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Local elastic properties of nano-confined fluids: A density functional study

โœ Scribed by Sun, Zongli; Kang, Yanshuang

Book ID
121825743
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
407 KB
Volume
378
Category
Article
ISSN
0375-9601

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The structural, electronic, bonding, and elastic properties of the low-temperature orthorhombic phase of NH 3 BH 3 are studied by means of first-principles total energy calculations based on the pseudopotential method. The calculated structural parameters of NH 3 BH 3 are found to be in good agreeme