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ABINITIO STUDY ON THE ISOPROPYL RADICAL
被引:34
作者
:
PACANSKY, J
论文数:
0
引用数:
0
h-index:
0
PACANSKY, J
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
DUPUIS, M
机构
:
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1980年
/ 73卷
/ 04期
关键词
:
D O I
:
10.1063/1.440322
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:1867 / 1872
页数:6
相关论文
共 21 条
[1]
[Anonymous], MOL VIBRATIONS THEOR
[2]
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
-
+
[3]
MOLECULAR SYMMETRY .2. GRADIENT OF ELECTRONIC-ENERGY WITH RESPECT TO NUCLEAR COORDINATES
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1978,
68
(09)
: 3998
-
4004
[4]
EVALUATION OF MOLECULAR INTEGRALS OVER GAUSSIAN BASIS FUNCTIONS
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
RYS, J
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
RYS, J
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1976,
65
(01)
: 111
-
116
[5]
ELECTRON SPIN RESONANCE STUDIES OF TRANSIENT ALKYL RADICALS
FESSENDEN, RW
论文数:
0
引用数:
0
h-index:
0
FESSENDEN, RW
SCHULER, RH
论文数:
0
引用数:
0
h-index:
0
SCHULER, RH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1963,
39
(09)
: 2147
-
&
[6]
TILT AND ASYMMETRY OF METHYL-GROUPS IN ASYMMETRIC ENVIRONMENTS
FLOOD, E
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
FLOOD, E
PULAY, P
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
PULAY, P
BOGGS, JE
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
BOGGS, JE
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(17)
: 5570
-
5574
[7]
1ST IONIZATION-POTENTIAL OF ETHYL RADICAL BY PHOTOELECTRON-SPECTROSCOPY
HOULE, FA
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
HOULE, FA
BEAUCHAMP, JL
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
BEAUCHAMP, JL
[J].
CHEMICAL PHYSICS LETTERS,
1977,
48
(03)
: 457
-
460
[8]
HELIUM(I) PHOTOELECTRON-SPECTRA OF ORGANIC RADICALS
KOENIG, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
KOENIG, T
BALLE, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
BALLE, T
SNELL, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
SNELL, W
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975,
97
(03)
: 662
-
663
[9]
EFFICIENT DETERMINATION AND CHARACTERIZATION OF TRANSITION-STATES USING ABINITIO METHODS
KOMORNICKI, A
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
KOMORNICKI, A
ISHIDA, K
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
ISHIDA, K
MOROKUMA, K
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
MOROKUMA, K
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
DITCHFIELD, R
CONRAD, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
CONRAD, M
[J].
CHEMICAL PHYSICS LETTERS,
1977,
45
(03)
: 595
-
602
[10]
MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .10. SYSTEMATIC STUDY OF GEOMETRIES AND ENERGIES OF AHN MOLECULES AND CATIONS
LATHAN, WA
论文数:
0
引用数:
0
h-index:
0
LATHAN, WA
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
CURTISS, LA
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(24)
: 6377
-
+
←
1
2
3
→
共 21 条
[1]
[Anonymous], MOL VIBRATIONS THEOR
[2]
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
-
+
[3]
MOLECULAR SYMMETRY .2. GRADIENT OF ELECTRONIC-ENERGY WITH RESPECT TO NUCLEAR COORDINATES
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1978,
68
(09)
: 3998
-
4004
[4]
EVALUATION OF MOLECULAR INTEGRALS OVER GAUSSIAN BASIS FUNCTIONS
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
RYS, J
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
RYS, J
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1976,
65
(01)
: 111
-
116
[5]
ELECTRON SPIN RESONANCE STUDIES OF TRANSIENT ALKYL RADICALS
FESSENDEN, RW
论文数:
0
引用数:
0
h-index:
0
FESSENDEN, RW
SCHULER, RH
论文数:
0
引用数:
0
h-index:
0
SCHULER, RH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1963,
39
(09)
: 2147
-
&
[6]
TILT AND ASYMMETRY OF METHYL-GROUPS IN ASYMMETRIC ENVIRONMENTS
FLOOD, E
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
FLOOD, E
PULAY, P
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
PULAY, P
BOGGS, JE
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
BOGGS, JE
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(17)
: 5570
-
5574
[7]
1ST IONIZATION-POTENTIAL OF ETHYL RADICAL BY PHOTOELECTRON-SPECTROSCOPY
HOULE, FA
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
HOULE, FA
BEAUCHAMP, JL
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
CALTECH,ARTHUR AMOS NOYES LAB CHEM PHYS,PASADENA,CA 91125
BEAUCHAMP, JL
[J].
CHEMICAL PHYSICS LETTERS,
1977,
48
(03)
: 457
-
460
[8]
HELIUM(I) PHOTOELECTRON-SPECTRA OF ORGANIC RADICALS
KOENIG, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
KOENIG, T
BALLE, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
BALLE, T
SNELL, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
UNIV OREGON,DEPT CHEM,EUGENE,OR 97403
SNELL, W
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975,
97
(03)
: 662
-
663
[9]
EFFICIENT DETERMINATION AND CHARACTERIZATION OF TRANSITION-STATES USING ABINITIO METHODS
KOMORNICKI, A
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
KOMORNICKI, A
ISHIDA, K
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
ISHIDA, K
MOROKUMA, K
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
MOROKUMA, K
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
DITCHFIELD, R
CONRAD, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627
CONRAD, M
[J].
CHEMICAL PHYSICS LETTERS,
1977,
45
(03)
: 595
-
602
[10]
MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .10. SYSTEMATIC STUDY OF GEOMETRIES AND ENERGIES OF AHN MOLECULES AND CATIONS
LATHAN, WA
论文数:
0
引用数:
0
h-index:
0
LATHAN, WA
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
CURTISS, LA
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(24)
: 6377
-
+
←
1
2
3
→