UNRESTRICTED CNDO-MO CALCULATIONS .2. MNO2-/4 AND CRO3-/4

被引：2

作者：

COPELAND, DA ^{[1
]}

机构：

[1] UNIV TENNESSEE,DEPT CHEM,MARTIN,TN 38237

来源：

THEORETICA CHIMICA ACTA | 1973年 / 32卷 / 01期

关键词：

D O I：

10.1007/BF01209414

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

收藏

页码：41 / 47

页数：7

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共 18 条

[1] INTENSITIES IN INORGANIC COMPLEXES .2. TETRAHEDRAL COMPLEXES
BALLHAUSEN, CJ
LIEHR, AD
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1958, 2 (04) : 342 - 360
[2] MOLECULAR ORBITAL THEORY FOR OCTAHEDRAL AND TETRAHEDRAL METAL COMPLEXES
BASCH, H
VISTE, A
GRAY, HB
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (01) : 10 - +
[3] CNDO-MO CALCULATION OF VCL4
BECKER, CAL
DAHL, JP
[J]. THEORETICA CHIMICA ACTA, 1970, 19 (02): : 135 - &
[4] A CNDO-MO CALCULATION OF TICL4
BECKER, CAL
DAHL, JP
[J]. THEORETICA CHIMICA ACTA, 1969, 14 (01): : 26 - &
[5] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION ELEMENT COMPOUNDS .2. CNDO TYPE STUDIES OF PERMANGANATE AND CHROMATE
BROWN, RD
JAMES, BH
MCQUADE, TJV
ODWYER, MF
[J]. THEORETICA CHIMICA ACTA, 1970, 17 (04): : 279 - &
[6] AB INITIO COMPUTATIONS IN ATOMS AND MOLECULES
CLEMENTI, E
[J]. IBM JOURNAL OF RESEARCH AND DEVELOPMENT, 1965, 9 (01) : 2 - &
[7] AN UNRESTRICTED CNDO-MO CALCULATION OF VC14
COPELAND, DA
BALLHAUS.CJ
[J]. THEORETICA CHIMICA ACTA, 1971, 20 (04): : 317 - +
[8] APPROXIMATE RADIAL FUNCTIONS .1. FIRST-ROW TRANSITION-METAL 4S AND 3D ATOMIC ORBITALS
COPELAND, DA
[J]. THEORETICA CHIMICA ACTA, 1972, 27 (04): : 367 - &
[9] ELECTRONIC STRUCTURES OF TETRAHEDRAL CRO2/4- VO3/4- AND TICL4
DAHL, JP
JOHANSEN, H
[J]. THEORETICA CHIMICA ACTA, 1968, 11 (01): : 26 - &
[10] ELECTRONIC STRUCTURE OF PERMANGANATE ION
DAHL, JP
JOHANSEN, H
[J]. THEORETICA CHIMICA ACTA, 1968, 11 (01): : 8 - &