ABINITIO STUDY OF STRUCTURES AND BINDING-ENERGIES FOR ANION WATER COMPLEXES

被引：178

作者：

GAO, J ^{[1
]}

GARNER, DS ^{[1
]}

JORGENSEN, WL ^{[1
]}

机构：

[1] PURDUE UNIV, DEPT CHEM, W LAFAYETTE, IN 47907 USA

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1986年 / 108卷 / 16期

关键词：

D O I：

10.1021/ja00276a016

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：4784 / 4790

页数：7

共 57 条

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[4] HYDRATION OF HALIDE NEGATIVE IONS IN GAS PHASE .2. COMPARISON OF HYDRATION ENERGIES FOR ALKALI POSITIVE AND HALIDE NEGATIVE IONS
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[5] SCALE OF ACIDITIES IN THE GAS-PHASE FROM METHANOL TO PHENOL
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1979, 101 (20) : 6046 - 6056
[6] MOLECULAR-POTENTIAL, CATION BINDING, AND HYDRATION PROPERTIES OF THE CARBOXYLATE ANION - ABINITIO STUDIES WITH AN EXTENDED POLARIZED BASIS SET
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PULLMAN, A
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1981, 2 (01) : 87 - 95
[7] MOLLER-PLESSET THEORY FOR ATOMIC GROUND-STATE ENERGIES
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POPLE, JA
[J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1975, 9 (02) : 229 - 236
[8] BINKLEY JS, 1983, QCPE, V13
[9] Bowers M. T., 1979, GAS PHASE ION CHEM, V2
[10] Bowers MT, 1979, GAS PHASE ION CHEM, V1

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