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SEMICLASSICAL REACTION-PATH METHODS APPLIED TO CALCULATE THE TUNNELING SPLITTING IN AMMONIA
被引:30
作者
:
BROWN, FB
论文数:
0
引用数:
0
h-index:
0
BROWN, FB
TUCKER, SC
论文数:
0
引用数:
0
h-index:
0
TUCKER, SC
TRUHLAR, DG
论文数:
0
引用数:
0
h-index:
0
TRUHLAR, DG
机构
:
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1985年
/ 83卷
/ 09期
关键词
:
D O I
:
10.1063/1.449064
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:4451 / 4455
页数:5
相关论文
共 43 条
[1]
AN INTERMOLECULAR POTENTIAL-ENERGY SURFACE FOR (HF)2
BARTON, AE
论文数:
0
引用数:
0
h-index:
0
BARTON, AE
HOWARD, BJ
论文数:
0
引用数:
0
h-index:
0
HOWARD, BJ
[J].
FARADAY DISCUSSIONS,
1982,
73
: 45
-
62
[2]
MICROWAVE SPECTROSCOPIC STUDY OF MALONALDEHYDE (3-HYDROXY-2-PROPENAL) .2. STRUCTURE, DIPOLE-MOMENT, AND TUNNELING
BAUGHCUM, SL
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
BAUGHCUM, SL
DUERST, RW
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
DUERST, RW
ROWE, WF
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
ROWE, WF
SMITH, Z
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
SMITH, Z
WILSON, EB
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
WILSON, EB
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1981,
103
(21)
: 6296
-
6303
[3]
STRUCTURE AND TUNNELING DYNAMICS OF MALONALDEHYDE - A THEORETICAL-STUDY
BICERANO, J
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA
BICERANO, J
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA
SCHAEFER, HF
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA
MILLER, WH
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1983,
105
(09)
: 2550
-
2553
[4]
BOPP P, 1982, Z NATURFORSCH A, V37, P398
[5]
VINYLIDENE - POTENTIAL-ENERGY SURFACE AND UNIMOLECULAR REACTION DYNAMICS
CARRINGTON, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
CARRINGTON, T
HUBBARD, LM
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
HUBBARD, LM
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
SCHAEFER, HF
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
MILLER, WH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1984,
80
(09)
: 4347
-
4354
[6]
REACTION-PATH CURVATURE EFFECTS IN THE ISOMERIZATION OF THE METHOXY RADICAL
COLWELL, SM
论文数:
0
引用数:
0
h-index:
0
COLWELL, SM
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
HANDY, NC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1985,
82
(03)
: 1281
-
1290
[7]
REACTION-PATH HAMILTONIAN STUDY OF THE ISOMERIZATION OF THE METHOXY RADICAL
COLWELL, SM
论文数:
0
引用数:
0
h-index:
0
COLWELL, SM
[J].
MOLECULAR PHYSICS,
1984,
51
(05)
: 1217
-
1233
[8]
QUANTUM EFFECTS NEAR A BARRIER MAXIMUM
FORD, KW
论文数:
0
引用数:
0
h-index:
0
FORD, KW
HILL, DL
论文数:
0
引用数:
0
h-index:
0
HILL, DL
WAKANO, M
论文数:
0
引用数:
0
h-index:
0
WAKANO, M
WHEELER, JA
论文数:
0
引用数:
0
h-index:
0
WHEELER, JA
[J].
ANNALS OF PHYSICS,
1959,
7
(03)
: 239
-
258
[9]
GARRETT BC, 1979, J PHYS CHEM-US, V83, P3058, DOI 10.1021/j100486a600
[10]
GENERALIZED TRANSITION-STATE THEORY - QUANTUM EFFECTS FOR COLLINEAR REACTIONS OF HYDROGEN MOLECULES AND ISOTOPICALLY SUBSTITUTED HYDROGEN MOLECULES
GARRETT, BC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
GARRETT, BC
TRUHLAR, DG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
TRUHLAR, DG
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1979,
83
(08)
: 1079
-
1112
←
1
2
3
4
5
→
共 43 条
[1]
AN INTERMOLECULAR POTENTIAL-ENERGY SURFACE FOR (HF)2
BARTON, AE
论文数:
0
引用数:
0
h-index:
0
BARTON, AE
HOWARD, BJ
论文数:
0
引用数:
0
h-index:
0
HOWARD, BJ
[J].
FARADAY DISCUSSIONS,
1982,
73
: 45
-
62
[2]
MICROWAVE SPECTROSCOPIC STUDY OF MALONALDEHYDE (3-HYDROXY-2-PROPENAL) .2. STRUCTURE, DIPOLE-MOMENT, AND TUNNELING
BAUGHCUM, SL
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
BAUGHCUM, SL
DUERST, RW
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
DUERST, RW
ROWE, WF
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
ROWE, WF
SMITH, Z
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
SMITH, Z
WILSON, EB
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
HARVARD UNIV, DEPT CHEM, CAMBRIDGE, MA 02138 USA
WILSON, EB
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1981,
103
(21)
: 6296
-
6303
[3]
STRUCTURE AND TUNNELING DYNAMICS OF MALONALDEHYDE - A THEORETICAL-STUDY
BICERANO, J
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA
BICERANO, J
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA
SCHAEFER, HF
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA
MILLER, WH
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1983,
105
(09)
: 2550
-
2553
[4]
BOPP P, 1982, Z NATURFORSCH A, V37, P398
[5]
VINYLIDENE - POTENTIAL-ENERGY SURFACE AND UNIMOLECULAR REACTION DYNAMICS
CARRINGTON, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
CARRINGTON, T
HUBBARD, LM
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
HUBBARD, LM
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
SCHAEFER, HF
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
MILLER, WH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1984,
80
(09)
: 4347
-
4354
[6]
REACTION-PATH CURVATURE EFFECTS IN THE ISOMERIZATION OF THE METHOXY RADICAL
COLWELL, SM
论文数:
0
引用数:
0
h-index:
0
COLWELL, SM
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
HANDY, NC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1985,
82
(03)
: 1281
-
1290
[7]
REACTION-PATH HAMILTONIAN STUDY OF THE ISOMERIZATION OF THE METHOXY RADICAL
COLWELL, SM
论文数:
0
引用数:
0
h-index:
0
COLWELL, SM
[J].
MOLECULAR PHYSICS,
1984,
51
(05)
: 1217
-
1233
[8]
QUANTUM EFFECTS NEAR A BARRIER MAXIMUM
FORD, KW
论文数:
0
引用数:
0
h-index:
0
FORD, KW
HILL, DL
论文数:
0
引用数:
0
h-index:
0
HILL, DL
WAKANO, M
论文数:
0
引用数:
0
h-index:
0
WAKANO, M
WHEELER, JA
论文数:
0
引用数:
0
h-index:
0
WHEELER, JA
[J].
ANNALS OF PHYSICS,
1959,
7
(03)
: 239
-
258
[9]
GARRETT BC, 1979, J PHYS CHEM-US, V83, P3058, DOI 10.1021/j100486a600
[10]
GENERALIZED TRANSITION-STATE THEORY - QUANTUM EFFECTS FOR COLLINEAR REACTIONS OF HYDROGEN MOLECULES AND ISOTOPICALLY SUBSTITUTED HYDROGEN MOLECULES
GARRETT, BC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
GARRETT, BC
TRUHLAR, DG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
UNIV MINNESOTA, DEPT CHEM, CHEM DYNAM LAB, MINNEAPOLIS, MN 55455 USA
TRUHLAR, DG
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1979,
83
(08)
: 1079
-
1112
←
1
2
3
4
5
→