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High-temperature behavior and thermodynamic properties of the compounds Cu3P and CuP2

✍ Scribed by S. P. Gordienko; G. Sh. Viksman


Publisher
Springer
Year
1985
Tongue
English
Weight
273 KB
Volume
24
Category
Article
ISSN
1573-9066

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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