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ON THE REPRESENTATION OF FORCE-FIELDS FOR CHEMICALLY REACTING SYSTEMS
被引:57
作者
:
WILLIAMS, IH
论文数:
0
引用数:
0
h-index:
0
WILLIAMS, IH
机构
:
来源
:
CHEMICAL PHYSICS LETTERS
|
1982年
/ 88卷
/ 05期
关键词
:
D O I
:
10.1016/0009-2614(82)83154-0
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:462 / 466
页数:5
相关论文
共 11 条
[1]
INVARIANCE OF MOLECULAR INVERSE FORCE-CONSTANTS
[J].
CYVIN, SJ
论文数:
0
引用数:
0
h-index:
0
CYVIN, SJ
;
SLATER, NB
论文数:
0
引用数:
0
h-index:
0
SLATER, NB
.
NATURE,
1960,
188
(4749)
:485
-485
[2]
COMPLIANCE MATRIX AND MOLECULAR VIBRATIONS
[J].
DECIUS, JC
论文数:
0
引用数:
0
h-index:
0
DECIUS, JC
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(01)
:241
-&
[3]
COMPLETE SETS AND REDUNDANCIES AMONG SMALL VIBRATIONAL COORDINATES
[J].
DECIUS, JC
论文数:
0
引用数:
0
h-index:
0
DECIUS, JC
.
JOURNAL OF CHEMICAL PHYSICS,
1949,
17
(12)
:1315
-1318
[4]
FORCE CONSTANT CALCULATION USING GENERALIZED INVERSE MATRIX
[J].
GELLAI, B
论文数:
0
引用数:
0
h-index:
0
GELLAI, B
;
JANCSO, G
论文数:
0
引用数:
0
h-index:
0
JANCSO, G
.
JOURNAL OF MOLECULAR STRUCTURE,
1972,
12
(03)
:478
-&
[5]
INTERPRETATION OF POTENTIAL CONSTANTS - APPLICATION TO STUDY OF BONDING FORCES IN METAL CYANIDE COMPLEXES AND METAL-CARBONYLS
[J].
JONES, LH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,LOS ALAMOS,NM 87545
JONES, LH
;
SWANSON, BI
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,LOS ALAMOS,NM 87545
SWANSON, BI
.
ACCOUNTS OF CHEMICAL RESEARCH,
1976,
9
(04)
:128
-134
[6]
KING HF, 1980, NATL RESOUR COMPUT C, V1
[7]
SPANGLER D, UNPUB
[8]
MINIMUM ENERGY COORDINATES - RELATIONSHIP BETWEEN MOLECULAR VIBRATIONS AND REACTION COORDINATES
[J].
SWANSON, BI
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
SWANSON, BI
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(11)
:3067
-3071
[9]
REDUNDANCY COEFFICIENTS FOR VIBRATIONS INVOLVING ATOMS WITH 4 BONDS
[J].
TYPKE, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ULM,DEPT PHYS CHEM,D-7900 ULM,FED REP GER
UNIV ULM,DEPT PHYS CHEM,D-7900 ULM,FED REP GER
TYPKE, V
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1977,
64
(01)
:70
-74
[10]
THEORETICAL-MODELS FOR TRANSITION-STATE STRUCTURE AND CATALYSIS IN CARBONYL ADDITION
[J].
WILLIAMS, IH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
WILLIAMS, IH
;
SPANGLER, D
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
SPANGLER, D
;
FEMEC, DA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
FEMEC, DA
;
MAGGIORA, GM
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
MAGGIORA, GM
;
SCHOWEN, RL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
SCHOWEN, RL
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1980,
102
(21)
:6619
-6621
←
1
2
→
共 11 条
[1]
INVARIANCE OF MOLECULAR INVERSE FORCE-CONSTANTS
[J].
CYVIN, SJ
论文数:
0
引用数:
0
h-index:
0
CYVIN, SJ
;
SLATER, NB
论文数:
0
引用数:
0
h-index:
0
SLATER, NB
.
NATURE,
1960,
188
(4749)
:485
-485
[2]
COMPLIANCE MATRIX AND MOLECULAR VIBRATIONS
[J].
DECIUS, JC
论文数:
0
引用数:
0
h-index:
0
DECIUS, JC
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(01)
:241
-&
[3]
COMPLETE SETS AND REDUNDANCIES AMONG SMALL VIBRATIONAL COORDINATES
[J].
DECIUS, JC
论文数:
0
引用数:
0
h-index:
0
DECIUS, JC
.
JOURNAL OF CHEMICAL PHYSICS,
1949,
17
(12)
:1315
-1318
[4]
FORCE CONSTANT CALCULATION USING GENERALIZED INVERSE MATRIX
[J].
GELLAI, B
论文数:
0
引用数:
0
h-index:
0
GELLAI, B
;
JANCSO, G
论文数:
0
引用数:
0
h-index:
0
JANCSO, G
.
JOURNAL OF MOLECULAR STRUCTURE,
1972,
12
(03)
:478
-&
[5]
INTERPRETATION OF POTENTIAL CONSTANTS - APPLICATION TO STUDY OF BONDING FORCES IN METAL CYANIDE COMPLEXES AND METAL-CARBONYLS
[J].
JONES, LH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,LOS ALAMOS,NM 87545
JONES, LH
;
SWANSON, BI
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,LOS ALAMOS,NM 87545
SWANSON, BI
.
ACCOUNTS OF CHEMICAL RESEARCH,
1976,
9
(04)
:128
-134
[6]
KING HF, 1980, NATL RESOUR COMPUT C, V1
[7]
SPANGLER D, UNPUB
[8]
MINIMUM ENERGY COORDINATES - RELATIONSHIP BETWEEN MOLECULAR VIBRATIONS AND REACTION COORDINATES
[J].
SWANSON, BI
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
SWANSON, BI
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(11)
:3067
-3071
[9]
REDUNDANCY COEFFICIENTS FOR VIBRATIONS INVOLVING ATOMS WITH 4 BONDS
[J].
TYPKE, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ULM,DEPT PHYS CHEM,D-7900 ULM,FED REP GER
UNIV ULM,DEPT PHYS CHEM,D-7900 ULM,FED REP GER
TYPKE, V
.
JOURNAL OF MOLECULAR SPECTROSCOPY,
1977,
64
(01)
:70
-74
[10]
THEORETICAL-MODELS FOR TRANSITION-STATE STRUCTURE AND CATALYSIS IN CARBONYL ADDITION
[J].
WILLIAMS, IH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
WILLIAMS, IH
;
SPANGLER, D
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
SPANGLER, D
;
FEMEC, DA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
FEMEC, DA
;
MAGGIORA, GM
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
MAGGIORA, GM
;
SCHOWEN, RL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045
SCHOWEN, RL
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1980,
102
(21)
:6619
-6621
←
1
2
→