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MOLECULAR-ORBITAL THEORY OF THE PROPERTIES OF INORGANIC AND ORGANOMETALLIC COMPOUNDS .1. STO-NG BASIS-SETS FOR 3RD-ROW MAIN-GROUP ELEMENTS
被引:135
作者
:
PIETRO, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
PIETRO, WJ
LEVI, BA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
LEVI, BA
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
HEHRE, WJ
STEWART, RF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
STEWART, RF
机构
:
[1]
UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717
[2]
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
来源
:
INORGANIC CHEMISTRY
|
1980年
/ 19卷
/ 08期
关键词
:
D O I
:
10.1021/ic50210a005
中图分类号
:
O61 [无机化学];
学科分类号
:
070301 ;
081704 ;
摘要
:
引用
收藏
页码:2225 / 2229
页数:5
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PHOTOELECTRON SPECTROSCOPY OF HIGH-TEMPERATURE VAPORS .2. CHEMICAL BONDING IN GROUP-III MONOHALIDES
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BERKOWITZ, J
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DEHMER, JL
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[J].
CARLSON, KD
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ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS
[J].
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RAIMONDI, DL
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SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .17. GEOMETRIES AND BINDING-ENERGIES OF 2ND-ROW MOLECULES - COMPARISON OF 3 BASIS SETS
[J].
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[J].
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.
JOURNAL OF CHEMICAL PHYSICS,
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←
1
2
3
→
共 25 条
[1]
PHOTOELECTRON SPECTROSCOPY OF HIGH-TEMPERATURE VAPORS .2. CHEMICAL BONDING IN GROUP-III MONOHALIDES
[J].
BERKOWITZ, J
论文数:
0
引用数:
0
h-index:
0
BERKOWITZ, J
;
DEHMER, JL
论文数:
0
引用数:
0
h-index:
0
DEHMER, JL
.
JOURNAL OF CHEMICAL PHYSICS,
1972,
57
(08)
:3194
-+
[2]
ELECTRONIC STRUCTURE AND LOW-LYING TRIPLET STATES OF CAO
[J].
CARLSON, KD
论文数:
0
引用数:
0
h-index:
0
CARLSON, KD
;
KAISER, K
论文数:
0
引用数:
0
h-index:
0
KAISER, K
;
MOSER, C
论文数:
0
引用数:
0
h-index:
0
MOSER, C
;
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(09)
:4678
-&
[3]
ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
RAIMONDI, DL
论文数:
0
引用数:
0
h-index:
0
RAIMONDI, DL
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(11)
:2686
-&
[4]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .17. GEOMETRIES AND BINDING-ENERGIES OF 2ND-ROW MOLECULES - COMPARISON OF 3 BASIS SETS
[J].
COLLINS, JB
论文数:
0
引用数:
0
h-index:
0
机构:
PRINCETON UNIV, DEPT CHEM, PRINCETON, NJ 08540 USA
COLLINS, JB
;
SCHLEYER, PV
论文数:
0
引用数:
0
h-index:
0
机构:
PRINCETON UNIV, DEPT CHEM, PRINCETON, NJ 08540 USA
SCHLEYER, PV
;
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
机构:
PRINCETON UNIV, DEPT CHEM, PRINCETON, NJ 08540 USA
BINKLEY, JS
;
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
PRINCETON UNIV, DEPT CHEM, PRINCETON, NJ 08540 USA
POPLE, JA
.
JOURNAL OF CHEMICAL PHYSICS,
1976,
64
(12)
:5142
-5151
[5]
DEFREES DJ, UNPUBLISHED
[6]
INVERSION BARRIERS OF ASH3 AND SEH3+
[J].
DIXON, DA
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV,DEPT CHEM,GIBBS LAB,CAMBRIDGE,MA 02138
HARVARD UNIV,DEPT CHEM,GIBBS LAB,CAMBRIDGE,MA 02138
DIXON, DA
;
MARYNICK, DS
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV,DEPT CHEM,GIBBS LAB,CAMBRIDGE,MA 02138
HARVARD UNIV,DEPT CHEM,GIBBS LAB,CAMBRIDGE,MA 02138
MARYNICK, DS
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(18)
:6101
-6103
[7]
BARRIERS TO INTERNAL-ROTATION OBTAINED BY PSEUDOPOTENTIAL CALCULATIONS
[J].
EWIG, CS
论文数:
0
引用数:
0
h-index:
0
机构:
VANDERBILT UNIV,DEPT CHEM,NASHVILLE,TN 37235
VANDERBILT UNIV,DEPT CHEM,NASHVILLE,TN 37235
EWIG, CS
;
VANWAZER, JR
论文数:
0
引用数:
0
h-index:
0
机构:
VANDERBILT UNIV,DEPT CHEM,NASHVILLE,TN 37235
VANDERBILT UNIV,DEPT CHEM,NASHVILLE,TN 37235
VANWAZER, JR
.
JOURNAL OF CHEMICAL PHYSICS,
1976,
65
(05)
:2035
-2036
[8]
NONEMPIRICAL LCAO MO SCF STUDIES OF GROUP ILA DIHALIDES BEF2, MGF2, AND CAF2
[J].
GOLE, JL
论文数:
0
引用数:
0
h-index:
0
机构:
RICE UNIV,DEPT CHEM,HOUSTON,TX 77001
RICE UNIV,DEPT CHEM,HOUSTON,TX 77001
GOLE, JL
;
SIU, AKQ
论文数:
0
引用数:
0
h-index:
0
机构:
RICE UNIV,DEPT CHEM,HOUSTON,TX 77001
RICE UNIV,DEPT CHEM,HOUSTON,TX 77001
SIU, AKQ
;
HAYES, EF
论文数:
0
引用数:
0
h-index:
0
机构:
RICE UNIV,DEPT CHEM,HOUSTON,TX 77001
RICE UNIV,DEPT CHEM,HOUSTON,TX 77001
HAYES, EF
.
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(03)
:857
-868
[9]
SELF-CONSISTENT MOLECULAR ORBITAL METHODS .4. USE OF GAUSSIAN EXPANSIONS OF SLATER-TYPE ORBITALS - EXTENSION TO SECOND-ROW MOLECULES
[J].
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
;
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
DITCHFIELD, R
;
STEWART, RF
论文数:
0
引用数:
0
h-index:
0
STEWART, RF
;
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(05)
:2769
-+
[10]
STUDY OF STRUCTURE OF MOLECULAR COMPLEXES .5. HEAT OF FORMATION FOR LI+,NA+,K+,F-, AND CL- ION COMPLEXES WITH A SINGLE WATER MOLECULE
[J].
KISTENMACHER, H
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
KISTENMACHER, H
;
POPKIE, H
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
POPKIE, H
;
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
CLEMENTI, E
.
JOURNAL OF CHEMICAL PHYSICS,
1973,
59
(11)
:5842
-5848
←
1
2
3
→