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Carbonyl diazide, OC(N3)2: Calculated thermodynamic properties

โœ Scribed by David W. Ball


Book ID
104016809
Publisher
Elsevier
Year
2011
Tongue
English
Weight
323 KB
Volume
965
Category
Article
ISSN
2210-271X

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โœ Zuo Li; Pu Wang; Haihua Chen; Xinlu Cheng ๐Ÿ“‚ Article ๐Ÿ“… 2011 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 817 KB

The structural, electronic and thermodynamic properties of cubic Zn 3 N 2 under hydrostatic pressure up to 80 GPa are investigated using the local density approximation method with pseudopotentials of the ab initio norm-conserving full separable Troullier-Martin scheme in the frame of density functi