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Application of the method of functional integration to the theory of the heavy atom

✍ Scribed by G. K. Bidzhelova; V. N. Popov


Publisher
Springer US
Year
1986
Tongue
English
Weight
417 KB
Volume
34
Category
Article
ISSN
1573-8795

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Using the optimized effective potential method in conjunction with the semianalytical approximation due to Krieger, Li, and Iafrate, we performed fully selfconsistent exact exchange-only density functional calculations for diatomic molecules with a fully numerical basis-set-free molecular code. The