SEMI EMPIRICAL CALCULATIONS OF SPIN DENSITY DISTRIBUTIONS IN SOME NITRO SUBSTITUTED CONJUGATED ANIONS

被引：16

作者：

HINCHLIFFE, A

机构：

来源：

THEORETICA CHIMICA ACTA | 1966年 / 5卷 / 05期

关键词：

D O I：

10.1007/BF00527050

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：451 / +

页数：1

共 9 条

[1]

ATHERTON NM, TO BE PUBLISHED

[2] SCF CALCULATION OF SPIN DENSITY DISTRIBUTIONS IN SOME NITRILE RADICAL ANIONS [J].

HINCHLIFFE, A ;

ALI, MA .

THEORETICA CHIMICA ACTA, 1966, 5 (03) :271-+

[3] OPEN SHELL SCF MO CI CALCULATION OF SPIN DENSITY DISTRIBUTIONS [J].

HINCHLIFFE, A .

THEORETICA CHIMICA ACTA, 1966, 5 (03) :208-+

[4]

HINCHLIFFE A, UNPUBLISHED WORK

[5] UNRESTRICTED HARTREE-FOCK METHOD [J].

MARSHALL, W .

PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON, 1961, 78 (503) :113-&

[6] ELECTRONIC STRUCTURE AND SPECTRUM OF NITROBENZENE [J].

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PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON, 1961, 78 (501) :460-&

[7] ANALYSIS OF ELECTRON SPIN RESONANCE SPECTRA OF AROMATIC NITROSUBSTITUTED ANION RADICALS [J].

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FRAENKEL, GK .

JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (03) :609-&

[8] UNRESTRICTED HARTREE-FOCK CALCULATIONS .2. SPIN PROPERTIES OF PI-ELECTRON RADICALS [J].

SNYDER, LC ;

AMOS, T .

JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (10) :3670-&

[9] SEMIEMPIRICAL SCF-LCAO-MO TREATMENT OF THIOPHENE FURAN AND PYRROLE [J].

SOLONY, N ;

BIRSS, FW ;

GREENSHI.JB .

CANADIAN JOURNAL OF CHEMISTRY, 1965, 43 (05) :1569-&

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