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CNDO CI CALCULATIONS ON SECOND-ROW MOLECULES .1. PHOSPHORIN AND THIOPHENE
被引:119
作者
:
SCHULTE, KW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG, FACH BEREICH PHYS CHEM, BIEGEN STR 12, D-3550 MARBURG, GERMANY
UNIV MARBURG, FACH BEREICH PHYS CHEM, BIEGEN STR 12, D-3550 MARBURG, GERMANY
SCHULTE, KW
[
1
]
SCHWEIG, A
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG, FACH BEREICH PHYS CHEM, BIEGEN STR 12, D-3550 MARBURG, GERMANY
UNIV MARBURG, FACH BEREICH PHYS CHEM, BIEGEN STR 12, D-3550 MARBURG, GERMANY
SCHWEIG, A
[
1
]
机构
:
[1]
UNIV MARBURG, FACH BEREICH PHYS CHEM, BIEGEN STR 12, D-3550 MARBURG, GERMANY
来源
:
THEORETICA CHIMICA ACTA
|
1974年
/ 33卷
/ 01期
关键词
:
D O I
:
10.1007/BF00527622
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:19 / 28
页数:10
相关论文
共 43 条
[31]
OEHLING H, 1971, ANGEW CHEM, V83, P723
[32]
LONG WAVELENGTH ABSORPTION BAND OF THIOPHENE
PADHYE, MR
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0
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0
h-index:
0
PADHYE, MR
DESAI, SR
论文数:
0
引用数:
0
h-index:
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DESAI, SR
[J].
PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON SECTION A,
1952,
65
(388):
: 298
-
299
[33]
A SEMI-EMPIRICAL THEORY OF THE ELECTRONIC SPECTRA AND ELECTRONIC STRUCTURE OF COMPLEX UNSATURATED MOLECULES .2.
PARISER, R
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PARISER, R
PARR, RG
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0
引用数:
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PARR, RG
[J].
JOURNAL OF CHEMICAL PHYSICS,
1953,
21
(05)
: 767
-
776
[34]
THEORETICAL STUDY ON ELECTRON SPECTRA OF SULFUR DERIVATIVES .1. PYRAN DERIVATIVES
PFISTERG.G
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GONBEAU, D
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0
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0
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0
GONBEAU, D
DESCHAMPS, J
论文数:
0
引用数:
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h-index:
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DESCHAMPS, J
[J].
JOURNAL OF MOLECULAR STRUCTURE,
1972,
14
(01)
: 81
-
+
[35]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .I. INVARIANT PROCEDURES
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0
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SEGAL, GA
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0
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SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(10)
: S129
-
+
[36]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .2. CALCULATIONS WITH COMPLETE NEGLECT OF DIFFERENTIAL OVERLAP
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SEGAL, GA
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引用数:
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SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(10)
: S136
-
+
[37]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .3. CNDO RESULTS FOR AB2 AND AB3 SYSTEMS
POPLE, JA
论文数:
0
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0
h-index:
0
POPLE, JA
SEGAL, GA
论文数:
0
引用数:
0
h-index:
0
SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(09)
: 3289
-
&
[38]
POPLE JA, 1970, APPROXIMATE MOLECULA
[39]
The absorption spectra of the cyclic dienes in the vacuum ultra-violet
Price, WC
论文数:
0
引用数:
0
h-index:
0
机构:
Phys Chem Lab, Cambridge, UK
Phys Chem Lab, Cambridge, UK
Price, WC
Walsh, AD
论文数:
0
引用数:
0
h-index:
0
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Phys Chem Lab, Cambridge, UK
Phys Chem Lab, Cambridge, UK
Walsh, AD
[J].
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES,
1941,
179
(A977)
: 0201
-
0214
[40]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .4. CALCULATIONS ON MOLECULES INCLUDING ELEMENTS SODIUM THROUGH CHLORINE
SANTRY, DP
论文数:
0
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0
h-index:
0
SANTRY, DP
SEGAL, GA
论文数:
0
引用数:
0
h-index:
0
SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(01)
: 158
-
&
←
1
2
3
4
5
→
共 43 条
[31]
OEHLING H, 1971, ANGEW CHEM, V83, P723
[32]
LONG WAVELENGTH ABSORPTION BAND OF THIOPHENE
PADHYE, MR
论文数:
0
引用数:
0
h-index:
0
PADHYE, MR
DESAI, SR
论文数:
0
引用数:
0
h-index:
0
DESAI, SR
[J].
PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON SECTION A,
1952,
65
(388):
: 298
-
299
[33]
A SEMI-EMPIRICAL THEORY OF THE ELECTRONIC SPECTRA AND ELECTRONIC STRUCTURE OF COMPLEX UNSATURATED MOLECULES .2.
PARISER, R
论文数:
0
引用数:
0
h-index:
0
PARISER, R
PARR, RG
论文数:
0
引用数:
0
h-index:
0
PARR, RG
[J].
JOURNAL OF CHEMICAL PHYSICS,
1953,
21
(05)
: 767
-
776
[34]
THEORETICAL STUDY ON ELECTRON SPECTRA OF SULFUR DERIVATIVES .1. PYRAN DERIVATIVES
PFISTERG.G
论文数:
0
引用数:
0
h-index:
0
PFISTERG.G
GONBEAU, D
论文数:
0
引用数:
0
h-index:
0
GONBEAU, D
DESCHAMPS, J
论文数:
0
引用数:
0
h-index:
0
DESCHAMPS, J
[J].
JOURNAL OF MOLECULAR STRUCTURE,
1972,
14
(01)
: 81
-
+
[35]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .I. INVARIANT PROCEDURES
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
SANTRY, DP
论文数:
0
引用数:
0
h-index:
0
SANTRY, DP
SEGAL, GA
论文数:
0
引用数:
0
h-index:
0
SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(10)
: S129
-
+
[36]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .2. CALCULATIONS WITH COMPLETE NEGLECT OF DIFFERENTIAL OVERLAP
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
SEGAL, GA
论文数:
0
引用数:
0
h-index:
0
SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(10)
: S136
-
+
[37]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .3. CNDO RESULTS FOR AB2 AND AB3 SYSTEMS
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
SEGAL, GA
论文数:
0
引用数:
0
h-index:
0
SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(09)
: 3289
-
&
[38]
POPLE JA, 1970, APPROXIMATE MOLECULA
[39]
The absorption spectra of the cyclic dienes in the vacuum ultra-violet
Price, WC
论文数:
0
引用数:
0
h-index:
0
机构:
Phys Chem Lab, Cambridge, UK
Phys Chem Lab, Cambridge, UK
Price, WC
Walsh, AD
论文数:
0
引用数:
0
h-index:
0
机构:
Phys Chem Lab, Cambridge, UK
Phys Chem Lab, Cambridge, UK
Walsh, AD
[J].
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES,
1941,
179
(A977)
: 0201
-
0214
[40]
APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .4. CALCULATIONS ON MOLECULES INCLUDING ELEMENTS SODIUM THROUGH CHLORINE
SANTRY, DP
论文数:
0
引用数:
0
h-index:
0
SANTRY, DP
SEGAL, GA
论文数:
0
引用数:
0
h-index:
0
SEGAL, GA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(01)
: 158
-
&
←
1
2
3
4
5
→