Ab initio effective core potentials including relativistic effects. V. SCF calculations with ω–ω coupling including results for Au2+, TlH, PbS, and PbSe

1980 ◽  
Vol 73 (1) ◽  
pp. 360-366 ◽  
Author(s):  
Yoon S. Lee ◽  
Walter C. Ermler ◽  
Kenneth S. Pitzer
Keyword(s):  
Ab Initio ◽  
Relativistic Effects ◽  
Scf Calculations ◽  
Effective Core Potentials

scholarly journals Ab initio effective core potentials including relativistic effects. III. Ground state Au2 calculations

1979 ◽  
Vol 70 (1) ◽  
pp. 288 ◽  
Author(s):  
Yoon S. Lee ◽  
Walter C. Ermler ◽  
Kenneth S. Pitzer ◽  
A. D. McLean
Keyword(s):  
Ab Initio ◽  
Ground State ◽  
Relativistic Effects ◽  
Effective Core Potentials
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