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SCMEH-MO calculations on Cr2 and Mo2 molecules
被引:15
作者
:
Boudreaux, EA
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Boudreaux, EA
[
1
]
Baxter, E
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Baxter, E
[
1
]
机构
:
[1]
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
来源
:
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
|
2001年
/ 85卷
/ 4-5期
关键词
:
SCMEH-MO calculations;
Slater-type orbital functions;
antiferromagnetic coupling;
D O I
:
10.1002/qua.1539
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:509 / 513
页数:5
相关论文
共 4 条
[1]
BOUDREAUX EA, 1986, INT J QUANTUM CHEM Q, V20, P239
[2]
MASS-SPECTROMETRIC OBSERVATION AND BOND-DISSOCIATION ENERGY OF DIMOLYBDENUM, MO2(G)
GUPTA, SK
论文数:
0
引用数:
0
h-index:
0
机构:
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
GUPTA, SK
ATKINS, RM
论文数:
0
引用数:
0
h-index:
0
机构:
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
ATKINS, RM
GINGERICH, KA
论文数:
0
引用数:
0
h-index:
0
机构:
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
GINGERICH, KA
[J].
INORGANIC CHEMISTRY,
1978,
17
(11)
: 3211
-
3213
[3]
MARTIN RL, 1968, NEW PATHWAYS INORGAN, pCH9
[4]
The Cr2 molecule:: some perspectives
Thomas, EJ
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Thomas, EJ
Murray, JS
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Murray, JS
O'Connor, CJ
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
O'Connor, CJ
Politzer, P
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Politzer, P
[J].
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM,
1999,
487
(1-2):
: 177
-
182
←
1
→
共 4 条
[1]
BOUDREAUX EA, 1986, INT J QUANTUM CHEM Q, V20, P239
[2]
MASS-SPECTROMETRIC OBSERVATION AND BOND-DISSOCIATION ENERGY OF DIMOLYBDENUM, MO2(G)
GUPTA, SK
论文数:
0
引用数:
0
h-index:
0
机构:
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
GUPTA, SK
ATKINS, RM
论文数:
0
引用数:
0
h-index:
0
机构:
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
ATKINS, RM
GINGERICH, KA
论文数:
0
引用数:
0
h-index:
0
机构:
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
TEXAS A&M UNIV,DEPT CHEM,COLLEGE STN,TX 77843
GINGERICH, KA
[J].
INORGANIC CHEMISTRY,
1978,
17
(11)
: 3211
-
3213
[3]
MARTIN RL, 1968, NEW PATHWAYS INORGAN, pCH9
[4]
The Cr2 molecule:: some perspectives
Thomas, EJ
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Thomas, EJ
Murray, JS
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Murray, JS
O'Connor, CJ
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
O'Connor, CJ
Politzer, P
论文数:
0
引用数:
0
h-index:
0
机构:
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Univ New Orleans, Dept Chem, New Orleans, LA 70148 USA
Politzer, P
[J].
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM,
1999,
487
(1-2):
: 177
-
182
←
1
→