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    Predicting exchange coupling in molecular systems with Density Functional Theory

    Predicting exchange coupling in molecular systems with Density Functional Theory by Toivola, Juho

    Published 2021
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    Master's thesis
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4033 Nanoscience Nanotiede computational chemistry density functional theory kvanttikemia laskennallinen kemia magneettiset ominaisuudet magnetic properties molecules molekyylit quantum chemistry tiheysfunktionaaliteoria

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