Ab initio effective core potentials including relativistic effects. I. Formalism and applications to the Xe and Au atoms

1977 ◽  
Vol 67 (12) ◽  
pp. 5861-5876 ◽  
Author(s):  
Yoon S. Lee ◽  
Walter C. Ermler ◽  
Kenneth S. Pitzer
Keyword(s):  
Ab Initio ◽  
Relativistic Effects ◽  
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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