NOVEL ABINITIO SELF-CONSISTENT-FIELD APPROACH TO MOLECULAR-SOLIDS UNDER PRESSURE .2. SOLID H-2 UNDER HIGH-PRESSURE

被引:26
作者
RAYNOR, S
机构
关键词
D O I
10.1063/1.453067
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:2795 / 2799
页数:5
相关论文
共 19 条
[1]   QUANTUM MONTE-CARLO [J].
CEPERLEY, D ;
ALDER, B .
SCIENCE, 1986, 231 (4738) :555-560
[2]   THEORY OF DENSE HYDROGEN [J].
CHAKRAVARTY, S ;
ROSE, JH ;
WOOD, D ;
ASHCROFT, NW .
PHYSICAL REVIEW B, 1981, 24 (04) :1624-1635
[3]   MELTING CURVES OF MOLECULAR-HYDROGEN AND MOLECULAR DEUTERIUM UNDER HIGH-PRESSURES BETWEEN 20-K AND 373-K [J].
DIATSCHENKO, V ;
CHU, CW ;
LIEBENBERG, DH ;
YOUNG, DA ;
ROSS, M ;
MILLS, RL .
PHYSICAL REVIEW B, 1985, 32 (01) :381-389
[4]   The energy levels of a rotating vibrator [J].
Dunham, JL .
PHYSICAL REVIEW, 1932, 41 (06) :721-731
[5]   PROPERTIES OF SOLID AND GASEOUS HYDROGEN, BASED UPON ANISOTROPIC PAIR INTERACTIONS [J].
ETTERS, RD ;
DANILOWICZ, R ;
ENGLAND, W .
PHYSICAL REVIEW A, 1975, 12 (05) :2199-2212
[6]   COMBINED REPRESENTATION METHOD FOR USE IN BAND-STRUCTURE CALCULATIONS - APPLICATION TO HIGHLY COMPRESSED HYDROGEN [J].
FRIEDLI, C ;
ASHCROFT, NW .
PHYSICAL REVIEW B, 1977, 16 (02) :662-672
[7]   ELECTRON CORRELATION-EFFECTS ON THE N-2-N-2 INTERACTION [J].
HAY, PJ ;
PACK, RT ;
MARTIN, RL .
JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (03) :1360-1372
[8]   ELECTRONIC AND VIBRATIONAL PROPERTIES OF MOLECULES AT HIGH-PRESSURES - HYDROGEN MOLECULE IN A RIGID SPHEROIDAL BOX [J].
LESAR, R ;
HERSCHBACH, DR .
JOURNAL OF PHYSICAL CHEMISTRY, 1981, 85 (19) :2798-2804
[10]   ULTRAHIGH PRESSURES - OPTICAL OBSERVATIONS AND RAMAN MEASUREMENTS OF HYDROGEN AND DEUTERIUM TO 1.47 MBAR [J].
MAO, HK ;
BELL, PM ;
HEMLEY, RJ .
PHYSICAL REVIEW LETTERS, 1985, 55 (01) :99-102