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MOLECULAR-ORBITAL THEORY OF HYDROGEN-BOND .2. DIMERS CONTAINING H2O2 AND H2O
被引:24
作者
:
DELBENE, JE
论文数:
0
引用数:
0
h-index:
0
DELBENE, JE
机构
:
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1972年
/ 56卷
/ 10期
关键词
:
D O I
:
10.1063/1.1676970
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:4923 / &
相关论文
共 16 条
[1]
THEORY OF MOLECULAR INTERACTIONS .1. MOLECULAR ORBITAL STUDIES OF WATER POLYMERS USING A MINIMAL SLATER-TYPE BASIS
DELBENE, J
论文数:
0
引用数:
0
h-index:
0
DELBENE, J
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(09)
: 4858
-
+
[2]
DELBENE JE, 1971, J CHEM PHYS, V55, P2296, DOI 10.1063/1.1676408
[3]
DELBENE JE, 1971, J CHEM PHYS, V55, P4633, DOI 10.1063/1.1676800
[4]
SCF MO LCGO studies on hydrogen bonding. The water dimer
Dierckssen, Geerd H. F.
论文数:
0
引用数:
0
h-index:
0
机构:
Max Planck Inst Phys & Astrophys, D-8 Munich 23, Germany
Max Planck Inst Phys & Astrophys, D-8 Munich 23, Germany
Dierckssen, Geerd H. F.
[J].
CHEMICAL PHYSICS LETTERS,
1969,
4
(06)
: 373
-
375
[5]
WATER MOLECULE INTERACTIONS
HANKINS, D
论文数:
0
引用数:
0
h-index:
0
HANKINS, D
MOSKOWITZ, JW
论文数:
0
引用数:
0
h-index:
0
MOSKOWITZ, JW
STILLINGER, FH
论文数:
0
引用数:
0
h-index:
0
STILLINGER, FH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(12)
: 4544
-
+
[6]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .I. USE OF GAUSSIAN EXPANSIONS OF SLATER-TYPE ATOMIC ORBITALS
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Carnegie-Mellon University, Pittsburgh
HEHRE, WJ
STEWART, RF
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Carnegie-Mellon University, Pittsburgh
STEWART, RF
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Carnegie-Mellon University, Pittsburgh
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(06)
: 2657
-
+
[7]
INTERNAL-ROTATION IN HYDROGEN PEROXIDE - FAR-INFRARED SPECTRUM AND DETERMINATION OF HINDERING POTENTIAL
HUNT, RH
论文数:
0
引用数:
0
h-index:
0
HUNT, RH
LEACOCK, RA
论文数:
0
引用数:
0
h-index:
0
LEACOCK, RA
PETERS, CW
论文数:
0
引用数:
0
h-index:
0
PETERS, CW
HECHT, KT
论文数:
0
引用数:
0
h-index:
0
HECHT, KT
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(06)
: 1931
-
&
[8]
THEORY OF HYDROGEN BOND - ELECTRONIC STRUCTURE AND PROPERTIES OF WATER DIMER
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
ALLEN, LC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(08)
: 3286
-
&
[9]
THEORY OF HYDROGEN BOND - AB-INITIO CALCULATIONS ON HYDROGEN FLUORIDE DIMER AND MIXED WATER-HYDROGEN FLUORIDE DIMER
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
ALLEN, LC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(10)
: 5085
-
&
[10]
NATURE OF HYDROGEN BOND - DIMERS INVOLVING ELECTRONEGATIVE ATOMS OF FIRST ROW
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
ALLEN, LC
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(20)
: 4991
-
&
←
1
2
→
共 16 条
[1]
THEORY OF MOLECULAR INTERACTIONS .1. MOLECULAR ORBITAL STUDIES OF WATER POLYMERS USING A MINIMAL SLATER-TYPE BASIS
DELBENE, J
论文数:
0
引用数:
0
h-index:
0
DELBENE, J
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(09)
: 4858
-
+
[2]
DELBENE JE, 1971, J CHEM PHYS, V55, P2296, DOI 10.1063/1.1676408
[3]
DELBENE JE, 1971, J CHEM PHYS, V55, P4633, DOI 10.1063/1.1676800
[4]
SCF MO LCGO studies on hydrogen bonding. The water dimer
Dierckssen, Geerd H. F.
论文数:
0
引用数:
0
h-index:
0
机构:
Max Planck Inst Phys & Astrophys, D-8 Munich 23, Germany
Max Planck Inst Phys & Astrophys, D-8 Munich 23, Germany
Dierckssen, Geerd H. F.
[J].
CHEMICAL PHYSICS LETTERS,
1969,
4
(06)
: 373
-
375
[5]
WATER MOLECULE INTERACTIONS
HANKINS, D
论文数:
0
引用数:
0
h-index:
0
HANKINS, D
MOSKOWITZ, JW
论文数:
0
引用数:
0
h-index:
0
MOSKOWITZ, JW
STILLINGER, FH
论文数:
0
引用数:
0
h-index:
0
STILLINGER, FH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(12)
: 4544
-
+
[6]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .I. USE OF GAUSSIAN EXPANSIONS OF SLATER-TYPE ATOMIC ORBITALS
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Carnegie-Mellon University, Pittsburgh
HEHRE, WJ
STEWART, RF
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Carnegie-Mellon University, Pittsburgh
STEWART, RF
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Carnegie-Mellon University, Pittsburgh
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(06)
: 2657
-
+
[7]
INTERNAL-ROTATION IN HYDROGEN PEROXIDE - FAR-INFRARED SPECTRUM AND DETERMINATION OF HINDERING POTENTIAL
HUNT, RH
论文数:
0
引用数:
0
h-index:
0
HUNT, RH
LEACOCK, RA
论文数:
0
引用数:
0
h-index:
0
LEACOCK, RA
PETERS, CW
论文数:
0
引用数:
0
h-index:
0
PETERS, CW
HECHT, KT
论文数:
0
引用数:
0
h-index:
0
HECHT, KT
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(06)
: 1931
-
&
[8]
THEORY OF HYDROGEN BOND - ELECTRONIC STRUCTURE AND PROPERTIES OF WATER DIMER
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
ALLEN, LC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(08)
: 3286
-
&
[9]
THEORY OF HYDROGEN BOND - AB-INITIO CALCULATIONS ON HYDROGEN FLUORIDE DIMER AND MIXED WATER-HYDROGEN FLUORIDE DIMER
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
ALLEN, LC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(10)
: 5085
-
&
[10]
NATURE OF HYDROGEN BOND - DIMERS INVOLVING ELECTRONEGATIVE ATOMS OF FIRST ROW
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
ALLEN, LC
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(20)
: 4991
-
&
←
1
2
→