GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.

被引:5814
作者
HUZINAGA, S
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10.1063/1.1696113
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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:1293 / &
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共 19 条
[1]  
BOYS SF, 1960, P ROY SOC LONDON, VA254, P487
[2]  
BOYS SF, 1950, P ROY SOC LONDON, VA200, P542
[3]  
BUCKINGHAM RA, 1957, NUMERICAL METHODS
[4]   ACCURAT ANALYTICAL SELF-CONSISTENT FIELD FUNCTIONS FOR ATOMS .2. LOWEST CONFIGURATIONS OF NEUTRAL FIRST ROW ATOMS [J].
CLEMENTI, E ;
YOSHIMINE, M ;
ROOTHAAN, CC .
PHYSICAL REVIEW, 1962, 127 (05) :1618-&
[6]   GAUSSIAN WAVEFUNCTIONS FOR 10-ELECTRON SYSTEMS .2. HYDROGEN FLUORIDE [J].
HARRISON, MC .
JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (02) :499-&
[7]  
HYLLERASS EA, 1949, Z PHYSIK, V54, P347
[8]   HARTREE-FOCK APPROXIMATION OF CH4 AND NH4+ [J].
KRAUSS, M .
JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (02) :564-&
[9]  
LONGSTAFF JVL, 1960, P ROY SOC LONDON, VA258, P421
[10]   LCAO-MO-SCF GROUND STATE CALCULATIONS ON C2H2 AND CO2 [J].
MCLEAN, AD .
JOURNAL OF CHEMICAL PHYSICS, 1960, 32 (05) :1595-1597