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5 Results for Persons = "Kühne, Thomas D."
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Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations
Laß, Michael ; Plessl, Christian ; Kühne, Thomas D. ; Hellebrand, Sybille ; Platzner, Marco ; Meyer auf der Heide, Friedhelm
Elektronische Ressource, Paderborn, 2022
Impact of hydrophobicity and confinement on the structure and dynamics of water at interfaces
Zysk, Frederik Maria ; Kühne, Thomas D. ; Bauer, Matthias
Elektronische Ressource, Paderborn, 2023
Implementing Meta-GGA functionals in PAW formalism and applications in molecular and nanoscale thin-film systems
Tamoev, Konstantin ; Kühne, Thomas D. ; Brehm, Martin
Elektronische Ressource, Paderborn, 2024
Quantum mechanical investigations of adsorbate interactions inside nanopores of 2D poly(heptazine imide) salts and a novel approach for calculating transport coefficients
Heske, Julian Joachim ; Kühne, Thomas D. ; Antonietti, Markus
Elektronische Ressource, Paderborn, 2022
Synthesis and characterization of multichromophoric iron(II) complexes as novel photosensitizers
Dierks, Philipp ; Bauer, Matthias ; Egold, Hans ; Kühne, Thomas D. ; Werner, Thomas
Elektronische Ressource, Paderborn, 2022