NUMERICAL COMPARISON OF RANDOM-PHASE APPROXIMATIONS OF EXCITED-STATES OF DNA BASES USING CNDO-S METHOD

被引：8

作者：

ITO, H ^{[1
]}

IHAYA, YJ ^{[1
]}

机构：

[1] UNIV ELECTROCOMMUN, DEPT MAT SCI, CHOFU 182, TOKYO, JAPAN

来源：

CHEMICAL PHYSICS LETTERS | 1976年 / 38卷 / 02期

关键词：

D O I：

10.1016/0009-2614(76)85152-4

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：271 / 274

页数：4

共 22 条

[1] SEMI-EMPIRICAL PI-ELECTRON CALCULATIONS [J].

BAILEY, ML .

THEORETICA CHIMICA ACTA, 1969, 13 (01) :56-+

[2]

DEVOE H, 1962, J MOL BIOL, V4, P518

[3] NONEMPIRICAL CALCULATIONS ON EXCITED STATES - FORMALDEHYDE MOLECULE [J].

DUNNING, TH ;

MCKOY, V .

JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (11) :5263-&

[4] USE OF CNDO METHOD IN SPECTROSCOPY .6. FURTHER N-PI TRANSITIONS [J].

ELLIS, RL ;

JAFFE, HH ;

KUEHNLEN.G .

THEORETICA CHIMICA ACTA, 1972, 26 (02) :131-&

[5] STRETCHED-FILM SPECTRA AND TRANSITION MOMENTS OF NUCLEIC ACID BASES [J].

FUCALORO, AF ;

FORSTER, LS .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1971, 93 (24) :6443-&

[6] ASSIGNMENT OF N-] PI TRANSIITIONS IN POLYNUCLEOTIDES [J].

GELLERT, M .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1961, 83 (22) :4664-&

[7] COMPARATIVE STUDY OF RANDOM-PHASE APPROXIMATION, HARTREE-FOCK AND SINGLE EXCITED CONFIGURATION-INTERACTION METHODS OF COMPUTING EXCITATION PROPERTIES OF SOME MOLECULES [J].

HO, JC ;

SEGAL, GA ;

TAYLOR, HS .

JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (04) :1520-+

[8]

ITO H, UNPUBLISHED

[9] SELF-CONSISTENT TIME-DEPENDENT HARTREE-FOCK SCHEME [J].

JORGENSE.R ;

ODDERSHE.J ;

RATNER, M .

JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (02) :710-718

[10] ELECTRONIC STRUCTURE + SPECTRUM OF NITROBENZENE [J].

MATSUOKA, O ;

IHAYA, Y .

MOLECULAR PHYSICS, 1964, 8 (05) :455-&

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