ABINITIO EFFECTIVE VALENCE HAMILTONIAN DESCRIPTION OF ELECTRON CORRELATION FOR THE NEUTRAL AND ION VALENCE STATES OF TRANSITION-METAL ATOMS

被引：32

作者：

LEE, YS ^{[1
]}

SUN, H ^{[1
]}

SHEPPARD, MG ^{[1
]}

FREED, KF ^{[1
]}

机构：

[1] UNIV CHICAGO,DEPT CHEM,CHICAGO,IL 60637

来源：

JOURNAL OF CHEMICAL PHYSICS | 1980年 / 73卷 / 03期

关键词：

D O I：

10.1063/1.440223

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：1472 / 1474

页数：3

共 16 条

[1]

BASHKIN S, 1978, ATOMIC ENERGY LEVELS

[2] LINKED-CLUSTER EXPANSIONS FOR NUCLEAR MANY-BODY PROBLEM [J].

BRANDOW, BH .

REVIEWS OF MODERN PHYSICS, 1967, 39 (04) :771-&

[3]

Clementi E., 1974, Atomic Data and Nuclear Data Tables, V14, P177, DOI 10.1016/S0092-640X(74)80016-1

[4]

Dunning Jr T. H, J CHEM PHYS

[5]

DUNNING TH, COMMUNICATION

[6]

Froese-Fischer C., 1977, J PHYS B ATOM MOL PH, V10, P1241

[7]

GERSHGORN Z, 1968, INT J QUANTUM CHEM, V2, P251

[8] PERTURBATION CALCULATION OF ATOMIC CORRELATION ENERGIES FOR THE 1ST TRANSITION PERIOD [J].

GUSE, M ;

OSTLUND, NS ;

BLYHOLDER, GD .

CHEMICAL PHYSICS LETTERS, 1979, 61 (03) :526-531

[9] CORRECTION [J].

IWATA, S .

JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (04) :1765-1765

[10] NONCLASSICAL TERMS IN TRUE EFFECTIVE VALENCE SHELL HAMILTONIAN - 2ND QUANTIZED FORMALISM [J].

IWATA, S ;

FREED, KF .

JOURNAL OF CHEMICAL PHYSICS, 1976, 65 (03) :1071-1088

← 1 2 →