SEMIEMPIRICAL COMPUTATION OF ZERO-FIELD SPLITTINGS IN GROUND-STATE TRIPLET MOLECULES = NITRENOBENZENE AND 9-NITRENOANTHRACENE

被引：8

作者：

ALVARADO, R

GRIVET, JP

MIJOULE, C

机构：

[1] MUSEUM NATL HISTOIRE NAT,LAB BIOPHYS,75005 PARIS,FRANCE

[2] UNIV ORLEANS,DEPT PHYS,45045 ORLEANS,FRANCE

[3] ECOLE POLYTECH,LAB OPTIQUE & PHYS MOLEC,75230 PARIS,FRANCE

来源：

CHEMICAL PHYSICS LETTERS | 1975年 / 35卷 / 03期

关键词：

D O I：

10.1016/0009-2614(75)85630-2

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：403 / 406

页数：4

共 28 条

[1]

ALVARADO R, 1975, THESIS U PARIS 6

[2] PMDR STUDIES OF MAGNETIC AND DYNAMIC PROPERTIES OF LOWEST EXCITED TRIPLET-STATES OF AROMATIC CARBONYL MOLECULES - ACETOPHENONE, BENZALDEHYDE AND THEIR DERIVATIVES [J].

CHENG, TH ;

HIROTA, N .

MOLECULAR PHYSICS, 1974, 27 (02) :281-307

[3]

CHENG TH, 1974, MOL PHYS, V27, P309

[4]

CHENG TH, 1974, MOL PHYS, V27, P327

[5] ZERO-FIELD SPLITTINGS AND SPIN DENSITIES IN GROUND-STATE TRIPLET AROMATIC NITRENES [J].

COOPE, JAR ;

FARMER, JB ;

GARDNER, CL ;

MCDOWELL, CA .

JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (01) :54-&

[6]

DELBENE J, 1968, J CHEM PHYS, V48, P1807

[7] ZERO-FIELD SPLITTING 1- + 2-CENTER COULOMB-TYPE INTEGRALS [J].

GELLER, M ;

GRIFFITH, RW .

JOURNAL OF CHEMICAL PHYSICS, 1964, 40 (08) :2309-&

[8]

GINSBURG JL, 1968, MOL PHYS, V15, P442

[9]

GRIVET JP, 1971, 5TH INT M PHOT BORD

[10]

GRIVET JP, TO BE PUBLISHED

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