CHINESE JOURNAL OF COMPUTATIONAL PHYSICS ›› 2000, Vol. 17 ›› Issue (S1): 1-5.DOI: 10.3969/j.issn.1001-246X.2000.01.002
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WANG Yi
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Abstract: Calculated shock-wave compressed properties of metal platinum is presented based on i)the accurate calculations of 0-K total energies with the self-consistent,relativistic,full-potential,and spin-polarized,linearized augmented plane wave method within the local density approximation to exchenge-correlational functional;and ii)the classical mean-field statistics.The calculations of 0-K total energies span a wide fcc lattice constant range of from 6.1 a.u. to 9.9 a.u.Our approach does not invoke any empirical parameters.The experimental Hugoniot is reproduced excellently.
Key words: Hugoniot state, EOS, LAPW, platinum
CLC Number:
O414
WANG Yi. CALCULATED HUGONIOT OF PLATINUM TO 1000 Gpa[J]. CHINESE JOURNAL OF COMPUTATIONAL PHYSICS, 2000, 17(S1): 1-5.
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URL: http://www.cjcp.org.cn/EN/10.3969/j.issn.1001-246X.2000.01.002
http://www.cjcp.org.cn/EN/Y2000/V17/IS1/1