Free Energy Minimization of Continuous Network Models of Amorphous Germanium
作者:
R. Grigorovici,
R.Ma˘na˘ila&breve,
M. Popescu,
C. Sta˘nescu,
期刊:
AIP Conference Proceedings
(AIP Available online 1974)
卷期:
Volume 20,
issue 1
页码: 200-205
ISSN:0094-243X
年代: 1974
DOI:10.1063/1.2945961
出版商: AIP
数据来源: AIP
摘要:
Energy minimization was performed by computer on models of a‐Ge and crystalline GeIIIand GeIV. The force constants obtained by minimizing the lattice energy are shown to vary systematically with density of the structure. This variation removes the discrepancies between the experimental and calculated values of the transformation enthalpies of a‐Ge, GeIIIand GeIV.
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