TRANSCORRELATED METHOD FOR ACCURATE CORRELATION ENERGIES USING GAUSSIAN-TYPE FUNCTIONS - EXAMPLES ON HE, H2, LIH AND H2O

被引：45

作者：

HANDY, NC

机构：

来源：

MOLECULAR PHYSICS | 1972年 / 23卷 / 01期

关键词：

D O I：

10.1080/00268977200100011

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：1 / &

共 14 条

[1] BENDER CF, 1971, J CHEM PHYS, V55, P1720
[2] DETERMINATION OF ENERGIES AND WAVEFUNCTIONS WITH FULL ELECTRONIC CORRELATION
BOYS, SF
HANDY, NC
[J]. PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1969, 310 (1500): : 43 - &
[3] SOME BILINEAR CONVERGENCE CHARACTERISTICS OF SOLUTIONS OF DISSYMMETRIC SECULAR EQUATIONS
BOYS, SF
[J]. PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1969, 309 (1497): : 195 - &
[4] A CONDITION TO REMOVE INDETERMINACY IN INTERELECTRONIC CORRELATION FUNCTIONS
BOYS, SF
HANDY, NC
[J]. PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1969, 309 (1497): : 209 - &
[5] A CALCULATION FOR ENERGIES AND WAVEFUNCTIONS FOR STATES OF NEON WITH FULL ELECTRONIC CORRELATION ACCURACY
BOYS, SF
HANDY, NC
[J]. PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1969, 310 (1500): : 63 - &
[6] A FIRST SOLUTION, FOR LIH, OF A MOLECULAR TRANSCORRELATED WAVE EQUATION BY MEANS OF RESTRICTED NUMERICAL INTEGRATION
BOYS, SF
HANDY, NC
[J]. PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1969, 311 (1505): : 309 - &
[7] BOYS SF, TO BE PUBLISHED
[8] ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .6A. HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR GROUND STATES OF FIRST-ROW HYDRIDES AH
CADE, PE
HUO, WM
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (02) : 614 - &
[9] DAVIDSON ER, 1967, J PHYS CHEM-US, V70, P2675
[10] A FLOATING SPHERICAL GAUSSIAN ORBITAL MODEL OF MOLECULAR STRUCTURE .3. FIRST-ROW ATOM HYDRIDES
FROST, AA
[J]. JOURNAL OF PHYSICAL CHEMISTRY, 1968, 72 (04) : 1289 - &

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