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THE CONSERVATION OF QUANTUM ZERO-POINT ENERGIES IN CLASSICAL TRAJECTORY SIMULATIONS - REPLY
被引:18
作者
:
MCCORMACK, DA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MELBOURNE,SCH CHEM,PARKVILLE,VIC 3052,AUSTRALIA
UNIV MELBOURNE,SCH CHEM,PARKVILLE,VIC 3052,AUSTRALIA
MCCORMACK, DA
[
1
]
LIM, KF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MELBOURNE,SCH CHEM,PARKVILLE,VIC 3052,AUSTRALIA
UNIV MELBOURNE,SCH CHEM,PARKVILLE,VIC 3052,AUSTRALIA
LIM, KF
[
1
]
机构
:
[1]
UNIV MELBOURNE,SCH CHEM,PARKVILLE,VIC 3052,AUSTRALIA
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1995年
/ 103卷
/ 05期
关键词
:
D O I
:
10.1063/1.469725
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:1991 / 1992
页数:2
相关论文
共 14 条
[1]
CONSERVATION OF ZERO-POINT ENERGY IN CLASSICAL TRAJECTORY COMPUTATIONS BY A SIMPLE SEMICLASSICAL CORRESPONDENCE
[J].
BENNUN, M
论文数:
0
引用数:
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h-index:
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机构:
Fritz Haber Research Center for Molecular Dynamics, Hebrew University
BENNUN, M
;
LEVINE, RD
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Fritz Haber Research Center for Molecular Dynamics, Hebrew University
LEVINE, RD
.
JOURNAL OF CHEMICAL PHYSICS,
1994,
101
(10)
:8768
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[2]
A METHOD TO CONSTRAIN VIBRATIONAL-ENERGY IN QUASICLASSICAL TRAJECTORY CALCULATIONS
[J].
BOWMAN, JM
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0
引用数:
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BOWMAN, JM
;
GAZDY, B
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SUN, QY
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JOURNAL OF CHEMICAL PHYSICS,
1989,
91
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:2859
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[3]
EVANS DJF, COMMUNICATION
[4]
ROTATIONAL EFFECTS ON THE OVERTONE-INDUCED ISOMERIZATION RATE FOR CHD2NC-]CHD2CN
[J].
GUTOW, JH
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0
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0
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0
机构:
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
GUTOW, JH
;
ZARE, RN
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STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
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.
JOURNAL OF PHYSICAL CHEMISTRY,
1992,
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:2534
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[5]
EFFECT OF ANHARMONICITY ON INTERMOLECULAR ENERGY-TRANSFER FROM HIGHLY VIBRATIONALLY EXCITED MOLECULES
[J].
HU, XC
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HU, XC
;
HASE, WL
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0
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JOURNAL OF PHYSICAL CHEMISTRY,
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[6]
QUASI-CLASSICAL TRAJECTORY STUDY OF COLLISIONAL ENERGY-TRANSFER IN TOLUENE SYSTEMS .1. ARGON BATH GAS - ENERGY-DEPENDENCE AND ISOTOPE EFFECTS
[J].
LIM, KF
论文数:
0
引用数:
0
h-index:
0
机构:
School of Chemistry, University of Melbourne, Parkville
LIM, KF
.
JOURNAL OF CHEMICAL PHYSICS,
1994,
100
(10)
:7385
-7399
[7]
THE CONSERVATION OF QUANTUM ZERO-POINT ENERGIES IN CLASSICAL TRAJECTORY SIMULATIONS
[J].
LIM, KF
论文数:
0
引用数:
0
h-index:
0
机构:
School of Chemistry, University of Melbourne, Parkville
LIM, KF
;
MCCORMACK, DA
论文数:
0
引用数:
0
h-index:
0
机构:
School of Chemistry, University of Melbourne, Parkville
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.
JOURNAL OF CHEMICAL PHYSICS,
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:1705
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[8]
CLASSICAL MECHANICS OF INTRAMOLECULAR VIBRATIONAL-ENERGY FLOW IN BENZENE .5. EFFECT OF ZERO-POINT ENERGY MOTION
[J].
LU, DH
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0
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0
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0
LU, DH
;
HASE, WL
论文数:
0
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HASE, WL
.
JOURNAL OF CHEMICAL PHYSICS,
1989,
91
(12)
:7490
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[9]
A SIMPLE-MODEL FOR CORRECTING THE ZERO-POINT ENERGY PROBLEM IN CLASSICAL TRAJECTORY SIMULATIONS OF POLYATOMIC-MOLECULES
[J].
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
MILLER, WH
;
HASE, WL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
HASE, WL
;
DARLING, CL
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0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
DARLING, CL
.
JOURNAL OF CHEMICAL PHYSICS,
1989,
91
(05)
:2863
-2868
[10]
ANALYSIS AND EXTENSION OF A MODEL FOR CONSTRAINING ZERO-POINT ENERGY-FLOW IN CLASSICAL TRAJECTORY SIMULATIONS
[J].
PESLHERBE, GH
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Wayne State University, Detroit
PESLHERBE, GH
;
HASE, WL
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Wayne State University, Detroit
HASE, WL
.
JOURNAL OF CHEMICAL PHYSICS,
1994,
100
(02)
:1179
-1189
←
1
2
→
共 14 条
[1]
CONSERVATION OF ZERO-POINT ENERGY IN CLASSICAL TRAJECTORY COMPUTATIONS BY A SIMPLE SEMICLASSICAL CORRESPONDENCE
[J].
BENNUN, M
论文数:
0
引用数:
0
h-index:
0
机构:
Fritz Haber Research Center for Molecular Dynamics, Hebrew University
BENNUN, M
;
LEVINE, RD
论文数:
0
引用数:
0
h-index:
0
机构:
Fritz Haber Research Center for Molecular Dynamics, Hebrew University
LEVINE, RD
.
JOURNAL OF CHEMICAL PHYSICS,
1994,
101
(10)
:8768
-8783
[2]
A METHOD TO CONSTRAIN VIBRATIONAL-ENERGY IN QUASICLASSICAL TRAJECTORY CALCULATIONS
[J].
BOWMAN, JM
论文数:
0
引用数:
0
h-index:
0
BOWMAN, JM
;
GAZDY, B
论文数:
0
引用数:
0
h-index:
0
GAZDY, B
;
SUN, QY
论文数:
0
引用数:
0
h-index:
0
SUN, QY
.
JOURNAL OF CHEMICAL PHYSICS,
1989,
91
(05)
:2859
-2862
[3]
EVANS DJF, COMMUNICATION
[4]
ROTATIONAL EFFECTS ON THE OVERTONE-INDUCED ISOMERIZATION RATE FOR CHD2NC-]CHD2CN
[J].
GUTOW, JH
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
GUTOW, JH
;
ZARE, RN
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
STANFORD UNIV,DEPT CHEM,STANFORD,CA 94305
ZARE, RN
.
JOURNAL OF PHYSICAL CHEMISTRY,
1992,
96
(06)
:2534
-2543
[5]
EFFECT OF ANHARMONICITY ON INTERMOLECULAR ENERGY-TRANSFER FROM HIGHLY VIBRATIONALLY EXCITED MOLECULES
[J].
HU, XC
论文数:
0
引用数:
0
h-index:
0
HU, XC
;
HASE, WL
论文数:
0
引用数:
0
h-index:
0
HASE, WL
.
JOURNAL OF PHYSICAL CHEMISTRY,
1988,
92
(14)
:4040
-4046
[6]
QUASI-CLASSICAL TRAJECTORY STUDY OF COLLISIONAL ENERGY-TRANSFER IN TOLUENE SYSTEMS .1. ARGON BATH GAS - ENERGY-DEPENDENCE AND ISOTOPE EFFECTS
[J].
LIM, KF
论文数:
0
引用数:
0
h-index:
0
机构:
School of Chemistry, University of Melbourne, Parkville
LIM, KF
.
JOURNAL OF CHEMICAL PHYSICS,
1994,
100
(10)
:7385
-7399
[7]
THE CONSERVATION OF QUANTUM ZERO-POINT ENERGIES IN CLASSICAL TRAJECTORY SIMULATIONS
[J].
LIM, KF
论文数:
0
引用数:
0
h-index:
0
机构:
School of Chemistry, University of Melbourne, Parkville
LIM, KF
;
MCCORMACK, DA
论文数:
0
引用数:
0
h-index:
0
机构:
School of Chemistry, University of Melbourne, Parkville
MCCORMACK, DA
.
JOURNAL OF CHEMICAL PHYSICS,
1995,
102
(04)
:1705
-1715
[8]
CLASSICAL MECHANICS OF INTRAMOLECULAR VIBRATIONAL-ENERGY FLOW IN BENZENE .5. EFFECT OF ZERO-POINT ENERGY MOTION
[J].
LU, DH
论文数:
0
引用数:
0
h-index:
0
LU, DH
;
HASE, WL
论文数:
0
引用数:
0
h-index:
0
HASE, WL
.
JOURNAL OF CHEMICAL PHYSICS,
1989,
91
(12)
:7490
-7497
[9]
A SIMPLE-MODEL FOR CORRECTING THE ZERO-POINT ENERGY PROBLEM IN CLASSICAL TRAJECTORY SIMULATIONS OF POLYATOMIC-MOLECULES
[J].
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
MILLER, WH
;
HASE, WL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
HASE, WL
;
DARLING, CL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
DARLING, CL
.
JOURNAL OF CHEMICAL PHYSICS,
1989,
91
(05)
:2863
-2868
[10]
ANALYSIS AND EXTENSION OF A MODEL FOR CONSTRAINING ZERO-POINT ENERGY-FLOW IN CLASSICAL TRAJECTORY SIMULATIONS
[J].
PESLHERBE, GH
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Wayne State University, Detroit
PESLHERBE, GH
;
HASE, WL
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Wayne State University, Detroit
HASE, WL
.
JOURNAL OF CHEMICAL PHYSICS,
1994,
100
(02)
:1179
-1189
←
1
2
→