PRELIMINARY RESULTS OF A SELF-CONSISTENT-FIELD STUDY OF BENZENE MOLECULE

被引：76

作者：

SCHULMAN, JM

MOSKOWITZ, JW

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1965年 / 43卷 / 09期

关键词：

D O I：

10.1063/1.1697302

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：3287 / +

页数：1

共 12 条

[1]

CSIZMADIA IG, 40 TECHN NOT COOP CO

[2]

CSIZMADIA IG, 36 TECHN NOT COOP CO

[3] AN EXTENDED HUCKEL THEORY .I. HYDROCARBONS [J].

HOFFMANN, R .

JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) :1397-&

[4] DETERMINATION OF ASSIGNMENT OF TRIPLET STATES IN CATACONDENSED AROMATIC HYDROCARBONS [J].

KEARNS, DR .

JOURNAL OF CHEMICAL PHYSICS, 1962, 36 (06) :1608-&

[5] ETHYLENE MOLECULE IN A GAUSSIAN BASIS .I. A SELF-CONSISTENT-FIELD CALCULATION [J].

MOSKOWIT.JW ;

HARRISON, MC .

JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (05) :1726-&

[6] PI ELECTRONIC STRUCTURE OF BENZENE MOLECULE [J].

MOSKOWITZ, JW ;

BARNETT, MP .

JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) :1557-&

[7] MOLECULAR ORBITAL CALCULATIONS OF THE LOWER EXCITED ELECTRONIC LEVELS OF BENZENE, CONFIGURATION INTERACTION INCLUDED [J].

PARR, RG ;

CRAIG, DP ;

ROSS, IG .

JOURNAL OF CHEMICAL PHYSICS, 1950, 18 (12) :1561-1563

[8]

PARR RG, 1963, QUANTUM THEORY MOLEC, P32

[9] NEW DEVELOPMENTS IN MOLECULAR ORBITAL THEORY [J].

ROOTHAAN, CCJ .

REVIEWS OF MODERN PHYSICS, 1951, 23 (02) :69-89

[10]

ROOTHAAN CCJ, 1950, NEW DEVELOPMENTS MOL

← 1 2 →