AN ABINITIO CALCULATION ON PROTON-TRANSFER IN THE BENZOIC-ACID DIMER

被引：60

作者：

NAGAOKA, SI ^{[1
]}

HIROTA, N ^{[1
]}

MATSUSHITA, T ^{[1
]}

NISHIMOTO, K ^{[1
]}

机构：

[1] OSAKA CITY UNIV,FAC SCI,DEPT CHEM,OSAKA 558,JAPAN

来源：

CHEMICAL PHYSICS LETTERS | 1982年 / 92卷 / 05期

关键词：

D O I：

10.1016/0009-2614(82)87048-6

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

页码：498 / 502

页数：5

共 23 条

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[2] HOW RELIABLE ARE CALCULATIONS ON PROTON TUNNELING
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[3] AN INFRA-RED STUDY OF ASSOCIATION OF BENZOIC ACID IN VAPOUR PHASE AND IN DILUTE SOLUTION IN NON-POLAR SOLVENTS
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[4] A REFINEMENT OF THE BENZOIC-ACID STRUCTURE AT ROOM-TEMPERATURE
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[J]. ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1980, 36 (JUL): : 1711 - 1712
[5] HEAT OF DIMERIZATION OF SOME CARBOXYLIC ACIDS IN VAPOUR PHASE DETERMINED BY A SPECTROSCOPIC METHOD
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[6] STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .12. HYDROGEN BRIDGES IN GUANINE-CYTOSINE PAIR AND IN DIMERIC FORM OF FORMIC ACID
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) : 508 - &
[7] MOLECULAR-ORBITAL THEORY OF HYDROGEN-BOND .15. RING-CLOSURE AND PROTON-TRANSFER IN FORMIC-ACID DIMER AND BETA-HYDROXYACROLEIN
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (08) : 2041 - 2046
[8] REINVESTIGATION OF MOLECULAR STRUCTURE OF ACETIC ACID MONOMER AND DIMER BY GAS ELECTRON DIFFRACTION
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[J]. JOURNAL OF MOLECULAR STRUCTURE, 1971, 7 (1-2) : 67 - &
[9] THE CRYSTAL-STRUCTURE OF BENZOIC-ACID - A REDETERMINATION WITH X-RAYS AT ROOM-TEMPERATURE - A SUMMARY OF NEUTRON-DIFFRACTION WORK AT TEMPERATURES DOWN TO 5K
FELD, R
LEHMANN, MS
MUIR, KW
SPEAKMAN, JC
[J]. ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1981, 157 (3-4): : 215 - 231
[10] DYNAMICS OF HYDROGEN-BOND EXCHANGE IN CARBOXYLIC-ACID DIMERS
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MEYER, R
HA, TK
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (06) : 2914 - 2918

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