Computing Binding Energies of Interstellar Molecules by Semiempirical Quantum Methods: Comparison Between DFT and GFN2 on Crystalline Ice

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Authors: Aurèle Germain; Marta Corno; Piero Ugliengo

Journal title: Computational Science and Its Applications – ICCSA 2021

Journal number: ICCSA2021

Journal publisher: Springer link

Published year: 2021

Published pages: 632-645

DOI identifier: 10.1007/978-3-030-86976-2_43

ISBN: 9783030869755