First principle study of the adsorption of atomic hydrogen on cluster-model surfaces

Synthetic Metals

Volumn 152, Issue 1-3, 2005, Pages 329-332

  Ohta, Yasuhito ^a,b   Ohta, Koji ^b  

^a JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

^b NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY AIST   (Japan)

Author keywords

Ab initio quantum chemical methods and calculations; Density functional calculations; Fuel storage devices; Graphite and related compounds; Models of surface and interface chemistry and physics

Indexed keywords

AB INITIO QUANTUM CHEMICAL METHODS AND CALCULATIONS; FUEL STORAGE DEVICES; GRAPHITE AND RELATED COMPOUNDS; MODELS OF SURFACE INTERFACE CHEMISTRY AND PHYSICS;

ADSORPTION; CALCULATIONS; CHEMISORPTION; ELECTRONIC STRUCTURE; OPTIMIZATION; POTENTIAL ENERGY; SURFACES;

HYDROGEN;

EID: 24644493432     PISSN: 03796779     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.synthmet.2005.07.331     Document Type: Conference Paper

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