COMPARISON OF 2 STATISTICAL APPROACHES TO CALCULATE ATOMIC AND MOLECULAR-ORBITALS

被引：21

作者：

JORGENSEN, P

OHRN, Y

机构：

[1] UNIV FLORIDA, DEPT CHEM, QUANTUM THEORY PROJECT, GAINESVILLE, FL 32601 USA

[2] UNIV FLORIDA, DEPT PHYS, QUANTUM THEORY PROJECT, GAINESVILLE, FL 32601 USA

来源：

PHYSICAL REVIEW A | 1973年 / 8卷 / 01期

关键词：

D O I：

10.1103/PhysRevA.8.112

中图分类号：

O43 [光学];

学科分类号：

070207 ; 0803 ;

摘要：

引用

页码：112 / 119

页数：8

共 25 条

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LINDERBERG, J ;

OHRN, U .

PHYSICAL REVIEW A-GENERAL PHYSICS, 1972, 6 (03) :889-+

[2]

BEEBE NHF, TO BE PUBLISHED

[3] LOCAL EXCHANGE APPROXIMATION AND VIRIAL THEOREM [J].

BERRONDO, M ;

GOSCINSKI, O .

PHYSICAL REVIEW, 1969, 184 (01) :10-+

[4] TOTAL ENERGY IN MULTIPLE-SCATTERING FORMALISM - APPLICATION TO WATER MOLECULE [J].

CONNOLLY, JW ;

SABIN, JR .

JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (11) :5529-&

[5]

CONNOLLY JWD, UNPUBLISHED

[6]

CONNOLLY JWD, PRIVATE COMMUNICATIO

[7] POLARIZATION CORRECTIONS TO CORE LEVELS [J].

HEDIN, L ;

JOHANSSO.A .

JOURNAL OF PHYSICS PART B ATOMIC AND MOLECULAR PHYSICS, 1969, 2 (12) :1336-&

[8]

HEDIN L, 1972, J PHYS-PARIS, V33, P73

[9]

HOWELL JM, TO BE PUBLISHED

[10] TRIPLET - TRIPLET ABSORPTION SPECTRA OF ALTERNANT HYDROCARBONS WITHIN GRAND CANONICAL TIME-DEPENDENT HARTREE-FOCK APPROXIMATION [J].

JORGENSEN, P ;

OHRN, Y .

CHEMICAL PHYSICS LETTERS, 1973, 18 (02) :261-267

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