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ANALYTIC-FUNCTION FOR THE H + CH3 REVERSIBLE CH4 POTENTIAL-ENERGY SURFACE
被引:117
作者
:
DUCHOVIC, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
DUCHOVIC, RJ
[
1
]
HASE, WL
论文数:
0
引用数:
0
h-index:
0
机构:
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
HASE, WL
[
1
]
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
机构:
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
SCHLEGEL, HB
[
1
]
机构
:
[1]
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
来源
:
JOURNAL OF PHYSICAL CHEMISTRY
|
1984年
/ 88卷
/ 07期
关键词
:
D O I
:
10.1021/j150651a021
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:1339 / 1347
页数:9
相关论文
共 65 条
[1]
[Anonymous], 1966, GAS PHASE REACTION R
[2]
TRANSITION-STATES FOR ABSTRACTION REACTIONS OF TRIPLET METHYLENE WITH HYDROGEN AND METHANE
[J].
BAUSCHLICHER, CW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
BAUSCHLICHER, CW
;
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
BENDER, CF
;
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
SCHAEFER, HF
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(11)
:3072
-3074
[3]
RAMAN-SPECTRUM OF CH-12(4) BETWEEN 2850 AND 3100 CM
[J].
BERGER, H
论文数:
0
引用数:
0
h-index:
0
机构:
LAB SPECTRONOMIE MOLEC,CNRS,EQUIPE RECH,F-2100 DIJON,FRANCE
LAB SPECTRONOMIE MOLEC,CNRS,EQUIPE RECH,F-2100 DIJON,FRANCE
BERGER, H
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1977,
66
(01)
:55
-61
[4]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .21. SMALL SPLIT-VALENCE BASIS-SETS FOR 1ST-ROW ELEMENTS
[J].
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
BINKLEY, JS
;
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
POPLE, JA
;
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
HEHRE, WJ
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1980,
102
(03)
:939
-947
[5]
POTENTIAL-ENERGY SURFACE FOR THE GROUND-STATE OF FORMALDEHYDE, H2CO(X1A1)
[J].
CARTER, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
CARTER, S
;
MILLS, IM
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
MILLS, IM
;
MURRELL, JN
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
MURRELL, JN
.
MOLECULAR PHYSICS,
1980,
39
(02)
:455
-469
[6]
CRITICAL-POINT ANALYSIS OF INSTABILITIES IN HAMILTONIAN-SYSTEMS - CLASSICAL MECHANICS OF STOCHASTIC INTRA-MOLECULAR ENERGY-TRANSFER
[J].
CERJAN, C
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV COLORADO,DEPT CHEM,BOULDER,CO 80309
CERJAN, C
;
REINHARDT, WP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV COLORADO,DEPT CHEM,BOULDER,CO 80309
REINHARDT, WP
.
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(04)
:1819
-1831
[7]
GROUND-STATE ROTATIONAL-CONSTANTS OF C-12H3D1
[J].
CHACKERIAN, C
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
CHACKERIAN, C
;
GUELACHVILI, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
GUELACHVILI, G
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1980,
84
(02)
:447
-456
[8]
CHIPMAN DM, J CHEM PHYS
[9]
SPECTRAL INTENSITIES IN THE NU-3-BANDS OF (CH4)-C-12 AND (CH4)-C-13
[J].
DANGNHU, M
论文数:
0
引用数:
0
h-index:
0
机构:
MIT,LINCOLN LAB,LEXINGTON,MA 02173
DANGNHU, M
;
PINE, AS
论文数:
0
引用数:
0
h-index:
0
机构:
MIT,LINCOLN LAB,LEXINGTON,MA 02173
PINE, AS
;
ROBIETTE, AG
论文数:
0
引用数:
0
h-index:
0
机构:
MIT,LINCOLN LAB,LEXINGTON,MA 02173
ROBIETTE, AG
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1979,
77
(01)
:57
-68
[10]
EFFECT OF ELECTRON CORRELATION ON THEORETICAL EQUILIBRIUM GEOMETRIES .2. COMPARISON OF THIRD-ORDER PERTURBATION AND CONFIGURATION-INTERACTION RESULTS WITH EXPERIMENT
[J].
DEFREES, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
DEFREES, DJ
;
RAGHAVACHARI, K
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
RAGHAVACHARI, K
;
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
SCHLEGEL, HB
;
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
POPLE, JA
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1982,
104
(21)
:5576
-5580
←
1
2
3
4
5
6
7
→
共 65 条
[1]
[Anonymous], 1966, GAS PHASE REACTION R
[2]
TRANSITION-STATES FOR ABSTRACTION REACTIONS OF TRIPLET METHYLENE WITH HYDROGEN AND METHANE
[J].
BAUSCHLICHER, CW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
BAUSCHLICHER, CW
;
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
BENDER, CF
;
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
SCHAEFER, HF
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(11)
:3072
-3074
[3]
RAMAN-SPECTRUM OF CH-12(4) BETWEEN 2850 AND 3100 CM
[J].
BERGER, H
论文数:
0
引用数:
0
h-index:
0
机构:
LAB SPECTRONOMIE MOLEC,CNRS,EQUIPE RECH,F-2100 DIJON,FRANCE
LAB SPECTRONOMIE MOLEC,CNRS,EQUIPE RECH,F-2100 DIJON,FRANCE
BERGER, H
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1977,
66
(01)
:55
-61
[4]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .21. SMALL SPLIT-VALENCE BASIS-SETS FOR 1ST-ROW ELEMENTS
[J].
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
BINKLEY, JS
;
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
POPLE, JA
;
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
HEHRE, WJ
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1980,
102
(03)
:939
-947
[5]
POTENTIAL-ENERGY SURFACE FOR THE GROUND-STATE OF FORMALDEHYDE, H2CO(X1A1)
[J].
CARTER, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
CARTER, S
;
MILLS, IM
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
MILLS, IM
;
MURRELL, JN
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
UNIV SUSSEX,SCH MOLEC SCI,BRIGHTON BN1 9QJ,E SUSSEX,ENGLAND
MURRELL, JN
.
MOLECULAR PHYSICS,
1980,
39
(02)
:455
-469
[6]
CRITICAL-POINT ANALYSIS OF INSTABILITIES IN HAMILTONIAN-SYSTEMS - CLASSICAL MECHANICS OF STOCHASTIC INTRA-MOLECULAR ENERGY-TRANSFER
[J].
CERJAN, C
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV COLORADO,DEPT CHEM,BOULDER,CO 80309
CERJAN, C
;
REINHARDT, WP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV COLORADO,DEPT CHEM,BOULDER,CO 80309
REINHARDT, WP
.
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(04)
:1819
-1831
[7]
GROUND-STATE ROTATIONAL-CONSTANTS OF C-12H3D1
[J].
CHACKERIAN, C
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
CHACKERIAN, C
;
GUELACHVILI, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
UNIV PARIS 11,CTR ORSAY,CNRS,INFRAROUGE LAB,F-91405 ORSAY,FRANCE
GUELACHVILI, G
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1980,
84
(02)
:447
-456
[8]
CHIPMAN DM, J CHEM PHYS
[9]
SPECTRAL INTENSITIES IN THE NU-3-BANDS OF (CH4)-C-12 AND (CH4)-C-13
[J].
DANGNHU, M
论文数:
0
引用数:
0
h-index:
0
机构:
MIT,LINCOLN LAB,LEXINGTON,MA 02173
DANGNHU, M
;
PINE, AS
论文数:
0
引用数:
0
h-index:
0
机构:
MIT,LINCOLN LAB,LEXINGTON,MA 02173
PINE, AS
;
ROBIETTE, AG
论文数:
0
引用数:
0
h-index:
0
机构:
MIT,LINCOLN LAB,LEXINGTON,MA 02173
ROBIETTE, AG
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1979,
77
(01)
:57
-68
[10]
EFFECT OF ELECTRON CORRELATION ON THEORETICAL EQUILIBRIUM GEOMETRIES .2. COMPARISON OF THIRD-ORDER PERTURBATION AND CONFIGURATION-INTERACTION RESULTS WITH EXPERIMENT
[J].
DEFREES, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
DEFREES, DJ
;
RAGHAVACHARI, K
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
RAGHAVACHARI, K
;
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
SCHLEGEL, HB
;
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
POPLE, JA
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1982,
104
(21)
:5576
-5580
←
1
2
3
4
5
6
7
→