THEORETICAL-STUDY OF THE ELECTRONIC-STRUCTURE AND 3D-]NL EXCITATIONS FOR KMGF3-FE-2+ AND KMGF3-V-2+ CRYSTALS

被引：6
作者：
HEATON, RA
LIN, CC
机构：
来源：
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS | 1985年 / 18卷 / 16期
关键词：
D O I：
10.1088/0022-3719/18/16/016
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：3211 / 3223
页数：13
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共 27 条
[1]   ENERGY BAND STRUCTURE OF LITHIUM FLUORIDE CRYSTALS BY METHOD OF TIGHT BINDING [J].
CHANEY, RC ;
LAFON, EE ;
LIN, CC .
PHYSICAL REVIEW B, 1971, 4 (08) :2734-&
[2]   ELECTRONIC-STRUCTURE OF F-CENTER IN A LITHIUM-FLUORIDE CRYSTAL BY METHOD OF LINEAR COMBINATIONS OF ATOMIC ORBITALS [J].
CHANEY, RC ;
LIN, CC .
PHYSICAL REVIEW B, 1976, 13 (02) :843-851
[3]   ELECTRONIC-ENERGY STRUCTURE OF AMORPHOUS SILICON [J].
CHING, WY ;
LIN, CC ;
HUBER, DL .
PHYSICAL REVIEW B, 1976, 14 (02) :620-631
[4]   CALCULATION OF MOLECULAR ESCA SPECTRA BY MULTIPLE-SCATTERING X-ALPHA METHOD [J].
CONNOLLY, JW ;
SIEGBAHN, H ;
GELIUS, U ;
NORDLING, C .
JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (10) :4265-4277
[5]   ELECTRONIC PAIR EXCITATIONS OF MN2+ AND NI2+ IN PEROVSKITE FLUORIDES - INVOLVEMENT OF T-31GA STATE OF NI2+ [J].
FERGUSON, J ;
GUDEL, HU ;
KRAUSZ, ER .
MOLECULAR PHYSICS, 1975, 30 (04) :1139-1147
[6]  
HARRISON JG, 1981, PHYS REV B, V24, P6060, DOI 10.1103/PhysRevB.24.6060
[7]   SELF-CONSISTENT-FIELD ELECTRONIC-STRUCTURE OF CU+ IMPURITY STATES IN A LICL CRYSTAL [J].
HARRISON, JG ;
LIN, CC .
PHYSICAL REVIEW B, 1981, 23 (08) :3894-3902
[8]   SELF-INTERACTION CORRECTION TO THE LOCAL DENSITY HARTREE-FOCK ATOMIC CALCULATIONS OF EXCITED AND GROUND-STATES [J].
HARRISON, JG ;
HEATON, RA ;
LIN, CC .
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1983, 16 (12) :2079-2091
[9]   SELF-INTERACTION CORRECTION FOR DENSITY-FUNCTIONAL THEORY OF ELECTRONIC-ENERGY BANDS OF SOLIDS [J].
HEATON, RA ;
HARRISON, JG ;
LIN, CC .
PHYSICAL REVIEW B, 1983, 28 (10) :5992-6007
[10]   ELECTRONIC ENERGY-BAND STRUCTURE OF THE CALCIUM-FLUORIDE CRYSTAL [J].
HEATON, RA ;
LIN, CC .
PHYSICAL REVIEW B, 1980, 22 (08) :3629-3638
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