CNDO-MO-SCF-CI STUDY ON PHOTOELECTRON AND ELECTRONIC-SPECTRA OF MOLECULES - SOME UNSATURATED-HYDROCARBONS

被引：15

作者：

KOBAYASHI, T ^{[1
]}

机构：

[1] UNIV TOKYO,INST SOLID STATE PHYS,TOKYO 113,JAPAN

来源：

JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA | 1976年 / 9卷 / 05期

关键词：

D O I：

10.1016/0368-2048(76)80056-4

中图分类号：

O433 [光谱学];

学科分类号：

0703 ; 070302 ;

摘要：

引用

页码：381 / 390

页数：10

共 26 条

[1] CNDO-2 CALCULATIONS OF IONIZATION-POTENTIALS AND ELECTRONIC-SPECTRA OF SOME UNSATURATED-HYDROCARBONS
HAYASHI, T
NAKAJIMA, T
BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1975, 48 (03) : 980 - 984
[2] CNDO-CI STUDY OF ELECTRONIC-SPECTRA OF CYCLOPROPANE, METHYLENCYCLOPROPANE, DIMETHYLENCYCLOPROPANE AND TRIMETHYLENCYCLOPROPANE
SIEIRO, C
PONCE, C
ANALES DE QUIMICA, 1976, 72 (03): : 201 - 205
[3] AB-INITIO SCF-CI STUDY OF ELECTRONIC-SPECTRA OF NITROETHYLENE
HA, TK
MOLECULAR PHYSICS, 1974, 27 (03) : 753 - 761
[4] ELECTRONIC STRUCTURE AND SPECTRA OF ORGANIC MOLECULES .10. SCF MO CI CALCULATIONS FOR HYDROXY DERIVATIVE ANIONS OF SOME AROMATIC MOLECULES
BERNDT, M
KWIATKOW.JS
THEORETICA CHIMICA ACTA, 1970, 17 (01): : 35 - &
[5] MO INVESTIGATIONS ON LIGNIN MODEL COMPOUNDS .10. CNDO-CI CALCULATIONS OF ELECTRONIC-SPECTRA OF SOME EXTENDED QUINONE METHIDE STRUCTURES
REMKO, M
POLCIN, J
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-FRANKFURT, 1978, 110 (02): : 229 - 235
[6] THEORETICAL-STUDY OF MANY-BODY EFFECTS IN THE PHOTOELECTRON-SPECTRA OF UNSATURATED-HYDROCARBONS
LISINI, A
FRONZONI, G
DECLEVA, P
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1994, 52 (02) : 527 - 548
[7] THEORETICAL-STUDY OF ELECTRONIC-SPECTRA OF HYDROGEN MALEATE ION BY CNDO-S CI METHOD
LATAJKA, Z
RATAJCZAK, H
CHEMICAL PHYSICS LETTERS, 1977, 49 (03) : 407 - 409
[8] LCAO MO INVESTIGATIONS ON LIGNIN MODEL COMPOUNDS .6. CNDO-CI CALCULATIONS OF ELECTRONIC-SPECTRA OF CINNAMALDEHYDE STRUCTURES
REMKO, M
POLCIN, J
ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES, 1978, 33 (01): : 59 - 65
[9] LCAO MO INVESTIGATIONS ON LIGNIN MODEL COMPOUNDS .4. CNDO-CI CALCULATIONS OF ELECTRONIC-SPECTRA OF OXYBENZALDEHYDE TYPE MODELS
REMKO, M
POLCIN, J
CHEMICKE ZVESTI, 1977, 31 (02): : 171 - 179
[10] PHOTOELECTRON-SPECTRA OF DITHIASPIROCYCLOBUTANE MOLECULES - ELECTRONIC-SPECTRA OF THEIR RUTHENIUM COMPLEXES AND EVIDENCE FROM CNDO/2 CALCULATIONS FOR A HYPERCONJUGATING ELECTRON-TRANSFER MECHANISM
STEIN, CA
LEWIS, NA
SEITZ, G
BAKER, AD
INORGANIC CHEMISTRY, 1983, 22 (07) : 1124 - 1128

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