GROUND STATES OF CONJUGATED MOLECULES .16. TREATMENT OF HYDROCARBONS BY L.C.A.O. S.C.F. M.O.

被引:126
作者
DEWAR, MJS
HARGET, AJ
机构
来源
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES | 1970年 / 315卷 / 1523期
关键词
D O I
10.1098/rspa.1970.0054
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 [理学]; 0710 [生物学]; 09 [农学];
摘要
引用
收藏
页码:443 / &
相关论文
共 25 条
[1]
AN ELECTRON DIFFRACTION REINVESTIGATION OF THE MOLECULAR STRUCTURE OF 1,3-BUTADIENE [J].
ALMENNINGEN, A ;
BASTIANSEN, O ;
TRAETTEBERG, M .
ACTA CHEMICA SCANDINAVICA, 1958, 12 (06) :1221-1225
[2]
THERMODYNAMIC PROPERTIES OF GASEOUS 1,3-BUTADIENE AND THE NORMAL BUTENES ABOVE 25-DEGREES C - EQUILIBRIA IN THE SYSTEM 1,3-BUTADIENE, N-BUTENES, AND N-BUTANE [J].
ASTON, JG ;
SZASZ, G ;
WOOLLEY, HW ;
BRICKWEDDE, FG .
JOURNAL OF CHEMICAL PHYSICS, 1946, 14 (02) :67-79
[3]
ON THE EFFECTS OF INTRAMOLECULAR VANDERWAALS FORCES [J].
BARTELL, LS .
JOURNAL OF CHEMICAL PHYSICS, 1960, 32 (03) :827-831
[4]
GROUND STATES OF CONJUGATED MOLECULES .I. SEMIEMPIRICAL SCF MO TREATMENT AND ITS APPLICATION TO AROMATIC HYDROCARBONS [J].
CHUNG, ALH ;
DEWAR, MJS .
JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (02) :756-&
[5]
ASYMMETRIC ANNELLATION EFFECTS .2. [J].
CLAR, E .
TETRAHEDRON, 1959, 6 (04) :355-357
[6]
ASYMMETRIC ANNELLATION EFFECTS [J].
CLAR, E .
TETRAHEDRON, 1959, 5 (01) :98-98
[7]
COULSON CA, 1949, PHILOS MAG, V40, P26
[8]
THE PLANAR VIBRATIONS OF BENZENE [J].
CRAWFORD, BL ;
MILLER, FA .
JOURNAL OF CHEMICAL PHYSICS, 1949, 17 (03) :249-256
[9]
GROUND STATES OF CONJUGATED MOLECULES .15. BOND LOCALIZATION AND RESONANCE ENERGIES IN COMPOUNDS CONTAINING NITROGEN OR OXYGEN [J].
DEWAR, MJS ;
HARGET, AJ ;
TRINAJSTIC, N .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1969, 91 (23) :6321-+
[10]
GROUND STATES OF CONJUGATED MOLECULES .12. IMPROVED CALCULATIONS FOR COMPOUNDS CONTAINING NITROGEN OR OXYGEN [J].
DEWAR, MJS ;
MORITA, T .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1969, 91 (04) :796-&