ELECTRON-GAS MODEL FOR MOLECULAR-CRYSTALS - APPLICATION TO THE ALKALI AND ALKALINE-EARTH HYDROXIDES

被引:37
作者
LESAR, R [1 ]
GORDON, RG [1 ]
机构
[1] HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
来源
PHYSICAL REVIEW B | 1982年 / 25卷 / 12期
关键词
D O I
10.1103/PhysRevB.25.7221
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
引用
收藏
页码:7221 / 7237
页数:17
相关论文
共 57 条
[1]   NON-EMPIRICAL MOLECULAR-ORBITAL CALCULATIONS FOR HYDROGEN-BONDED MOLECULAR-SOLIDS - MOLECULAR DIPOLE AND QUADRUPOLE-MOMENTS FOR SOLID HF AND HCL [J].
ANDERSON, SG ;
SANTRY, DP .
JOURNAL OF CHEMICAL PHYSICS, 1981, 74 (10) :5780-5784
[2]  
[Anonymous], 1975, J PHYS CHEM REF DATA, V4, P1
[3]  
[Anonymous], 1961, MATH COMPUT
[4]   PREDICTION OF HYDROGEN-BONDS AND HYDROGEN-ATOM POSITIONS IN CRYSTALLINE SOLIDS [J].
BAUR, WH .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1972, B 28 (MAY15) :1456-&
[5]  
BEC C, 1974, CR ACAD SCI C CHIM, V278, P1193
[6]  
Born M., 1954, DYNAMIC THEORY CRYST
[8]   NATURE OF MELTING AND SUPERIONICITY IN ALKALI AND ALKALINE-EARTH HALIDES [J].
BOYER, LL .
PHYSICAL REVIEW LETTERS, 1980, 45 (23) :1858-1862
[9]   NEUTRON DIFFRACTION STUDY OF CALCIUM HYDROXIDE [J].
BUSING, WR ;
LEVY, HA .
JOURNAL OF CHEMICAL PHYSICS, 1957, 26 (03) :563-568