Quantum molecular-dynamics study of the electrical and optical properties of shocked liquid nitrogen

被引:31
作者
Mazevet, S [1 ]
Kress, JD
Collins, LA
Blottiau, P
机构
[1] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA
[2] CEA, F-91680 Bruyeres Le Chatel, France
来源
PHYSICAL REVIEW B | 2003年 / 67卷 / 05期
关键词
D O I
10.1103/PhysRevB.67.054201
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Using quantum molecular-dynamics simulations, we show that the electrical and optical properties of shocked liquid nitrogen change drastically as the density increases along the principal and second-shock Hugoniots. Initially, a nonmetal molecular fluid at normal conditions, we find that nitrogen becomes a metal for pressures of 60 GPa and higher. This nonmetal-metal transition for fluid nitrogen can be directly associated to the continuous dissociation occurring along the Hugoniots, and is analogous to the high-pressure nonmetal-metal transition observed experimentally for two other homonuclear diatomic fluids, hydrogen and oxygen.
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页数:7
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