STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .8. ALL-ELECTRON SCF WAVEFUNCTIONS FOR PYRIDINE POSITIVE ION 2A2

被引：44

作者：

CLEMENTI, E

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1967年 / 47卷 / 11期

关键词：

D O I：

10.1063/1.1701657

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：4485 / &

共 18 条

[1] STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .3. PYRROLE GROUND-STATE WAVEFUNCTION [J].

CLEMENTI, E ;

CLEMENTI, H ;

DAVIS, DR .

JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (12) :4725-&

[2] ELECTRONIC STATES IN C4 MOLECULE [J].

CLEMENTI, E .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1961, 83 (22) :4501-&

[3]

CLEMENTI E, 1967, J CHEM PHYS, V46, P4737, DOI 10.1063/1.1840628

[4] SCF-MO WAVE FUNCTIONS FOR HYDROGEN FLUORIDE MOLECULE [J].

CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1962, 36 (01) :33-&

[5] APPROXIMATE RELATIVISTIC CORRECTION FOR 10-18 ELECTRONS IN ATOMS [J].

CLEMENTI, E .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1964, 12 (01) :18-&

[6] CORRELATION ENERGY FOR ATOMIC SYSTEMS [J].

CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (09) :2248-&

[7] CORRELATION ENERGY IN ATOMIC SYSTEMS .3. CONFIGURATIONS WITH 3D AND 4S ELECTRONS [J].

CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (08) :2783-&

[8] STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .4. ALL-ELECTRON SCF WAVEFUNCTION FOR GROUND STATE OF PYRIDINE [J].

CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (12) :4731-&

[9] GROUND-STATE WAVE FUNCTIONS FOR LINEAR MOLECULES [J].

CLEMENTI, E .

JOURNAL OF CHEMICAL PHYSICS, 1961, 34 (04) :1468-&

[10] BARRIER TO INTERNAL ROTATION IN ETHANE [J].

CLEMENTI, E ;

DAVIS, DR .

JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (07) :2593-+

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