ^a   Shuxia, Wang ^b  

^a CHONGQING THREE GORGES UNIVERSITY   (China)

^b CHONGQING UNIVERSITY   (China)

Author keywords

Graphene; Hydrogen storage; The first principle

Indexed keywords

ADSORPTION ENERGIES; GENERALIZED GRADIENT APPROXIMATIONS; GEOMETRICAL STRUCTURE; HYDROGEN MOLECULE; PLANE WAVE CALCULATIONS; PLANE-WAVE PSEUDOPOTENTIAL METHOD; PLATINUM ATOMS; THE FIRST PRINCIPLE;

ADSORPTION; ATOMS; CALCULATIONS; CHARGE TRANSFER; COMPUTER AIDED DESIGN; COMPUTER SIMULATION; DENSITY FUNCTIONAL THEORY; HYDROGEN; HYDROGEN STORAGE; MANUFACTURE; MOLECULAR ORBITALS; MOLECULES; PLATINUM;

GRAPHENE;

EID: 84872937320     PISSN: 16609336     EISSN: 16627482     Source Type: Book Series    
DOI: 10.4028/www.scientific.net/AMM.246-247.1057     Document Type: Conference Paper

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