Melting of iron and other metals at earth's core conditions: A simplified computational approach

被引:82
作者
Wang, Y
Ahuja, R
Johansson, B
机构
[1] Uppsala Univ, Dept Phys, Condensed Matter Theory Grp, S-75121 Uppsala, Sweden
[2] Inst Appl Phys & Computat Math, Beijing 100088, Peoples R China
[3] Royal Inst Technol, Dept Mat Sci & Engn, S-10044 Stockholm, Sweden
来源
PHYSICAL REVIEW B | 2002年 / 65卷 / 01期
关键词
D O I
10.1103/PhysRevB.65.014104
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
In order to Study melting of metals' at high pressure, we propose a different method which can be thought of as a generalization of the well-known Lindemann law. One essential interesting feature is that neither the Debye temperature nor the Gruneisen coefficient are used in the theory. We find that the method based on first-principles calculations can be used to model the pressure dependence of the melting properties of metals very well, predictions of the melting along the principal Hugoniot are calculated for Cu and Ta. In the case of Fe, the melting temperature is calculated at geophysically interesting pressures.
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页码:1 / 3
页数:3
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