First--Principles Study of the Thermal Properties of Metal Zr

Acta Metall Sin

2007, Vol. 43

Issue (7): 693-698 DOI:

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First--Principles Study of the Thermal Properties of Metal Zr

NIE Yaozhuang; XIE Youqing;LI Xiaobo; PENG Hongjian

School of Physics Science and Technology;Central South University

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NIE Yaozhuang; XIE Youqing; LI Xiaobo; PENG Hongjian. First--Principles Study of the Thermal Properties of Metal Zr. Acta Metall Sin, 2007, 43(7): 693-698 .

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Key words: First-principles calculations Thermal properties Phonons Pseudopotential methods

Received: 30 October 2006

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