BOND-FUNCTION ANALYSIS OF ROTATIONAL BARRIERS - ETHANE

被引：187

作者：

SOVERS, OJ

KERN, CW

PITZER, RM

KARPLUS, M

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1968年 / 49卷 / 06期

关键词：

D O I：

10.1063/1.1670458

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

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页码：2592 / &

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共 33 条

[1] FREE-ELECTRON TREATMENT OF BARRIER TO INTERNAL ROTATION IN ETHANE
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (07) : 2423 - &
[2] LOCALIZED ATOMIC AND MOLECULAR ORBITALS
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[3] INTEGRATED AND INTEGRAL HELLMANN-FEYNMAN FORMULAS
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PARR, RG
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (04) : 1275 - &
[4] ORIGIN OF ROTATIONAL BARRIERS .2. METHYLAMINE AND IMPROVED WAVEFUNCTIONS FOR HYDROGEN PEROXIDE
FINK, WH
ALLEN, LC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (06) : 2276 - &
[5] NUMERICAL TEST OF INTEGRAL HELLMANN-FEYNMAN THEOREM
FINK, WH
ALLEN, LC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (08) : 3270 - &
[6] ORIGIN OF ROTATIONAL BARRIERS .I. MANY-ELECTRON MOLECULAR ORBITAL WAVEFUNCTIONS FOR ETHANE METHYL ALCOHOL AND HYDROGEN PEROXIDE
FINK, WH
ALLEN, LC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (06) : 2261 - &
[7] CALCULATION OF BARRIER TO INTERNAL ROTATION OF ETHANE
GOODISMAN, J
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (05) : 2085 - +
[8] POSTSCRIPT TO BARRIER TO INTERNAL ROTATION IN ETHANE BY HELLMANN-FEYNMAN THEOREM
GOODISMAN, J
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (01) : 334 - +
[9] BARRIER TO INTERNAL ROTATION IN ETHANE USING HELLMAN-FEYNMAN THEOREM
GOODISMAN, J
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (12) : 4689 - +
[10] Barriers to internal rotation in propane
Hoyland, James R.
[J]. CHEMICAL PHYSICS LETTERS, 1967, 1 (06) : 247 - 248

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