ABINITIO CL STUDY OF THE ELECTRONIC-SPECTRUM OF THE ALLYL RADICAL (CH2-CH-CH2)

被引：47

作者：

HA, TK ^{[1
]}

BAUMANN, H ^{[1
]}

OTH, JFM ^{[1
]}

机构：

[1] SWISS FED INST TECHNOL,ORGAN CHEM LAB,CH-8092 ZURICH,SWITZERLAND

来源：

JOURNAL OF CHEMICAL PHYSICS | 1986年 / 85卷 / 03期

关键词：

D O I：

10.1063/1.451234

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：1438 / 1442

页数：5

共 25 条

[1] ELECTRONIC SPECTRA OF FREE ALLYL RADICAL AND SOME OF ITS SIMPLE DERIVATIVES
CALLEAR, AB
LEE, HK
[J]. TRANSACTIONS OF THE FARADAY SOCIETY, 1968, 64 (542P): : 308 - &
[2] ABINITIO CALCULATION OF SPIN-DENSITIES IN HYDROCARBON RADICALS
CHIPMAN, DM
[J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (02) : 761 - 768
[3] ELECTRONIC ABSORPTION SPECTRUM AND DISSOCIATION ENERGY OF ALLYL RADICAL
CURRIE, CL
RAMSAY, DA
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (02) : 488 - +
[4] KINETIC ISOTOPE EFFECT IN THE PARTIAL OXIDATION OF PROPYLENE OVER BI2O3
DRISCOLL, DJ
LUNSFORD, JH
[J]. JOURNAL OF PHYSICAL CHEMISTRY, 1983, 87 (02) : 301 - 303
[5] Dunning T., 1977, METHODS ELECT STRUCT, P1
[6] GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS
DUNNING, TH
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (07) : 2823 - +
[7] ELECTRON SPIN RESONANCE STUDIES OF TRANSIENT ALKYL RADICALS
FESSENDEN, RW
SCHULER, RH
[J]. JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (09) : 2147 - &
[8] FURTHER AB-INITIO CALCULATIONS ON ALLYL RADICAL
HINCHLIF.A
[J]. THEORETICA CHIMICA ACTA, 1972, 25 (02): : 138 - &
[9] DETECTION AND INVESTIGATION OF ALLYL AND BENZYL RADICALS BY PHOTOELECTRON-SPECTROSCOPY
HOULE, FA
BEAUCHAMP, JL
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (11) : 3290 - 3294
[10] OBSERVATION OF THE 3S 2A1 RYDBERG STATES OF ALLYL AND 2-METHYLALLYL RADICALS WITH MULTIPHOTON IONIZATION SPECTROSCOPY
HUDGENS, JW
DULCEY, CS
[J]. JOURNAL OF PHYSICAL CHEMISTRY, 1985, 89 (08) : 1505 - 1509

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