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CALCULATION OF TRANSITION-STATES
被引:125
作者
:
POPPINGER, D
论文数:
0
引用数:
0
h-index:
0
机构:
AUSTRALIAN NATL UNIV,RES SCH CHEM,CANBERRA 2600,ACT,AUSTRALIA
AUSTRALIAN NATL UNIV,RES SCH CHEM,CANBERRA 2600,ACT,AUSTRALIA
POPPINGER, D
[
1
]
机构
:
[1]
AUSTRALIAN NATL UNIV,RES SCH CHEM,CANBERRA 2600,ACT,AUSTRALIA
来源
:
CHEMICAL PHYSICS LETTERS
|
1975年
/ 35卷
/ 04期
关键词
:
D O I
:
10.1016/0009-2614(75)85665-X
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:550 / 554
页数:5
相关论文
共 17 条
[1]
REACTION PATHWAYS FOR TRIPLET METHYLENE ABSTRACTION CH2 (B-3(1)) + H2-] CH3 + H
BASKIN, CP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
BASKIN, CP
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
BENDER, CF
BAUSCHLI.CW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
BAUSCHLI.CW
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
SCHAEFER, HF
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1974,
96
(09)
: 2709
-
2713
[2]
MINDO-3 STUDY OF THERMAL CONVERSION OF CYCLOBUTENE TO 1,3-BUTADIEN
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
KIRSCHNE.S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
KIRSCHNE.S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1974,
96
(21)
: 6809
-
6810
[3]
CLASSICAL AND NONCLASSICAL POTENTIAL SURFACES - SIGNIFICANCE OF ANTIAROMATICITY IN TRANSITION STATES
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
DEWAR, MJS
KIRSCHNE.S
论文数:
0
引用数:
0
h-index:
0
KIRSCHNE.S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(17)
: 4292
-
&
[4]
MINDO/2 STUDY OF ANTIAROMATIC (FORBIDDEN) ELECTROCYCLIC PROCESSES
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
DEWAR, MJS
KIRSCHNE.S
论文数:
0
引用数:
0
h-index:
0
KIRSCHNE.S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(17)
: 4291
-
&
[5]
OPTIMIZATION OF SCF LCAO WAVE FUNCTIONS
FLETCHER, R
论文数:
0
引用数:
0
h-index:
0
FLETCHER, R
[J].
MOLECULAR PHYSICS,
1970,
19
(01)
: 55
-
&
[6]
HADDON RC, COMMUNICATION
[7]
POTENTIAL-ENERGY SURFACE FOR ADDITION OF BENZYNE TO ETHYLENE
HAYES, DM
论文数:
0
引用数:
0
h-index:
0
HAYES, DM
HOFFMANN, R
论文数:
0
引用数:
0
h-index:
0
HOFFMANN, R
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1972,
76
(05)
: 656
-
&
[8]
HEHRE WJ, QCPE236 U IND PROGR
[9]
STRUCTURE OF TRANSITION-STATES .3. A MINDO-2 STUDY OF CYCLIZATION OF 1,3,5-HEXATRIENE TO 1,3-CYCLOHEXADIENE
KOMORNIC.A
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
KOMORNIC.A
MCIVER, JW
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
MCIVER, JW
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1974,
96
(18)
: 5798
-
5800
[10]
LAIDLER KJ, 1969, THEORIES CHEMICAL RE
←
1
2
→
共 17 条
[1]
REACTION PATHWAYS FOR TRIPLET METHYLENE ABSTRACTION CH2 (B-3(1)) + H2-] CH3 + H
BASKIN, CP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
BASKIN, CP
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
BENDER, CF
BAUSCHLI.CW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
BAUSCHLI.CW
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,LAWRENCE LIVERMORE LAB,LIVERMORE,CA 94550
SCHAEFER, HF
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1974,
96
(09)
: 2709
-
2713
[2]
MINDO-3 STUDY OF THERMAL CONVERSION OF CYCLOBUTENE TO 1,3-BUTADIEN
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
KIRSCHNE.S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
KIRSCHNE.S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1974,
96
(21)
: 6809
-
6810
[3]
CLASSICAL AND NONCLASSICAL POTENTIAL SURFACES - SIGNIFICANCE OF ANTIAROMATICITY IN TRANSITION STATES
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
DEWAR, MJS
KIRSCHNE.S
论文数:
0
引用数:
0
h-index:
0
KIRSCHNE.S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(17)
: 4292
-
&
[4]
MINDO/2 STUDY OF ANTIAROMATIC (FORBIDDEN) ELECTROCYCLIC PROCESSES
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
DEWAR, MJS
KIRSCHNE.S
论文数:
0
引用数:
0
h-index:
0
KIRSCHNE.S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(17)
: 4291
-
&
[5]
OPTIMIZATION OF SCF LCAO WAVE FUNCTIONS
FLETCHER, R
论文数:
0
引用数:
0
h-index:
0
FLETCHER, R
[J].
MOLECULAR PHYSICS,
1970,
19
(01)
: 55
-
&
[6]
HADDON RC, COMMUNICATION
[7]
POTENTIAL-ENERGY SURFACE FOR ADDITION OF BENZYNE TO ETHYLENE
HAYES, DM
论文数:
0
引用数:
0
h-index:
0
HAYES, DM
HOFFMANN, R
论文数:
0
引用数:
0
h-index:
0
HOFFMANN, R
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1972,
76
(05)
: 656
-
&
[8]
HEHRE WJ, QCPE236 U IND PROGR
[9]
STRUCTURE OF TRANSITION-STATES .3. A MINDO-2 STUDY OF CYCLIZATION OF 1,3,5-HEXATRIENE TO 1,3-CYCLOHEXADIENE
KOMORNIC.A
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
KOMORNIC.A
MCIVER, JW
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
SUNY Buffalo, DEPT CHEM, BUFFALO, NY 14214 USA
MCIVER, JW
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1974,
96
(18)
: 5798
-
5800
[10]
LAIDLER KJ, 1969, THEORIES CHEMICAL RE
←
1
2
→