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THEORETICAL PREDICTION OF EXISTENCE AND PROPERTIES OF LITHIUM HYDRIDE DIMER
被引:65
作者
:
KOLLMAN, P
论文数:
0
引用数:
0
h-index:
0
KOLLMAN, P
ROTHENBE.S
论文数:
0
引用数:
0
h-index:
0
ROTHENBE.S
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
BENDER, CF
机构
:
来源
:
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
|
1972年
/ 94卷
/ 23期
关键词
:
D O I
:
10.1021/ja00778a014
中图分类号
:
O6 [化学];
学科分类号
:
0703 ;
摘要
:
引用
收藏
页码:8016 / &
相关论文
共 23 条
[1]
AB INITIO CALCULATION OF HELIUM-HELIUM 1SIGMAG+ POTENTIAL AT INTERMEDIATE AND LARGE SEPARATIONS
[J].
BERTONCI.P
论文数:
0
引用数:
0
h-index:
0
BERTONCI.P
;
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
.
PHYSICAL REVIEW LETTERS,
1970,
25
(15)
:991
-&
[2]
THEORETICAL STUDY OF 1SIGMA+, 3SIGMA+, 3PI, 1PI STATES OF NALI AND 2SIGMA+ STATE OF NALI+
[J].
BERTONCI.PJ
论文数:
0
引用数:
0
h-index:
0
BERTONCI.PJ
;
DAS, G
论文数:
0
引用数:
0
h-index:
0
DAS, G
;
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(10)
:5112
-&
[3]
ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .6A. HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR GROUND STATES OF FIRST-ROW HYDRIDES AH
[J].
CADE, PE
论文数:
0
引用数:
0
h-index:
0
CADE, PE
;
HUO, WM
论文数:
0
引用数:
0
h-index:
0
HUO, WM
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(02)
:614
-&
[4]
STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .6. CHARGE-TRANSFER MECHANISM FOR NH3+HCL[--]NH4CL REACTION
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(07)
:2323
-&
[5]
STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .7. INNER AND OUTER COMPLEX IN NH4CL FORMATION FROM NH3 AND HCL
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
GAYLES, JN
论文数:
0
引用数:
0
h-index:
0
GAYLES, JN
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(10)
:3837
-&
[6]
STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .2. WAVEFUNCTIONS FOR NH3+HCL-]NH4CL REACTION
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
46
(10)
:3851
-&
[7]
LCAO-MO-SCF CALCULATIONS ON LIH USING GAUSSIAN BASIS SET
[J].
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
CSIZMADIA, IG
.
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(05)
:1849
-+
[8]
Origin of the dimerization energy of BH3 to B2H6
[J].
Gelus, M.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Gelus, M.
;
Ahlrichs, R.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Chicago, Dept Phys, Lab Mol Struct & Spectra, Chicago, IL 60637 USA
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Ahlrichs, R.
;
Staemmler, V.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Karlsruhe, Inst Phys Chem, Karlsruhe, Germany
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Staemmler, V.
;
Kutzelnigg, W.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Karlsruhe, Inst Phys Chem, Karlsruhe, Germany
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Kutzelnigg, W.
.
CHEMICAL PHYSICS LETTERS,
1970,
7
(05)
:503
-505
[9]
STABILITY OF GASEOUS AMMONIUM CHLORIDE MOLECULE
[J].
GOLDFINGER, P
论文数:
0
引用数:
0
h-index:
0
机构:
Laboratoire de Chimie Physique Moléculaire, Université Libre de Bruxelles, Brussels
GOLDFINGER, P
;
VERHAEGEN, G
论文数:
0
引用数:
0
h-index:
0
机构:
Laboratoire de Chimie Physique Moléculaire, Université Libre de Bruxelles, Brussels
VERHAEGEN, G
.
JOURNAL OF CHEMICAL PHYSICS,
1969,
50
(03)
:1467
-+
[10]
Kollman P.A., 1970, J AM CHEM SOC, V92, P1142, DOI [10.1021/ja00708a007, DOI 10.1021/JA00708A007]
←
1
2
3
→
共 23 条
[1]
AB INITIO CALCULATION OF HELIUM-HELIUM 1SIGMAG+ POTENTIAL AT INTERMEDIATE AND LARGE SEPARATIONS
[J].
BERTONCI.P
论文数:
0
引用数:
0
h-index:
0
BERTONCI.P
;
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
.
PHYSICAL REVIEW LETTERS,
1970,
25
(15)
:991
-&
[2]
THEORETICAL STUDY OF 1SIGMA+, 3SIGMA+, 3PI, 1PI STATES OF NALI AND 2SIGMA+ STATE OF NALI+
[J].
BERTONCI.PJ
论文数:
0
引用数:
0
h-index:
0
BERTONCI.PJ
;
DAS, G
论文数:
0
引用数:
0
h-index:
0
DAS, G
;
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(10)
:5112
-&
[3]
ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .6A. HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR GROUND STATES OF FIRST-ROW HYDRIDES AH
[J].
CADE, PE
论文数:
0
引用数:
0
h-index:
0
CADE, PE
;
HUO, WM
论文数:
0
引用数:
0
h-index:
0
HUO, WM
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(02)
:614
-&
[4]
STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .6. CHARGE-TRANSFER MECHANISM FOR NH3+HCL[--]NH4CL REACTION
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(07)
:2323
-&
[5]
STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .7. INNER AND OUTER COMPLEX IN NH4CL FORMATION FROM NH3 AND HCL
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
GAYLES, JN
论文数:
0
引用数:
0
h-index:
0
GAYLES, JN
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(10)
:3837
-&
[6]
STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .2. WAVEFUNCTIONS FOR NH3+HCL-]NH4CL REACTION
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
46
(10)
:3851
-&
[7]
LCAO-MO-SCF CALCULATIONS ON LIH USING GAUSSIAN BASIS SET
[J].
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
CSIZMADIA, IG
.
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(05)
:1849
-+
[8]
Origin of the dimerization energy of BH3 to B2H6
[J].
Gelus, M.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Gelus, M.
;
Ahlrichs, R.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Chicago, Dept Phys, Lab Mol Struct & Spectra, Chicago, IL 60637 USA
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Ahlrichs, R.
;
Staemmler, V.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Karlsruhe, Inst Phys Chem, Karlsruhe, Germany
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Staemmler, V.
;
Kutzelnigg, W.
论文数:
0
引用数:
0
h-index:
0
机构:
Univ Karlsruhe, Inst Phys Chem, Karlsruhe, Germany
Univ Grenoble, Lab Chim Gen, St Martin Dheres, France
Kutzelnigg, W.
.
CHEMICAL PHYSICS LETTERS,
1970,
7
(05)
:503
-505
[9]
STABILITY OF GASEOUS AMMONIUM CHLORIDE MOLECULE
[J].
GOLDFINGER, P
论文数:
0
引用数:
0
h-index:
0
机构:
Laboratoire de Chimie Physique Moléculaire, Université Libre de Bruxelles, Brussels
GOLDFINGER, P
;
VERHAEGEN, G
论文数:
0
引用数:
0
h-index:
0
机构:
Laboratoire de Chimie Physique Moléculaire, Université Libre de Bruxelles, Brussels
VERHAEGEN, G
.
JOURNAL OF CHEMICAL PHYSICS,
1969,
50
(03)
:1467
-+
[10]
Kollman P.A., 1970, J AM CHEM SOC, V92, P1142, DOI [10.1021/ja00708a007, DOI 10.1021/JA00708A007]
←
1
2
3
→