SPIN-DENSITY AND DENSITY MOMENTS FOR THE LITHIUM GROUND-STATE

被引：28

作者：

ESQUIVEL, RO ^{[1
]}

BUNGE, AV ^{[1
]}

NUNEZ, MA ^{[1
]}

机构：

[1] UNIV AUTONOMA METROPOLITANA AZCAPOTZALCO, DEPT MATEMAT, MEXICO CITY 09340, DF, MEXICO

来源：

PHYSICAL REVIEW A | 1991年 / 43卷 / 07期

关键词：

D O I：

10.1103/PhysRevA.43.3373

中图分类号：

O43 [光学];

学科分类号：

070207 ; 0803 ;

摘要：

Accurate analytical charge and spin-electron densities for the lithium atom are obtained by using a systematic and reliable method recently developed and applied to closed-shell atoms. The convergence of the densities is analyzed in terms of well-defined improvements in the corresponding configuration-interaction wave functions, and mathematical criteria are used to test the stability of the densities and their derivatives. Fully converged results for one-electron properties and, in particular, for the Fermi-contact interaction are reported.

引用

页码：3373 / 3383

页数：11

共 27 条

[11]

ESQUIVEL RO, 1988, THESIS U AUTONOMA ME

[12]

ESQUIVEL RO, UNPUB

[13] MANY-BODY CALCULATION OF HYPERFINE INTERACTION IN LOWEST S-2 AND P-2 STATES OF LI-LIKE SYSTEMS [J].

GARPMAN, S ;

LINDGREN, I ;

LINDGREN, J ;

MORRISON, J .

ZEITSCHRIFT FUR PHYSIK A-HADRONS AND NUCLEI, 1976, 276 (03) :167-177

[14]

HARRIMAN JE, 1978, THEORETICAL F ELECTR, P271

[15] SCHRODINGER INEQUALITIES AND ASYMPTOTIC-BEHAVIOR OF ELECTRON-DENSITY OF ATOMS AND MOLECULES [J].

HOFFMANNOSTENHOF, M ;

HOFFMANNOSTENHOF, T .

PHYSICAL REVIEW A, 1977, 16 (05) :1782-1785

[16] ON THE EIGENFUNCTIONS OF MANY-PARTICLE SYSTEMS IN QUANTUM MECHANICS [J].

KATO, T .

COMMUNICATIONS ON PURE AND APPLIED MATHEMATICS, 1957, 10 (02) :151-177

[17] CALCULATIONS ON THE S2 GROUND-STATES OF SOME MEMBERS OF THE LI-I ISOELECTRONIC SERIES [J].

KING, FW .

PHYSICAL REVIEW A, 1989, 40 (04) :1735-1747

[18] CALCULATIONS ON THE 2S GROUND-STATE OF THE LITHIUM ATOM [J].

KING, FW ;

SHOUP, V .

PHYSICAL REVIEW A, 1986, 33 (05) :2940-2948

[19] COMPACT EXPRESSIONS FOR THE RADIAL ELECTRONIC DENSITY-FUNCTIONS FOR THE 2S STATES OF 3-ELECTRON SYSTEMS [J].

KING, FW ;

DRESSEL, PR .

JOURNAL OF CHEMICAL PHYSICS, 1989, 90 (11) :6449-6462

[20] CALCULATIONS ON 2S GROUND STATE OF LITHIUM ATOM USING WAVE FUNCTIONS OF HYLLERAAS TYPE [J].

LARSSON, S .

PHYSICAL REVIEW, 1968, 169 (01) :49-&

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