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ABINITIO MOLECULAR-ORBITAL CALCULATIONS OF GROUND AND EXCITED-STATES OF MONOMERIC LINEAR DICHLORIDES MCL2 (WHERE M=CR,CO, OR CU)
被引:24
作者
:
GARNER, CD
论文数:
0
引用数:
0
h-index:
0
GARNER, CD
HILLIER, IH
论文数:
0
引用数:
0
h-index:
0
HILLIER, IH
WOOD, C
论文数:
0
引用数:
0
h-index:
0
WOOD, C
机构
:
来源
:
INORGANIC CHEMISTRY
|
1978年
/ 17卷
/ 01期
关键词
:
D O I
:
10.1021/ic50179a032
中图分类号
:
O61 [无机化学];
学科分类号
:
070301 ;
081704 ;
摘要
:
引用
收藏
页码:168 / 172
页数:5
相关论文
共 12 条
[1]
AKISHIN PA, 1957, KRISTALLOGRAFIYA, V2, P475
[2]
GAUSSIAN-ORBITAL BASIS SETS FOR FIRST-ROW TRANSITION-METAL ATOMS
BASCH, H
论文数:
0
引用数:
0
h-index:
0
机构:
Scientific Laboratory, Ford Motor Company, Dearborn
BASCH, H
HORNBACK, CJ
论文数:
0
引用数:
0
h-index:
0
机构:
Scientific Laboratory, Ford Motor Company, Dearborn
HORNBACK, CJ
MOSKOWITZ, JW
论文数:
0
引用数:
0
h-index:
0
机构:
Scientific Laboratory, Ford Motor Company, Dearborn
MOSKOWITZ, JW
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(04)
: 1311
-
+
[3]
BUCHLER A, 1964, J CHEM PHYS, V40, P3471
[4]
ELECTRONIC ABSORPTION SPECTRA OF GASEOUS 3D TRANSITION-METAL DICHLORIDES
DEKOCK, CW
论文数:
0
引用数:
0
h-index:
0
DEKOCK, CW
GRUEN, DM
论文数:
0
引用数:
0
h-index:
0
GRUEN, DM
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(12)
: 4387
-
&
[5]
Gaussian basis functions for use in molecular calculations. Contraction of (12s9p) atomic basis sets for the second row atoms
Dunning, T. H., Jr.
论文数:
0
引用数:
0
h-index:
0
机构:
Ballelle Mem Inst, Columbus, OH 43201 USA
Ballelle Mem Inst, Columbus, OH 43201 USA
Dunning, T. H., Jr.
[J].
CHEMICAL PHYSICS LETTERS,
1970,
7
(04)
: 423
-
427
[6]
ABINITIO CALCULATION OF BONDING, EXCITED-STATES, AND G VALUE OF TETRACHLOROCOBALTATE(II), (COCL4)2-
HILLIER, IH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
HILLIER, IH
KENDRICK, J
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
KENDRICK, J
MABBS, FE
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
MABBS, FE
GARNER, CD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
GARNER, CD
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(02)
: 395
-
397
[7]
APPLICATION OF LIGAND FIELD THEORY TO ELECTRONIC SPECTRA OF GASEOUS CUCL2, NICL2, AND COCL2
HOUGEN, JT
论文数:
0
引用数:
0
h-index:
0
HOUGEN, JT
LEROI, GE
论文数:
0
引用数:
0
h-index:
0
LEROI, GE
JAMES, TC
论文数:
0
引用数:
0
h-index:
0
JAMES, TC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1961,
34
(05)
: 1670
-
&
[8]
INFRARED SPECTRA OF GASEOUS TRANSITION-METAL DIHALIDES
LEROI, GE
论文数:
0
引用数:
0
h-index:
0
LEROI, GE
JAMES, TC
论文数:
0
引用数:
0
h-index:
0
JAMES, TC
KLEMPERER, W
论文数:
0
引用数:
0
h-index:
0
KLEMPERER, W
HOUGEN, JT
论文数:
0
引用数:
0
h-index:
0
HOUGEN, JT
[J].
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(11)
: 2879
-
&
[9]
ELECTRONIC-SPECTRA OF LINEAR TRANSITION-METAL DIHALIDES - THEORETICAL APPROACH INVOLVING GROUND-STATE-ENERGY SPACE DIAGRAMS
LEVER, ABP
论文数:
0
引用数:
0
h-index:
0
LEVER, ABP
HOLLEBON.BR
论文数:
0
引用数:
0
h-index:
0
HOLLEBON.BR
[J].
INORGANIC CHEMISTRY,
1972,
11
(09)
: 2183
-
&
[10]
SPECTRA OF MATRIX-ISOLATED NIF2 AND NICL2
MILLIGAN, DE
论文数:
0
引用数:
0
h-index:
0
MILLIGAN, DE
JACOX, ME
论文数:
0
引用数:
0
h-index:
0
JACOX, ME
MCKINLEY, JD
论文数:
0
引用数:
0
h-index:
0
MCKINLEY, JD
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(03)
: 902
-
&
←
1
2
→
共 12 条
[1]
AKISHIN PA, 1957, KRISTALLOGRAFIYA, V2, P475
[2]
GAUSSIAN-ORBITAL BASIS SETS FOR FIRST-ROW TRANSITION-METAL ATOMS
BASCH, H
论文数:
0
引用数:
0
h-index:
0
机构:
Scientific Laboratory, Ford Motor Company, Dearborn
BASCH, H
HORNBACK, CJ
论文数:
0
引用数:
0
h-index:
0
机构:
Scientific Laboratory, Ford Motor Company, Dearborn
HORNBACK, CJ
MOSKOWITZ, JW
论文数:
0
引用数:
0
h-index:
0
机构:
Scientific Laboratory, Ford Motor Company, Dearborn
MOSKOWITZ, JW
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(04)
: 1311
-
+
[3]
BUCHLER A, 1964, J CHEM PHYS, V40, P3471
[4]
ELECTRONIC ABSORPTION SPECTRA OF GASEOUS 3D TRANSITION-METAL DICHLORIDES
DEKOCK, CW
论文数:
0
引用数:
0
h-index:
0
DEKOCK, CW
GRUEN, DM
论文数:
0
引用数:
0
h-index:
0
GRUEN, DM
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(12)
: 4387
-
&
[5]
Gaussian basis functions for use in molecular calculations. Contraction of (12s9p) atomic basis sets for the second row atoms
Dunning, T. H., Jr.
论文数:
0
引用数:
0
h-index:
0
机构:
Ballelle Mem Inst, Columbus, OH 43201 USA
Ballelle Mem Inst, Columbus, OH 43201 USA
Dunning, T. H., Jr.
[J].
CHEMICAL PHYSICS LETTERS,
1970,
7
(04)
: 423
-
427
[6]
ABINITIO CALCULATION OF BONDING, EXCITED-STATES, AND G VALUE OF TETRACHLOROCOBALTATE(II), (COCL4)2-
HILLIER, IH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
HILLIER, IH
KENDRICK, J
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
KENDRICK, J
MABBS, FE
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
MABBS, FE
GARNER, CD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
UNIV MANCHESTER,CHEM DEPT,MANCHESTER M13 9PL,ENGLAND
GARNER, CD
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(02)
: 395
-
397
[7]
APPLICATION OF LIGAND FIELD THEORY TO ELECTRONIC SPECTRA OF GASEOUS CUCL2, NICL2, AND COCL2
HOUGEN, JT
论文数:
0
引用数:
0
h-index:
0
HOUGEN, JT
LEROI, GE
论文数:
0
引用数:
0
h-index:
0
LEROI, GE
JAMES, TC
论文数:
0
引用数:
0
h-index:
0
JAMES, TC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1961,
34
(05)
: 1670
-
&
[8]
INFRARED SPECTRA OF GASEOUS TRANSITION-METAL DIHALIDES
LEROI, GE
论文数:
0
引用数:
0
h-index:
0
LEROI, GE
JAMES, TC
论文数:
0
引用数:
0
h-index:
0
JAMES, TC
KLEMPERER, W
论文数:
0
引用数:
0
h-index:
0
KLEMPERER, W
HOUGEN, JT
论文数:
0
引用数:
0
h-index:
0
HOUGEN, JT
[J].
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(11)
: 2879
-
&
[9]
ELECTRONIC-SPECTRA OF LINEAR TRANSITION-METAL DIHALIDES - THEORETICAL APPROACH INVOLVING GROUND-STATE-ENERGY SPACE DIAGRAMS
LEVER, ABP
论文数:
0
引用数:
0
h-index:
0
LEVER, ABP
HOLLEBON.BR
论文数:
0
引用数:
0
h-index:
0
HOLLEBON.BR
[J].
INORGANIC CHEMISTRY,
1972,
11
(09)
: 2183
-
&
[10]
SPECTRA OF MATRIX-ISOLATED NIF2 AND NICL2
MILLIGAN, DE
论文数:
0
引用数:
0
h-index:
0
MILLIGAN, DE
JACOX, ME
论文数:
0
引用数:
0
h-index:
0
JACOX, ME
MCKINLEY, JD
论文数:
0
引用数:
0
h-index:
0
MCKINLEY, JD
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(03)
: 902
-
&
←
1
2
→