THEORY OF ORIGIN OF INTERNAL-ROTATION BARRIER IN ETHANE MOLECULE . I

被引:44
作者
WYATT, RE
PARR, RG
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D O I
10.1063/1.1701493
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 ;
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页码:S217 / +
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[1]   NOTE ON THE INTERNAL ROTATION PROBLEM [J].
CLINTON, WL .
JOURNAL OF CHEMICAL PHYSICS, 1960, 33 (02) :632-633
[2]   THE POTENTIAL CONSTANTS OF ETHANE [J].
HANSEN, GE ;
DENNISON, DM .
JOURNAL OF CHEMICAL PHYSICS, 1952, 20 (02) :313-326
[3]   AN EXTENDED HUCKEL THEORY .I. HYDROCARBONS [J].
HOFFMANN, R .
JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) :1397-&
[4]   AN APPROACH TO INTERNAL ROTATION PROBLEM [J].
KARPLUS, M ;
PARR, RG .
JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (07) :1547-&
[5]   Hindered rotation of the methyl groups in ethane [J].
Kemp, JD ;
Pitzer, KS .
JOURNAL OF CHEMICAL PHYSICS, 1936, 4 (11) :749-749
[6]   INTEGRAL HELLMANN-FEYNMAN THEOREM [J].
KIM, HJ ;
PARR, RG .
JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (09) :2892-+
[7]   ELECTRON DISTRIBUTIONS INVOLVED IN BARRIERS TO INTERNAL ROTATION [J].
KIRTMAN, B .
JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (10) :3262-&
[8]   MOLECULAR PARAMETERS OF ETHANE [J].
LAFFERTY, WJ ;
PLYLER, EK .
JOURNAL OF CHEMICAL PHYSICS, 1962, 37 (11) :2688-&
[9]   INTERNAL BARRIER IN ETHANE [J].
LIDE, DR .
JOURNAL OF CHEMICAL PHYSICS, 1958, 29 (06) :1426-1427
[10]   CALCULATION OF FIELD GRADIENT AT DEUTERON IN FORMALDEHYDE [J].
LOWE, JT ;
FLYGARE, WH .
JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (07) :2153-&