F-TYPE CENTERS AND HYDROGEN ANIONS IN MGO - HARTREE-FOCK GROUND-STATES

被引:51
作者
PANDEY, R [1 ]
VAIL, JM [1 ]
机构
[1] UNIV MANITOBA,DEPT PHYS,WINNIPEG R3T 2N2,MANITOBA,CANADA
关键词
D O I
10.1088/0953-8984/1/17/003
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:2801 / 2820
页数:20
相关论文
共 34 条
[1]  
CATLOW CRA, 1982, COMPUTER SIMULATION, P3
[2]   ELECTRONIC-STRUCTURE AND STABILITY OF DIFFERENT CRYSTAL PHASES OF MAGNESIUM-OXIDE [J].
CAUSA, M ;
DOVESI, R ;
PISANI, C ;
ROETTI, C .
PHYSICAL REVIEW B, 1986, 33 (02) :1308-1316
[3]   LUMINESCENCE OF F+ CENTER IN MGO [J].
CHEN, Y ;
KOLOPUS, JL ;
SIBLEY, WA .
PHYSICAL REVIEW, 1969, 186 (03) :865-&
[4]   ELECTRONIC STATES OF F-TYPE CENTERS IN OXIDE CRYSTALS - A NEW PICTURE [J].
CHOI, S ;
TAKEUCHI, T .
PHYSICAL REVIEW LETTERS, 1983, 50 (19) :1474-1477
[5]  
Ewald PP, 1921, ANN PHYS-BERLIN, V64, P253
[6]  
GILBERT TL, 1964, MOL ORBITALS CHEM PH, P405
[7]   PERTURBATION-THEORY METHOD OF CALCULATING THE ENERGIES AND EXCITATION-ENERGIES OF ATOMIC, MOLECULAR, AND SOLID-STATE SYSTEMS [J].
GOALWIN, PW ;
KUNZ, AB .
PHYSICAL REVIEW B, 1986, 34 (04) :2140-2146
[8]   APPROXIMATE WAVE FUNCTIONS FOR THE F-CENTER, AND THEIR APPLICATION TO THE ELECTRON SPIN RESONANCE PROBLEM [J].
GOURARY, BS ;
ADRIAN, FJ .
PHYSICAL REVIEW, 1957, 105 (04) :1180-1192
[9]   HARTREE-FOCK CLUSTER COMPUTATIONS OF DEFECT AND PERFECT IONIC-CRYSTAL PROPERTIES [J].
HARDING, JH ;
HARKER, AH ;
KEEGSTRA, PB ;
PANDEY, R ;
VAIL, JM ;
WOODWARD, C .
PHYSICA B & C, 1985, 131 (1-3) :151-156
[10]   DOSE DEPENDENCE OF F-CENTRE PRODUCTION BY FAST NEUTRONS IN MAGNESIUM OXIDE [J].
HENDERSON, B ;
KING, RD .
PHILOSOPHICAL MAGAZINE, 1966, 13 (126) :1149-+