Predicting the properties of NiO with density functional theory: Impact of exchange and correlation approximations and validation of the r2SCAN functional
DelloStritto, Mark J., Kaplan, Aaron D., Perdew, John P., Klein, Michael L.
Published in APL materials (01.06.2023)
Published in APL materials (01.06.2023)
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Journal Article
Vibrational Density of States of Strongly H‑Bonded Interfacial Water: Insights from Inelastic Neutron Scattering and Theory
Wang, Hsiu-Wen, DelloStritto, Mark J., Kumar, Nitin, Kolesnikov, Alexander I., Kent, Paul R. C., Kubicki, James D., Wesolowski, David J., Sofo, Jorge O.
Published in Journal of physical chemistry. C (22.05.2014)
Published in Journal of physical chemistry. C (22.05.2014)
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Journal Article
Probing the Gold/Water Interface with Surface-Specific Spectroscopy
Piontek, Stefan M., Naujoks, Dennis, Tabassum, Tadneem, DelloStritto, Mark J., Jaugstetter, Maximilian, Hosseini, Pouya, Corva, Manuel, Ludwig, Alfred, Tschulik, Kristina, Klein, Michael L., Petersen, Poul B.
Published in ACS Physical Chemistry Au (25.01.2023)
Published in ACS Physical Chemistry Au (25.01.2023)
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Journal Article
Shear response in crystalline models of poly(p-phenylene terephthalamide)
Fiorin, Giacomo, DelloStritto, Mark J., Percec, Simona, Klein, Michael L.
Published in Molecular physics (18.10.2021)
Published in Molecular physics (18.10.2021)
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Journal Article
Vibrational density of states of strongly H-bonded interfacial water: insights from inelastic neutron scattering and theory
Wang, Hsiu-Wen, Dellostritto, Mark J, Kumar, Nitin, Kolesnikov, Alexander I, Kent, Paul R, Kubicki, James D., Wesolowski, David J, Sofo, Jorge O.
Published in Journal of physical chemistry. C (01.01.2014)
Published in Journal of physical chemistry. C (01.01.2014)
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Journal Article