EQUATION OF STATE OF A HYDROGEN PLASMA BY DENSITY-FUNCTIONAL MOLECULAR-DYNAMICS

被引：40

作者：

PENMAN, JI ^{[1
]}

CLEROUIN, JG ^{[1
]}

ZERAH, PG ^{[1
]}

机构：

[1] CEA, CTR ETUD LIMEIL VALENTON, F-94195 VILLENEUVE ST GEO, FRANCE

来源：

PHYSICAL REVIEW E | 1995年 / 51卷 / 06期

关键词：

D O I：

10.1103/PhysRevE.51.R5224

中图分类号：

O35 [流体力学]; O53 [等离子体物理学];

学科分类号：

070204 ; 080103 ; 080704 ;

摘要：

The orbital-free molecular dynamics model is used in a finite temperature extension of Kirshnits (Zh. Eksp. Teor. Fiz. 32, 115 (1957) [Sov. Phys. JETP 5, 64 (1957)]) to compute the equation of state of a hydrogen plasma. The pressures, corrected to account for the nontransferability of the pseudopotential, are in a good agreement with existing theories. © 1995 The American Physical Society.

引用

页码：R5224 / R5227

页数：4

共 50 条

[1] DENSITY-FUNCTIONAL MOLECULAR-DYNAMICS METHOD
OGUCHI, T
SASAKI, T
[J]. PROGRESS OF THEORETICAL PHYSICS SUPPLEMENT, 1991, (103): : 93 - 117
[2] UNIFIED APPROACH FOR MOLECULAR-DYNAMICS AND DENSITY-FUNCTIONAL THEORY
CAR, R
PARRINELLO, M
[J]. PHYSICAL REVIEW LETTERS, 1985, 55 (22) : 2471 - 2474
[3] ABINITIO MOLECULAR-DYNAMICS WITH AN ORBITAL-FREE DENSITY-FUNCTIONAL
PEARSON, M
SMARGIASSI, E
MADDEN, PA
[J]. JOURNAL OF PHYSICS-CONDENSED MATTER, 1993, 5 (19) : 3221 - 3240
[4] A DENSITY-FUNCTIONAL MOLECULAR-DYNAMICS STUDY OF THE STRUCTURE OF LIQUID NITROMETHANE
SEMINARIO, JM
CONCHA, MC
POLITZER, P
[J]. JOURNAL OF CHEMICAL PHYSICS, 1995, 102 (20): : 8281 - 8282
[5] MOLECULAR-DYNAMICS, DENSITY-FUNCTIONAL THEORY OF THE METAL ELECTROLYTE INTERFACE
PRICE, DL
HALLEY, JW
[J]. JOURNAL OF CHEMICAL PHYSICS, 1995, 102 (16): : 6603 - 6612
[6] DENSITY-FUNCTIONAL MOLECULAR-DYNAMICS WITH REAL-SPACE FINITE-DIFFERENCE
HOSHI, T
ARAI, M
FUJIWARA, T
[J]. PHYSICAL REVIEW B, 1995, 52 (08) : R5459 - R5462
[7] Phase diagram of MgO from density-functional theory and molecular-dynamics simulations
Strachan, A
Çagin, T
Goddard, WA
[J]. PHYSICAL REVIEW B, 1999, 60 (22) : 15084 - 15093
[8] AB-INITIO MOLECULAR-DYNAMICS WITH A FINITE-TEMPERATURE DENSITY-FUNCTIONAL
GRUMBACH, MP
HOHL, D
MARTIN, RM
CAR, R
[J]. JOURNAL OF PHYSICS-CONDENSED MATTER, 1994, 6 (10) : 1999 - 2014
[9] DYNAMICS OF METALLIC AND MOLECULAR-HYDROGEN THROUGH DENSITY-FUNCTIONAL SIMULATIONS
THEILHABER, J
[J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1994, : 611 - 624
[10] Equation of state of warm dense deuterium and its isotopes from density-functional theory molecular dynamics
Danel, J-F
Kazandjian, L.
Piron, R.
[J]. PHYSICAL REVIEW E, 2016, 93 (04)

← 1 2 3 4 5 →