THE CRYSTAL ELECTRON-ENERGY AND COMPTON PROFILE CALCULATIONS FROM X-RAY-DIFFRACTION DATA

被引:28
作者
ALEKSANDROV, YV
TSIRELSON, VG
REZNIK, IM
OZEROV, RP
机构
来源
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS | 1989年 / 155卷 / 01期
关键词
D O I
10.1002/pssb.2221550119
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
引用
收藏
页码:201 / 207
页数:7
相关论文
共 34 条
[1]   EXACT-EXCHANGE HARTREE-FOCK CALCULATIONS FOR PERIODIC-SYSTEMS - DIRECTIONAL COMPTON PROFILES OF SILICON IN THE IMPULSE APPROXIMATION [J].
ANGONOA, G ;
DOVESI, R ;
PISANI, C ;
ROETTI, C .
PHILOSOPHICAL MAGAZINE B-PHYSICS OF CONDENSED MATTER STATISTICAL MECHANICS ELECTRONIC OPTICAL AND MAGNETIC PROPERTIES, 1981, 44 (03) :413-418
[2]   MEAN-VALUE POINT IN BRILLOUIN ZONE [J].
BALDERESCHI, A .
PHYSICAL REVIEW B, 1973, 7 (12) :5212-5215
[3]   DETERMINATION OF ELECTRONIC ENERGIES FROM EXPERIMENTAL ELECTRON-DENSITIES [J].
BENTLEY, J .
JOURNAL OF CHEMICAL PHYSICS, 1979, 70 (01) :159-164
[4]  
CLINTON WL, 1973, INT J QUANTUM CHEM, P505
[5]   DIRECT DETERMINATION OF PURE-STATE DENSITY MATRICES .2. CONSTRUCTION OF CONSTRAINED IDEMPOTENT ONE-BODY DENSITIES [J].
CLINTON, WL ;
GALLI, AJ ;
MASSA, LJ .
PHYSICAL REVIEW, 1969, 177 (01) :7-&
[6]   EXACT-EXCHANGE HARTREE-FOCK CALCULATIONS FOR PERIODIC SYSTEMS .3. GROUND-STATE PROPERTIES OF DIAMOND [J].
DOVESI, R ;
PISANI, C ;
RICCA, F ;
ROETTI, C .
PHYSICAL REVIEW B, 1980, 22 (12) :5936-5944
[7]   EXACT-EXCHANGE HARTREE-FOCK CALCULATIONS FOR PERIODIC-SYSTEMS .5. GROUND-STATE PROPERTIES OF SILICON [J].
DOVESI, R ;
CAUSA, M ;
ANGONOA, G .
PHYSICAL REVIEW B, 1981, 24 (08) :4177-4183
[8]  
EUWEMA RN, 1975, J CHEM PHYS, V62, P4465
[9]  
EUWEMA RN, 1973, PHYS REV B, V8, P818
[10]   SPECIAL POINTS OF THE BRILLOUIN-ZONE AND THEIR USE IN THE SOLID-STATE THEORY [J].
EVARESTOV, RA ;
SMIRNOV, VP .
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS, 1983, 119 (01) :9-40