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Computational studies of catalytic active site properties and reactions at the metal–oxide interface
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Korpelin, Ville, kirjoittaja
Published 2022
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Doctoral dissertation
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acid catalysis
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density functional theory
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happokatalyysi
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katalyysi
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katalyytit
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klusterit
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metalli–oksidi-rajapinnat
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metal–oxide interface
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molecular dynamics
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molekyylidynamiikka
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pelkistys
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reducibility
supported clusters
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tiheysfunktionaaliteoria
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