MNDO STUDY OF OZONE AND ITS DECOMPOSITION INTO (O2+O)

被引：46
作者：
DEWAR, MJS [1 ]
OLIVELLA, S [1 ]
RZEPA, HS [1 ]
机构：
[1] UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
来源：
CHEMICAL PHYSICS LETTERS | 1977年 / 47卷 / 01期
关键词：
D O I：
10.1016/0009-2614(77)85311-6
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
收藏
页码：80 / 84
页数：5
相关论文
共 37 条
[1]   GROUND-STATES OF MOLECULES .27. MINDO-3 CALCULATIONS FOR CHON SPECIES [J].
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[2]   GROUND-STATES OF MOLECULES .28. MINDO-3 CALCULATIONS FOR COMPOUNDS CONTAINING CARBON, HYDROGEN, FLUORINE, AND CHLORINE [J].
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LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1307-1311
[3]   GROUND-STATES OF MOLECULES .26. MINDO-3 CALCULATIONS FOR HYDROCARBONS [J].
BINGHAM, RC ;
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[4]   GROUND-STATES OF MOLECULES .25. MINDO-3 - IMPROVED VERSION OF MINDO SEMIEMPIRICAL SCF-MO METHOD [J].
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JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1285-1293
[5]   HE (I) AND HE (II) PHOTOELECTRON-SPECTRA OF OZONE [J].
BRUNDLE, CR .
CHEMICAL PHYSICS LETTERS, 1974, 26 (01) :25-28
[6]   UNSYMMETRICAL B-1(2) (PI-PI-STAR) STATE OF OZONE [J].
DEVAQUET, A ;
RYAN, J .
CHEMICAL PHYSICS LETTERS, 1973, 22 (02) :269-272
[7]   GROUND STATES OF CONJUGATED MOLECULES .9. HYDROCARBON RADICALS AND RADICAL IONS [J].
DEWAR, MJS ;
HASHMALL, JA ;
VENIER, CG .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (08) :1953-&
[8]   GROUND-STATES OF MOLECULES .30. MINDO-3 STUDY OF REACTIONS OF SINGLET (1-DELTA-G) OXYGEN WITH CARBON-CARBON DOUBLE-BONDS [J].
DEWAR, MJS ;
THIEL, W .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (14) :3978-3986
[9]  
DEWAR MJS, UNPUBLISHED WORK
[10]  
DEWAR MJS, TO BE PUBLISHED
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