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Atom-Centered Potentials with Dispersion-Corrected Minimal Basis Set Hartree-Fock: An Efficient and Accurate Computational Approach for Large Molecular Systems.

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Description scientific article published on 20 December 2017
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author: Viki Kumar Prasad  Alberto Otero-de-la-Roza  Gino A DiLabio 

Publication date January 16, 2018
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