RANDOM TEMPERING OF GAUSSIAN-TYPE GEMINALS .1. ATOMIC SYSTEMS

被引：63

作者：

ALEXANDER, SA ^{[1
]}

MONKHORST, HJ ^{[1
]}

SZALEWICZ, K ^{[1
]}

机构：

[1] UNIV FLORIDA, DEPT CHEM, GAINESVILLE, FL 32611 USA

来源：

JOURNAL OF CHEMICAL PHYSICS | 1986年 / 85卷 / 10期

关键词：

D O I：

10.1063/1.451543

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：5821 / 5825

页数：5

共 32 条

[1] DIPOLE OSCILLATOR-STRENGTHS, WITH RIGOROUS LIMITS OF ERROR, FOR HE AND LI [J].

ANDERSON, MT ;

WEINHOLD, F .

PHYSICAL REVIEW A, 1974, 9 (01) :118-128

[2] THE INTEGRAL FORMULAE FOR THE VARIATIONAL SOLUTION OF THE MOLECULAR MANY-ELECTRON WAVE EQUATION IN TERMS OF GAUSSIAN FUNCTIONS WITH DIRECT ELECTRONIC CORRELATION [J].

BOYS, SF .

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1960, 258 (1294) :402-411

[3] MULTIPOLE STRUCTURE OF EXCHANGE DISPERSION ENERGY IN INTERACTION OF 2 HELIUM-ATOMS [J].

CHALASINSKI, G ;

JEZIORSKI, B ;

ANDZELM, J ;

SZALEWICZ, K .

MOLECULAR PHYSICS, 1977, 33 (04) :971-977

[4] LOGARITHMIC TERMS IN WAVE FUNCTIONS OF GROUND STATE OF 2-ELECTRON ATOMS [J].

FRANKOWSKI, K ;

PEKERIS, CL .

PHYSICAL REVIEW, 1966, 146 (01) :46-+

[5] VARIATIONAL CALCULATIONS ON THE HELIUM ISOELECTRONIC SEQUENCE [J].

FREUND, DE ;

HUXTABLE, BD ;

MORGAN, JD .

PHYSICAL REVIEW A, 1984, 29 (02) :980-982

[6] AN ACCURATE METHOD IN THE COULOMB 3-BODY PROBLEM AND MUONIC-MOLECULE EXCITED-STATES [J].

FROLOV, AM ;

EFROS, VD .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1985, 18 (10) :L265-L270

[7]

FROLOV AM, 1984, JETP LETT+, V39, P544

[8] HIGH-ACCURACY COMPTON PROFILE OF MOLECULAR-HYDROGEN FROM EXPLICITLY CORRELATED GAUSSIAN WAVE-FUNCTION [J].

JEZIORSKI, B ;

SZALEWICZ, K .

PHYSICAL REVIEW A, 1979, 19 (06) :2360-2365

[9] ATOMIC AND MOLECULAR CORRELATION ENERGIES WITH EXPLICITLY CORRELATED GAUSSIAN GEMINALS .3. COUPLED CLUSTER TREATMENT FOR HE, BE, H-2 AND LIH [J].

JEZIORSKI, B ;

MONKHORST, HJ ;

SZALEWICZ, K ;

ZABOLITZKY, JG .

JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (01) :368-388

[10] GAUSSIAN CORRELATION FUNCTIONS - 2-ELECTRON SYSTEMS [J].

LESTER, WA ;

KRAUSS, M .

JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (05) :1407-&

← 1 2 3 4 →