THE ELECTRONIC-STRUCTURE OF NITROMETHANE - A MULTICONFIGURATION SELF-CONSISTENT FIELD-STUDY

被引：0

作者：

MARYNICK, DS

RAY, AK

FRY, JL

KLEIER, DA

机构：

[1] UNIV TEXAS, DEPT PHYS, ARLINGTON, TX 76019 USA

[2] SHELL DEV CO, BIOL SCI RES CTR, MODESTO, CA 95352 USA

来源：

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1984年 / 17卷 / 1-2期

关键词：

D O I：

暂无

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：45 / 48

页数：4

共 50 条

[1] MODELING OF ELECTRONIC-STRUCTURE OF COMPLEXES WITH MOLECULAR-OXYGEN, BASED ON SEMIEMPIRICAL MULTICONFIGURATION SELF-CONSISTENT FIELD METHOD
SIZOVA, OV
BARANOVSKII, VI
IVANOVA, NV
JOURNAL OF STRUCTURAL CHEMISTRY, 1991, 32 (01) : 7 - 14
[2] SELF-CONSISTENT ELECTRONIC-STRUCTURE OF FEAL
KOENIG, C
KHAN, MA
PHYSICAL REVIEW B, 1983, 27 (10): : 6129 - 6135
[3] SELF-CONSISTENT ELECTRONIC-STRUCTURE OF VACANCIES IN SEMICONDUCTORS
JAROS, M
JOURNAL OF CRYSTAL GROWTH, 1985, 72 (1-2) : 139 - 146
[4] SELF-CONSISTENT ELECTRONIC-STRUCTURE OF TRIGONAL SELENIUM
KRUSIUS, P
BOEHM, JV
STUBB, T
PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1975, 67 (02): : 551 - 560
[5] SELF-CONSISTENT ELECTRONIC-STRUCTURE OF SOLID SURFACES
APPELBAUM, JA
HAMANN, DR
PHYSICAL REVIEW B-SOLID STATE, 1972, 6 (06): : 2166 - +
[6] SELF-CONSISTENT ELECTRONIC-STRUCTURE OF LITHIUM CLUSTERS
REDFERN, FR
CHANEY, RC
RUDOLF, PG
PHYSICAL REVIEW B, 1985, 32 (08): : 5023 - 5031
[7] SELF-CONSISTENT ELECTRONIC-STRUCTURE OF A VACANCY IN ALUMINUM
CHAKRABORTY, B
SIEGEL, RW
PICKETT, WE
PHYSICAL REVIEW B, 1981, 24 (10): : 5445 - 5454
[8] SOLUTION OF SELF-CONSISTENT FIELD ELECTRONIC-STRUCTURE EQUATIONS BY A PSEUDOSPECTRAL METHOD
FRIESNER, RA
CHEMICAL PHYSICS LETTERS, 1985, 116 (01) : 39 - 43
[9] NUMERICAL MULTICONFIGURATION SELF-CONSISTENT FIELD-STUDY OF THE TOTAL (ELECTRONIC AND NUCLEAR) PARALLEL POLARIZABILITY AND HYPERPOLARIZABILITY FOR THE OH, OH+, OH-
ADAMOWICZ, L
JOURNAL OF CHEMICAL PHYSICS, 1988, 89 (10): : 6305 - 6309
[10] DIRECT OPTIMIZATION OF ORBITALS FOR MULTICONFIGURATION SELF-CONSISTENT FIELD-THEORY BY UNITARY TRANSFORMATIONS - APPLICATION TO THE SELF-CONSISTENT AND MULTICONFIGURATION SELF-CONSISTENT FIELD-THEORIES
POLEZZO, S
FANTUCCI, P
GAZZETTA CHIMICA ITALIANA, 1981, 111 (1-2): : 49 - 52

← 1 2 3 4 5 →