HIGH-PRESSURE PROPERTIES OF THE BCC PHASE OF SF(6) BASED UPON SPHERICALLY SMOOTHED INTERMOLECULAR POTENTIALS

被引：3

作者：

HELMY, AA ^{[1
]}

ELSHEIKH, SM ^{[1
]}

ELERAKY, S ^{[1
]}

TABISZ, GC ^{[1
]}

机构：

[1] UNIV MANITOBA,FAC SCI,DEPT PHYS,WINNIPEG R3T 2N2,MANITOBA,CANADA

来源：

ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS | 1994年 / 187卷

关键词：

SOLID SF(6); INTERMOLECULAR POTENTIALS; MOLECULAR CRYSTALS;

D O I：

10.1524/zpch.1994.187.Part_2.203

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：

Properties of solid SF6 at T = 0 K are investigated using different intermolecular potentials. These potentials were constructed from different gas properties such as second virial coefficient, structural second virial coefficient and viscosity data without appeal to any solid state structural or spectroscopic data. A computer simulation study using a simple lattice sum, on a body centered cubic lattice, has been used to obtain the sublimation energy, the equation of state and bulk modulus (which appear not to be reported before).

引用

页码：203 / 211

页数：9

共 22 条

[1]

[Anonymous], 1980, VIRIAL COEFFICIENTS

[2] STRUCTURES OF HEXACOORDINATE COMPOUNDS OF MAIN-GROUP ELEMENTS .3. ELECTRON-DIFFRACTION STUDY OF SF6 [J].

BARTELL, LS ;

DOUN, SK .

JOURNAL OF MOLECULAR STRUCTURE, 1978, 43 (02) :245-249

[3]

BARTELL LS, 1987, SCIENCE

[4] NEUTRON-DIFFRACTION STUDY OF THE PLASTIC PHASES OF POLYCRYSTALLINE SF6 AND CBR4 [J].

DOLLING, G ;

POWELL, BM ;

SEARS, VF .

MOLECULAR PHYSICS, 1979, 37 (06) :1859-1883

[5] HIGH-TEMPERATURE GAS VISCOSITIES .2. NITROGEN, NITRIC OXIDE, BORON TRIFLUORIDE, SILICON TETRAFLUORIDE, AND SULFUR HEXAFLUORIDE [J].

ELLIS, CP ;

RAW, CJG .

JOURNAL OF CHEMICAL PHYSICS, 1959, 30 (02) :574-576

[6]

ELSADEK, 1991, J PHYS D, V80, P2782

[7] PERTURBER DEPENDENCE OF THE COLLISION-INDUCED LIGHT-SCATTERING BY SF6 AND CF4 [J].

ELSHEIKH, SM ;

TABISZ, GC .

MOLECULAR PHYSICS, 1989, 68 (06) :1225-1238

[8] PREDICTION OF STRUCTURES AND MAGNETIC ORIENTATIONS IN SOLID ALPHA-O-2 AND BETA-O-2 [J].

ETTERS, RD ;

HELMY, AA ;

KOBASHI, K .

PHYSICAL REVIEW B, 1983, 28 (04) :2166-2171

[9]

GARY SK, 1977, J CHEM PHYS, V6, P2517

[10]

HAMMAN SD, 1954, AUST J CHEM, V1, P1

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