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Phase transitions / Computational chemistry / Temperature / Condensed matter physics / Density functional theory / Melting point / Electronic band structure / Crystal / Molecular dynamics / Chemistry / Physics / Science


THE JOURNAL OF CHEMICAL PHYSICS 126, 194502 共2007兲 Ab initio melting curve of molybdenum by the phase coexistence method C. Cazorla and M. J. Gillan London Centre for Nanotechnology, UCL, London WC1H OAH, United Kin
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Document Date: 2010-02-11 05:02:36


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