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CNDO/2 AND INDO ALL-VALENCE-ELECTRON CALCULATIONS ON GEOMETRY AND PROPERTIES OF SOME INTERHALOGENS
被引:70
作者
:
DEB, BM
论文数:
0
引用数:
0
h-index:
0
DEB, BM
COULSON, CA
论文数:
0
引用数:
0
h-index:
0
COULSON, CA
机构
:
来源
:
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL
|
1971年
/ 08期
关键词
:
D O I
:
10.1039/j19710000958
中图分类号
:
O6 [化学];
学科分类号
:
0703 ;
摘要
:
引用
收藏
页码:958 / &
相关论文
共 61 条
[1]
Abramovitz M., 1964, HDB MATH FUNCTIONS, P229
[2]
BAILEY JPM, 1969, THESIS OXFORD U
[3]
GILLESPIES MODEL MOLECULAR ORBITALS AND MOLECULAR STRUCTURE
BARTELL, LS
论文数:
0
引用数:
0
h-index:
0
BARTELL, LS
[J].
INORGANIC CHEMISTRY,
1966,
5
(09)
: 1635
-
&
[4]
VIBRATIONAL SPECTRA AND VALENCE FORCE CONSTANTS OF SQUARE-PYRAMIDAL MOLECULES-XEOF4,IF5,BRF5, AND CLF5
BEGUN, GM
论文数:
0
引用数:
0
h-index:
0
BEGUN, GM
FLETCHER, WH
论文数:
0
引用数:
0
h-index:
0
FLETCHER, WH
SMITH, DF
论文数:
0
引用数:
0
h-index:
0
SMITH, DF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(06)
: 2236
-
&
[5]
VALENCE-SHELL CALCULATIONS ON POLYATOMIC MOLECULES .I. CNDO SCF CALCULATIONS ON NITROGEN AND OXYGEN HETEROCYCLICS
BLOOR, JE
论文数:
0
引用数:
0
h-index:
0
BLOOR, JE
BREEN, DL
论文数:
0
引用数:
0
h-index:
0
BREEN, DL
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1967,
89
(26)
: 6835
-
&
[6]
VALENCE SHELL CALCULATIONS ON POLYATOMIC MOLECULES .2. CNDO SCF CALCULATIONS ON MONOSUBSTITUTED BENZENES
BLOOR, JE
论文数:
0
引用数:
0
h-index:
0
BLOOR, JE
BREEN, DL
论文数:
0
引用数:
0
h-index:
0
BREEN, DL
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1968,
72
(02)
: 716
-
&
[7]
OPTIMUM PARAMETRIZATION OF POPLE-SANTRY-SEGAL METHOD OF TREATING ALL VALENCE ELECTRONS
BROWN, RD
论文数:
0
引用数:
0
h-index:
0
BROWN, RD
BURDEN, FR
论文数:
0
引用数:
0
h-index:
0
BURDEN, FR
[J].
THEORETICA CHIMICA ACTA,
1968,
12
(02):
: 95
-
+
[8]
STRUCTURE OF THE INTERHALOGEN COMPOUNDS .2. IODINE HEPTAFLUORIDE AT -110-DEGREES-C AND AT -145-DEGREES-C
BURBANK, RD
论文数:
0
引用数:
0
h-index:
0
BURBANK, RD
BENSEY, FN
论文数:
0
引用数:
0
h-index:
0
BENSEY, FN
[J].
JOURNAL OF CHEMICAL PHYSICS,
1957,
27
(04)
: 981
-
982
[9]
SIMPLE BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING FIRST- + SECOND-ROW ATOMS
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
[J].
JOURNAL OF CHEMICAL PHYSICS,
1964,
40
(07)
: 1944
-
&
[10]
AB INITIO COMPUTATIONS IN ATOMS AND MOLECULES
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
[J].
IBM JOURNAL OF RESEARCH AND DEVELOPMENT,
1965,
9
(01)
: 2
-
&
←
1
2
3
4
5
6
7
→
共 61 条
[1]
Abramovitz M., 1964, HDB MATH FUNCTIONS, P229
[2]
BAILEY JPM, 1969, THESIS OXFORD U
[3]
GILLESPIES MODEL MOLECULAR ORBITALS AND MOLECULAR STRUCTURE
BARTELL, LS
论文数:
0
引用数:
0
h-index:
0
BARTELL, LS
[J].
INORGANIC CHEMISTRY,
1966,
5
(09)
: 1635
-
&
[4]
VIBRATIONAL SPECTRA AND VALENCE FORCE CONSTANTS OF SQUARE-PYRAMIDAL MOLECULES-XEOF4,IF5,BRF5, AND CLF5
BEGUN, GM
论文数:
0
引用数:
0
h-index:
0
BEGUN, GM
FLETCHER, WH
论文数:
0
引用数:
0
h-index:
0
FLETCHER, WH
SMITH, DF
论文数:
0
引用数:
0
h-index:
0
SMITH, DF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(06)
: 2236
-
&
[5]
VALENCE-SHELL CALCULATIONS ON POLYATOMIC MOLECULES .I. CNDO SCF CALCULATIONS ON NITROGEN AND OXYGEN HETEROCYCLICS
BLOOR, JE
论文数:
0
引用数:
0
h-index:
0
BLOOR, JE
BREEN, DL
论文数:
0
引用数:
0
h-index:
0
BREEN, DL
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1967,
89
(26)
: 6835
-
&
[6]
VALENCE SHELL CALCULATIONS ON POLYATOMIC MOLECULES .2. CNDO SCF CALCULATIONS ON MONOSUBSTITUTED BENZENES
BLOOR, JE
论文数:
0
引用数:
0
h-index:
0
BLOOR, JE
BREEN, DL
论文数:
0
引用数:
0
h-index:
0
BREEN, DL
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1968,
72
(02)
: 716
-
&
[7]
OPTIMUM PARAMETRIZATION OF POPLE-SANTRY-SEGAL METHOD OF TREATING ALL VALENCE ELECTRONS
BROWN, RD
论文数:
0
引用数:
0
h-index:
0
BROWN, RD
BURDEN, FR
论文数:
0
引用数:
0
h-index:
0
BURDEN, FR
[J].
THEORETICA CHIMICA ACTA,
1968,
12
(02):
: 95
-
+
[8]
STRUCTURE OF THE INTERHALOGEN COMPOUNDS .2. IODINE HEPTAFLUORIDE AT -110-DEGREES-C AND AT -145-DEGREES-C
BURBANK, RD
论文数:
0
引用数:
0
h-index:
0
BURBANK, RD
BENSEY, FN
论文数:
0
引用数:
0
h-index:
0
BENSEY, FN
[J].
JOURNAL OF CHEMICAL PHYSICS,
1957,
27
(04)
: 981
-
982
[9]
SIMPLE BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING FIRST- + SECOND-ROW ATOMS
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
[J].
JOURNAL OF CHEMICAL PHYSICS,
1964,
40
(07)
: 1944
-
&
[10]
AB INITIO COMPUTATIONS IN ATOMS AND MOLECULES
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
[J].
IBM JOURNAL OF RESEARCH AND DEVELOPMENT,
1965,
9
(01)
: 2
-
&
←
1
2
3
4
5
6
7
→