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ADIABATIC CORRECTION FOR NONLINEAR TRIATOMIC-MOLECULES - TECHNIQUES AND CALCULATIONS
被引:40
作者
:
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
WOLFSBERG, M
机构
:
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1978年
/ 68卷
/ 06期
关键词
:
D O I
:
10.1063/1.436104
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:2686 / 2695
页数:10
相关论文
共 27 条
[1]
THEORETICAL CALCULATION OF EQUILIBRIUM-CONSTANT FOR ISOTOPIC EXCHANGE-REACTION BETWEEN H-2O AND HD
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
WOLFSBERG, M
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1976,
80
(10)
: 1068
-
1071
[2]
WAVE-EQUATION OF A NONLINEAR TRIATOMIC MOLECULE AND ADIABATIC CORRECTION TO BORN-OPPENHEIMER APPROXIMATION
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
WOLFSBERG, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1977,
67
(02)
: 593
-
603
[3]
EVEN-TEMPERED ATOMIC ORBITALS .4. ATOMIC ORBITAL BASES WITH PSEUDOSCALING CAPABILITY FOR MOLECULAR CALCULATIONS
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
BARDO, RD
RUEDENBERG, K
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
RUEDENBERG, K
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
59
(11)
: 5966
-
5977
[4]
EVEN-TEMPERED ATOMIC ORBITALS .7. THEORETICAL EQUILIBRIUM GEOMETRIES AND REACTION ENERGIES FOR CARBON SUBOXIDE AND OTHER MOLECULES CONTAINING CARBON, OXYGEN, AND HYDROGEN
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
BARDO, RD
RUEDENBERG, K
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
RUEDENBERG, K
[J].
JOURNAL OF CHEMICAL PHYSICS,
1974,
60
(03)
: 932
-
936
[5]
NUCLEAR MASS DEPENDENCE OF ADIABATIC CORRECTION TO BORN-OPPENHEIMER APPROXIMATION
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
WOLFSBERG, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(11)
: 4555
-
4558
[6]
BARDO RD, UNPUBLISHED
[7]
BETHE HA, 1957, QUANTUM MECHANICS ON, P27
[8]
CALCULATION OF EQUILIBRIUM CONSTANTS FOR ISOTOPIC EXCHANGE REACTIONS
BIGELEISEN, J
论文数:
0
引用数:
0
h-index:
0
BIGELEISEN, J
MAYER, MG
论文数:
0
引用数:
0
h-index:
0
MAYER, MG
[J].
JOURNAL OF CHEMICAL PHYSICS,
1947,
15
(05)
: 261
-
267
[9]
STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .1. ENERGY SURFACE OF A WATER MOLECULE IN FIELD OF A LITHIUM POSITIVE-ION
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
POPKIE, H
论文数:
0
引用数:
0
h-index:
0
POPKIE, H
[J].
JOURNAL OF CHEMICAL PHYSICS,
1972,
57
(03)
: 1077
-
&
[10]
AB-INITIO SCF-MO-CI CALCULATIONS FOR H-, H2, AND H3+ USING GAUSSIAN BASIS SETS
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
CSIZMADIA, IG
KARI, RE
论文数:
0
引用数:
0
h-index:
0
KARI, RE
POLANYI, JC
论文数:
0
引用数:
0
h-index:
0
POLANYI, JC
ROACH, AC
论文数:
0
引用数:
0
h-index:
0
ROACH, AC
ROBB, MA
论文数:
0
引用数:
0
h-index:
0
ROBB, MA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(12)
: 6205
-
+
←
1
2
3
→
共 27 条
[1]
THEORETICAL CALCULATION OF EQUILIBRIUM-CONSTANT FOR ISOTOPIC EXCHANGE-REACTION BETWEEN H-2O AND HD
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
WOLFSBERG, M
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1976,
80
(10)
: 1068
-
1071
[2]
WAVE-EQUATION OF A NONLINEAR TRIATOMIC MOLECULE AND ADIABATIC CORRECTION TO BORN-OPPENHEIMER APPROXIMATION
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
WOLFSBERG, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1977,
67
(02)
: 593
-
603
[3]
EVEN-TEMPERED ATOMIC ORBITALS .4. ATOMIC ORBITAL BASES WITH PSEUDOSCALING CAPABILITY FOR MOLECULAR CALCULATIONS
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
BARDO, RD
RUEDENBERG, K
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
RUEDENBERG, K
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
59
(11)
: 5966
-
5977
[4]
EVEN-TEMPERED ATOMIC ORBITALS .7. THEORETICAL EQUILIBRIUM GEOMETRIES AND REACTION ENERGIES FOR CARBON SUBOXIDE AND OTHER MOLECULES CONTAINING CARBON, OXYGEN, AND HYDROGEN
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
BARDO, RD
RUEDENBERG, K
论文数:
0
引用数:
0
h-index:
0
机构:
IOWA STATE UNIV, DEPT CHEM, AMES, IA 50010 USA
RUEDENBERG, K
[J].
JOURNAL OF CHEMICAL PHYSICS,
1974,
60
(03)
: 932
-
936
[5]
NUCLEAR MASS DEPENDENCE OF ADIABATIC CORRECTION TO BORN-OPPENHEIMER APPROXIMATION
BARDO, RD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
BARDO, RD
WOLFSBERG, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
UNIV CALIF,DEPT CHEM,IRVINE,CA 92664
WOLFSBERG, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(11)
: 4555
-
4558
[6]
BARDO RD, UNPUBLISHED
[7]
BETHE HA, 1957, QUANTUM MECHANICS ON, P27
[8]
CALCULATION OF EQUILIBRIUM CONSTANTS FOR ISOTOPIC EXCHANGE REACTIONS
BIGELEISEN, J
论文数:
0
引用数:
0
h-index:
0
BIGELEISEN, J
MAYER, MG
论文数:
0
引用数:
0
h-index:
0
MAYER, MG
[J].
JOURNAL OF CHEMICAL PHYSICS,
1947,
15
(05)
: 261
-
267
[9]
STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .1. ENERGY SURFACE OF A WATER MOLECULE IN FIELD OF A LITHIUM POSITIVE-ION
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
POPKIE, H
论文数:
0
引用数:
0
h-index:
0
POPKIE, H
[J].
JOURNAL OF CHEMICAL PHYSICS,
1972,
57
(03)
: 1077
-
&
[10]
AB-INITIO SCF-MO-CI CALCULATIONS FOR H-, H2, AND H3+ USING GAUSSIAN BASIS SETS
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
CSIZMADIA, IG
KARI, RE
论文数:
0
引用数:
0
h-index:
0
KARI, RE
POLANYI, JC
论文数:
0
引用数:
0
h-index:
0
POLANYI, JC
ROACH, AC
论文数:
0
引用数:
0
h-index:
0
ROACH, AC
ROBB, MA
论文数:
0
引用数:
0
h-index:
0
ROBB, MA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(12)
: 6205
-
+
←
1
2
3
→