AB INITIO CALCULATION OF EPSILON 1SIGMAG AND ALPHA 3SIGMAG+ STATES OF HYDROGEN MOLECULE

被引:13
作者
GERHAUSER, J
TAYLOR, HS
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D O I
10.1063/1.1695768
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 ;
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页码:3621 / +
页数:1
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[1]   Wave functions and potential curves for excited H-2 [J].
Coolidge, AS ;
James, HM .
JOURNAL OF CHEMICAL PHYSICS, 1938, 6 (11) :730-734
[2]   FIRST EXCITED 1SIGMAG+ STATE OF HYDROGEN MOLECULE [J].
DAVIDSON, ER .
JOURNAL OF CHEMICAL PHYSICS, 1961, 35 (04) :1189-&
[3]   1ST EXCITED 1-SIGMA-G+ STATE OF H-2 - A DOUBLE-MINIMUM PROBLEM [J].
DAVIDSON, ER .
JOURNAL OF CHEMICAL PHYSICS, 1960, 33 (05) :1577-1577
[4]   THE MOLECULAR SPECTRUM OF HYDROGEN AND ITS ISOTOPES [J].
DIEKE, GH .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1958, 2 (05) :494-517
[5]   MOLECULAR ORBITAL STUDIES OF DIATOMIC MOLECULES .3. GROUND STATE OF HYDROGEN MOLECULE [J].
HARRIS, FE ;
TAYLOR, HS .
JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (11) :2591-&
[7]  
Herzberg G., 1966, ELECT SPECTRA ELECT
[8]   ONE-CENTER EXPANSION OF MOLECULAR WAVE FUNCTION .2. LOWER EXCITED STATES OF H-2 [J].
HUZINAGA, S .
PROGRESS OF THEORETICAL PHYSICS, 1957, 17 (02) :162-168
[9]   MOLECULAR ORBITAL DESCRIPTION OF LOWEST EXCITED 1SIGMAGPLUS STATE OF H2 [J].
KATO, Y ;
HAYES, EF ;
DUNCAN, ABF .
JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (04) :986-&
[10]   ACCURATE ELECTRONIC WAVE FUNCTIONS FOR THE H-2 MOLECULE [J].
KOLOS, W ;
ROOTHAAN, CCJ .
REVIEWS OF MODERN PHYSICS, 1960, 32 (02) :219-232