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Tomas Kamencek

Dipl.-Ing., BSc BSc

20182020

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Research Output

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Article
2020

Evaluating Computational Shortcuts in Supercell-Based Phonon Calculations of Molecular Crystals: The Instructive Case of Naphthalene

Kamencek, T., Wieser, S., Kojima, H., Bedoya-Martínez, N., Dürholt, J. P., Schmid, R. & Zojer, E., 14 Apr 2020, In : Journal of Chemical Theory and Computation. 16, 4, p. 2716-2735

Research output: Contribution to journalArticleResearchpeer-review

Open Access
2019

Understanding phonon properties in isoreticular metal-organic frameworks from first principles

Kamencek, T., Bedoya-Martínez, N. & Zojer, E., 11 Nov 2019, In : Physical Review Materials. 3, p. 116003

Research output: Contribution to journalArticleResearchpeer-review