CYCLIC CLUSTER CALCULATION ON THE ELECTRONIC-STRUCTURE OF ALPHA-QUARTZ AND OF ITS VACANCY

被引：13
|
作者：
DEAK, P
GIBER, J
机构：
来源：
PHYSICS LETTERS A | 1982年 / 88卷 / 05期
关键词：
D O I：
10.1016/0375-9601(82)90237-7
中图分类号：
O4 [物理学];
学科分类号：
0702 ;
摘要：
引用
收藏
页码：237 / 240
页数：4
相关论文
共 50 条
  • [1] THE ELECTRONIC-STRUCTURE OF ALPHA-QUARTZ - A PERIODIC HARTREE-FOCK CALCULATION
    DOVESI, R
    PISANI, C
    ROETTI, C
    SILVI, B
    JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (12): : 6967 - 6971
  • [2] ELECTRONIC-STRUCTURE OF AN UNRECONSTRUCTED (1010) ALPHA-QUARTZ SURFACE
    NYLEN, M
    PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1984, 122 (01): : 301 - 308
  • [3] ELECTRONIC-STRUCTURE OF POINT-DEFECTS IN ALPHA-QUARTZ
    NYLEN, M
    JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1986, 19 (14): : 2403 - 2417
  • [4] TIGHT-BINDING STUDY OF ELECTRONIC-STRUCTURE OF ALPHA-QUARTZ
    NUCHO, RN
    MADHUKAR, A
    BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1978, 23 (03): : 294 - 294
  • [5] ELECTRONIC-STRUCTURE OF ALPHA-QUARTZ - A XANES STUDY OF EMPTY STATES
    BART, F
    JOLLET, F
    DURAUD, JP
    DOUILLARD, L
    PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1993, 176 (01): : 163 - 176
  • [6] ELECTRONIC-STRUCTURE OF ALPHA-QUARTZ - SELF-CONSISTENT PSEUDOPOTENTIAL APPROACH
    CHELIKOWSKY, JR
    BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1977, 22 (03): : 416 - 416
  • [7] ELECTRONIC-STRUCTURE OF SIO2 - ALPHA-QUARTZ AND THE INFLUENCE OF LOCAL DISORDER
    NUCHO, RN
    MADHUKAR, A
    PHYSICAL REVIEW B, 1980, 21 (04): : 1576 - 1588
  • [8] QUANTUM CHEMICAL STUDY OF PROPERTIES AND REACTIVITY OF QUARTZ DUST .1. ELECTRONIC-STRUCTURE OF ALPHA-QUARTZ
    HOBZA, P
    HURYCH, J
    ENVIRONMENTAL RESEARCH, 1978, 15 (03) : 432 - 442
  • [9] ISOLATED AND EMBEDDED-CLUSTER MODELING OF THE OXYGEN VACANCY IN ALPHA-QUARTZ
    SULIMOV, VB
    PISANI, C
    CORA, F
    SOKOLOV, VO
    SOLID STATE COMMUNICATIONS, 1994, 90 (08) : 511 - 514
  • [10] The structure of alpha-quartz
    Wei, PH
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1935, 92 (5/6): : 355 - 362
12345