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GROUND-STATE GEOMETRIES AND INVERSION BARRIERS FOR SIMPLE COMPLEXES OF EARLY TRANSITION-METALS
被引:47
作者
:
JOLLY, CA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,ARLINGTON,TX 76019
UNIV TEXAS,DEPT CHEM,ARLINGTON,TX 76019
JOLLY, CA
[
1
]
MARYNICK, DS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,ARLINGTON,TX 76019
UNIV TEXAS,DEPT CHEM,ARLINGTON,TX 76019
MARYNICK, DS
[
1
]
机构
:
[1]
UNIV TEXAS,DEPT CHEM,ARLINGTON,TX 76019
来源
:
INORGANIC CHEMISTRY
|
1989年
/ 28卷
/ 14期
关键词
:
D O I
:
10.1021/ic00313a038
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:2893 / 2895
页数:3
相关论文
共 29 条
[1]
ELECTRONIC AND GEOMETRIC STRUCTURES OF SCH+ AND SCH2+
ALVARADOSWAISGOOD, AE
论文数:
0
引用数:
0
h-index:
0
机构:
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
ALVARADOSWAISGOOD, AE
HARRISON, JF
论文数:
0
引用数:
0
h-index:
0
机构:
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
HARRISON, JF
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1985,
89
(24)
: 5198
-
5202
[2]
INTERACTION BETWEEN MATRIX-ISOLATED NICKEL DIFLUORIDE AND CARBON-MONOXIDE - ABINITIO MOLECULAR-ORBITAL STUDY
BESNAINOU, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
BESNAINOU, S
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
WHITTEN, JL
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1978,
100
(12)
: 3692
-
3698
[3]
THE GEOMETRY OF [TIH6]2-
CAMERON, AD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
CAMERON, AD
FITZGERALD, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
FITZGERALD, G
ZERNER, MC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
ZERNER, MC
[J].
INORGANIC CHEMISTRY,
1988,
27
(20)
: 3437
-
3439
[4]
EFFICIENT DIFFUSE FUNCTION-AUGMENTED BASIS SETS FOR ANION CALCULATIONS. III. THE 3-21+G BASIS SET FOR FIRST-ROW ELEMENTS, LI-F
CLARK, T
论文数:
0
引用数:
0
h-index:
0
CLARK, T
CHANDRASEKHAR, J
论文数:
0
引用数:
0
h-index:
0
CHANDRASEKHAR, J
SPITZNAGEL, GW
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0
引用数:
0
h-index:
0
SPITZNAGEL, GW
SCHLEYER, PV
论文数:
0
引用数:
0
h-index:
0
SCHLEYER, PV
[J].
JOURNAL OF COMPUTATIONAL CHEMISTRY,
1983,
4
(03)
: 294
-
301
[5]
DEVIATION FROM THE IDEAL OCTAHEDRAL FIELD VS ALKYL DISTORTION IN D0 METAL ALKYL COMPLEXES - A MO STUDY
DEMOLLIENS, A
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
DEMOLLIENS, A
JEAN, Y
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
JEAN, Y
EISENSTEIN, O
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
EISENSTEIN, O
[J].
ORGANOMETALLICS,
1986,
5
(07)
: 1457
-
1464
[6]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
DITCHFIELD, R
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1971,
54
(02)
: 724
-
+
[7]
Dunning T., 1977, METHODS ELECT STRUCT, P1
[8]
DUPUIS M, 1980, GENERAL ATOMIC MOL E
[9]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .25. SUPPLEMENTARY FUNCTIONS FOR GAUSSIAN-BASIS SETS
FRISCH, MJ
论文数:
0
引用数:
0
h-index:
0
机构:
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
FRISCH, MJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
POPLE, JA
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
机构:
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
BINKLEY, JS
[J].
JOURNAL OF CHEMICAL PHYSICS,
1984,
80
(07)
: 3265
-
3269
[10]
A THEORETICAL-STUDY OF OLEFIN INSERTIONS INTO TI-C AND TI-H BONDS - AN ANALYSIS BY PAIRED INTERACTING ORBITALS
FUJIMOTO, H
论文数:
0
引用数:
0
h-index:
0
FUJIMOTO, H
YAMASAKI, T
论文数:
0
引用数:
0
h-index:
0
YAMASAKI, T
MIZUTANI, H
论文数:
0
引用数:
0
h-index:
0
MIZUTANI, H
KOGA, N
论文数:
0
引用数:
0
h-index:
0
KOGA, N
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1985,
107
(22)
: 6157
-
6161
←
1
2
3
→
共 29 条
[1]
ELECTRONIC AND GEOMETRIC STRUCTURES OF SCH+ AND SCH2+
ALVARADOSWAISGOOD, AE
论文数:
0
引用数:
0
h-index:
0
机构:
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
ALVARADOSWAISGOOD, AE
HARRISON, JF
论文数:
0
引用数:
0
h-index:
0
机构:
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
MICHIGAN STATE UNIV,DEPT CHEM,E LANSING,MI 48824
HARRISON, JF
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1985,
89
(24)
: 5198
-
5202
[2]
INTERACTION BETWEEN MATRIX-ISOLATED NICKEL DIFLUORIDE AND CARBON-MONOXIDE - ABINITIO MOLECULAR-ORBITAL STUDY
BESNAINOU, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
BESNAINOU, S
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR EUROPEEN CALCUL ATOM & MOLEC,F-91405 ORSAY,FRANCE
WHITTEN, JL
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1978,
100
(12)
: 3692
-
3698
[3]
THE GEOMETRY OF [TIH6]2-
CAMERON, AD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
CAMERON, AD
FITZGERALD, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
FITZGERALD, G
ZERNER, MC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
ZERNER, MC
[J].
INORGANIC CHEMISTRY,
1988,
27
(20)
: 3437
-
3439
[4]
EFFICIENT DIFFUSE FUNCTION-AUGMENTED BASIS SETS FOR ANION CALCULATIONS. III. THE 3-21+G BASIS SET FOR FIRST-ROW ELEMENTS, LI-F
CLARK, T
论文数:
0
引用数:
0
h-index:
0
CLARK, T
CHANDRASEKHAR, J
论文数:
0
引用数:
0
h-index:
0
CHANDRASEKHAR, J
SPITZNAGEL, GW
论文数:
0
引用数:
0
h-index:
0
SPITZNAGEL, GW
SCHLEYER, PV
论文数:
0
引用数:
0
h-index:
0
SCHLEYER, PV
[J].
JOURNAL OF COMPUTATIONAL CHEMISTRY,
1983,
4
(03)
: 294
-
301
[5]
DEVIATION FROM THE IDEAL OCTAHEDRAL FIELD VS ALKYL DISTORTION IN D0 METAL ALKYL COMPLEXES - A MO STUDY
DEMOLLIENS, A
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
DEMOLLIENS, A
JEAN, Y
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
JEAN, Y
EISENSTEIN, O
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CHIM THEOR LAB,UNITE 506,BATIMENT 490,F-91405 ORSAY,FRANCE
EISENSTEIN, O
[J].
ORGANOMETALLICS,
1986,
5
(07)
: 1457
-
1464
[6]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
DITCHFIELD, R
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1971,
54
(02)
: 724
-
+
[7]
Dunning T., 1977, METHODS ELECT STRUCT, P1
[8]
DUPUIS M, 1980, GENERAL ATOMIC MOL E
[9]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .25. SUPPLEMENTARY FUNCTIONS FOR GAUSSIAN-BASIS SETS
FRISCH, MJ
论文数:
0
引用数:
0
h-index:
0
机构:
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
FRISCH, MJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
POPLE, JA
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
机构:
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
SANDIA NATL LABS, LIVERMORE, CA 94550 USA
BINKLEY, JS
[J].
JOURNAL OF CHEMICAL PHYSICS,
1984,
80
(07)
: 3265
-
3269
[10]
A THEORETICAL-STUDY OF OLEFIN INSERTIONS INTO TI-C AND TI-H BONDS - AN ANALYSIS BY PAIRED INTERACTING ORBITALS
FUJIMOTO, H
论文数:
0
引用数:
0
h-index:
0
FUJIMOTO, H
YAMASAKI, T
论文数:
0
引用数:
0
h-index:
0
YAMASAKI, T
MIZUTANI, H
论文数:
0
引用数:
0
h-index:
0
MIZUTANI, H
KOGA, N
论文数:
0
引用数:
0
h-index:
0
KOGA, N
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1985,
107
(22)
: 6157
-
6161
←
1
2
3
→