COUPLED CLUSTER AND MBPT STUDY OF NICKEL STATES

被引：16

作者：

SALTER, EA

ADAMOWICZ, L

BARTLETT, RJ

机构：

来源：

CHEMICAL PHYSICS LETTERS | 1985年 / 122卷 / 1-2期

关键词：

D O I：

10.1016/0009-2614(85)85471-3

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：23 / 28

页数：6

共 21 条

[1] ATOMIC CENTRAL-FIELD MODELS FOR OPEN SHELLS WITH APPLICATION TO TRANSITION-METALS [J].

ABDULNUR, SF ;

THULSTRUP, PW ;

LINDERBERG, J ;

OHRN, U .

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

[2] TOWARDS NUMERICAL-SOLUTIONS OF THE SCHRODINGER-EQUATION FOR DIATOMIC-MOLECULES [J].

ADAMOWICZ, L ;

BARTLETT, RJ ;

MCCULLOUGH, EA .

PHYSICAL REVIEW LETTERS, 1985, 54 (05) :426-429

[3]

ADAMOWICZ L, 1985, P NOBEL LAUREATE S A

[4] MANY-BODY PERTURBATION-THEORY AND COUPLED CLUSTER THEORY FOR ELECTRON CORRELATION IN MOLECULES [J].

BARTLETT, RJ .

ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1981, 32 :359-401

[5]

BARTLETT RJ, 1983, CHEM PHYS LETT, V98, P66, DOI 10.1016/0009-2614(83)80204-8

[6]

BARTLETT RJ, 1978, INT J QUANTUM CHEM, V14, P56

[7]

Clementi E., 1965, TABLES ATOMIC FUNCTI

[8] A SYSTEMATIC STUDY OF THE EFFECT OF TRIPLE SUBSTITUTIONS ON THE ELECTRON CORRELATION-ENERGY OF SMALL MOLECULES [J].

FRISCH, MJ ;

KRISHNAN, R ;

POPLE, JA .

CHEMICAL PHYSICS LETTERS, 1980, 75 (01) :66-68

[9] CORRELATION ENERGY OF OPEN-SHELL SYSTEMS - APPLICATION OF THE MANY-BODY RAYLEIGH-SCHRODINGER PERTURBATION-THEORY IN THE RESTRICTED ROOTHAAN-HARTREE-FOCK FORMALISM [J].

HUBAC, I ;

CARSKY, P .

PHYSICAL REVIEW A, 1980, 22 (06) :2392-2399

[10] A MULTI-REFERENCE COUPLED-CLUSTER METHOD FOR MOLECULAR APPLICATIONS [J].

LAIDIG, WD ;

BARTLETT, RJ .

CHEMICAL PHYSICS LETTERS, 1984, 104 (05) :424-430

← 1 2 3 →