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Preprints of the Keldysh Institute of Applied Mathematics, 2012, 048, 24 pp. (Mi ipmp66)  

Cold curve construction by using quasizonemodel and ABINIT code

N. N. Kosterin, V. G. Novikov, A. S. Grushin
References:
Abstract: The procedure of cold curve construction is discussed in this paper. The main tools are the ABINIT code, which implements electron density functional method,and the TH_BAND code, based on quasizone model. Since the ABINIT code uses pseudopotential approximation, its base domain is limited within narrow region close to normal density. Outside this region the dependencies of pressure and specific internal energy are sewed together with TH_BAND code results. As an example, calculations for aluminum, tungsten and xenon have been performed and presented in this work along with a short analysis of several types of pseudopotentials.
Document Type: Preprint
Language: Russian
Citation: N. N. Kosterin, V. G. Novikov, A. S. Grushin, “Cold curve construction by using quasizonemodel and ABINIT code”, Keldysh Institute preprints, 2012, 048, 24 pp.
Citation in format AMSBIB
\Bibitem{KosNovGru12}
\by N.~N.~Kosterin, V.~G.~Novikov, A.~S.~Grushin
\paper Cold curve construction by using quasizonemodel and ABINIT code
\jour Keldysh Institute preprints
\yr 2012
\papernumber 048
\totalpages 24
\mathnet{http://mi.mathnet.ru/ipmp66}
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  • https://www.mathnet.ru/eng/ipmp/y2012/p48
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    Препринты Института прикладной математики им. М. В. Келдыша РАН
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