(PDF) An Assessment of Initial Guesses for Self-Consistent

An Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple Yet Efficient

Journal of Chemical Theory and Computation - United States

doi 10.1021/acs.jctc.8b01089

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Abstract

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Categories

Theoretical Chemistry

Computer Science Applications

Date

January 17, 2019

Authors

Publisher

American Chemical Society (ACS)

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