PCILO CONFORMATIONAL ENERGY CALCULATION OF MODEL POLYVINYL-CHLORIDE) MOLECULES

被引:8
作者
ALIG, I
LOCHMANN, R
WARTEWIG, S
机构
关键词
D O I
10.1002/pol.1984.180220612
中图分类号
O63 [高分子化学(高聚物)];
学科分类号
070305 ; 080501 ; 081704 ;
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页码:1097 / 1104
页数:8
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共 40 条
[1]   CONFORMATIONAL ENERGIES OF N-ALKANES AND RANDOM CONFIGURATION OF HIGHER HOMOLOGS INCLUDING POLYMETHYLENE [J].
ABE, A ;
JERNIGAN, RL ;
FLORY, PJ .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1966, 88 (04) :631-&
[2]   NMR SPECTRA OF MODEL COMPOUNDS OF POLY(VINYL CHLORIDE) [J].
ABE, Y ;
TASUMI, M ;
SHIMANOU.T ;
SATOH, S ;
CHUJO, R .
JOURNAL OF POLYMER SCIENCE PART A-1-POLYMER CHEMISTRY, 1966, 4 (6PA1) :1413-&
[3]  
Alig I., UNPUB
[4]  
Bogel H., 1980, ACTA POLYM, V31, P248
[5]   CONFORMATIONAL PROPERTIES OF POLAR POLYMERS .1. POLYVINYL-CHLORIDE) [J].
BOYD, RH ;
KESNER, L .
JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS, 1981, 19 (03) :375-391
[6]   CONFORMATIONAL PROPERTIES OF POLAR POLYMERS .2. POLY(VINYLIDENE CHLORIDE) [J].
BOYD, RH ;
KESNER, L .
JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS, 1981, 19 (03) :393-403
[7]   SELF-CONSISTENT FIELD CONFORMATIONAL ENERGY CALCULATIONS FOR NORMAL-ALKANES AND CHARACTERIZATIONS OF POLYMETHYLENE [J].
DARSEY, JA ;
RAO, BK .
MACROMOLECULES, 1981, 14 (05) :1575-1581
[8]   LOCALIZED BOND ORBITALS AND CORRELATION PROBLEM .I. PERTURBATION CALCULATION OF GROUND STATE ENERGY [J].
DINER, S ;
MALRIEU, JP ;
CLAVERIE, P .
THEORETICA CHIMICA ACTA, 1969, 13 (01) :1-&
[9]   Fully localized bond orbitals and the correlation problem [J].
Diner, S. ;
Malrieu, J. P. ;
Claverie, P. ;
Jordan, F. .
CHEMICAL PHYSICS LETTERS, 1968, 2 (05) :319-323
[10]   LOCALIZED BOND ORBITALS AND CORRELATION PROBLEM .3. ENERGY UP TO THIRD-ORDER IN ZERO-DIFFERENTIAL OVERLAP APPROXIMATION . APPLICATION TO SIGMA-ELECTRON SYSTEMS [J].
DINER, S ;
MALRIEU, JP ;
JORDAN, F ;
GILBERT, M .
THEORETICA CHIMICA ACTA, 1969, 15 (02) :100-&