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Journal of the Physical Society of Japan

Volumn 73, Issue 10, 2004, Pages 2628-2630

Ab initio study of H2 desorption from magnesium hydride MgH 2 cluster

(4) Tsuda, Muneyuki a Diño, Wilson Agerico a,b,c Nakanishi, Hiroshi a Kasai, Hideaki a

a OSAKA UNIVERSITY (Japan)

b JAPAN SCIENCE AND TECHNOLOGY AGENCY (Japan)

c DE LA SALLE UNIVERSITY (Philippines)

Author keywords

Density functional theory; Desorption; Hydrogen storage; Ionic bond; Magnesium; Magnesium hydride

Indexed keywords

MAGNESIUM HYDROXIDE; TRANSITION ELEMENT;

AB INITIO CALCULATION; ARTICLE; CLUSTER ANALYSIS; CRYSTALLIZATION; DENSITY FUNCTIONAL THEORY; DESORPTION; HYDROGEN BOND; HYDROGENATION; THERMODYNAMICS;

EID: 20344405549 PISSN: 00319015 EISSN: None Source Type: Journal
DOI: 10.1143/JPSJ.73.2628 Document Type: Article

Times cited : (22)

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