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5. Effect of Complex-Valued Optimal Orbitals on Atomization Energies with the Perdew-Zunger Self-Interaction Correction to Density Functional Theory. Lehtola S; Jónsson EÖ; Jónsson H J Chem Theory Comput; 2016 Sep; 12(9):4296-302. PubMed ID: 27467900 [TBL] [Abstract][Full Text] [Related]
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