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Reversible disproportionation of ZrCo under high temperature and hydrogen pressure

โœ Scribed by S. Konishi; T. Nagasaki; K. Okuno

Book ID
107810995
Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
426 KB
Volume
223
Category
Article
ISSN
0022-3115

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The energy-volume curves of OsB have been obtained using the first-principles plane-wave ultrasoftpseudopotential density functional theory (DFT) within the generalized gradient approximation (GGA) and local density approximation (LDA). Using the quasi-harmonic Debye model we first analyze the speci