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Frontiers in Sleep|December 22, 2025
AuReTim: an inexpensive and extensible open-source auditory psychomotor vigilance testTorsten Straßer, Inga Rothert, Thomas Heine, et al.The Journal of Chemical Physics|August 20, 2014
Hydrogen adsorption in metal-organic frameworks: the role of nuclear quantum effectsMohammad Wahiduzzaman, Christian F J Walther, Thomas HeineNanoscale|July 7, 2022
The structural and electronic richness of buckled honeycomb AsP bilayersJessica Arcudia, Birkan Emrem, Thomas Heine, et al.The Enzymes|September 21, 2020
Styrene monooxygenases, indole monooxygenases and related flavoproteins applied in bioremediation and biocatalysisDirk Tischler, Antje Kumpf, Daniel Eggerichs, et al.The Journal of Physical Chemistry. A|May 26, 2021
Strong Binding of Noble Gases to [B12X11]-: A Theoretical StudyKevin Wöhner, Toshiki Wulf, Nina Vankova, et al.Advanced Science (Weinheim, Baden-Wurttemberg, Germany)|December 3, 2023
Rational Molecular Design of Redox-Active Carbonyl-Bridged Heterotriangulenes for High-Performance Lithium-Ion BatteriesXipeng Shu, Liang Hu, Thomas Heine, et al.The Journal of Chemical Physics|April 7, 2007
Car-Parrinello treatment for an approximate density-functional theory methodMathias Rapacioli, Robert Barthel, Thomas Heine, et al.The Journal of Physical Chemistry. A|September 11, 2014
AuToGraFS: automatic topological generator for framework structuresMatthew A Addicoat, Damien E Coupry, Thomas HeinePhysical Review Letters|April 1, 2014
Stabilization mechanism of ZnO nanoparticles by Fe dopingJianping Xiao, Agnieszka Kuc, Thomas Frauenheim, et al.The Journal of Chemical Physics|November 4, 2017
Explicit treatment of hydrogen bonds in the universal force field: Validation and application for metal-organic frameworks, hydrates, and host-guest complexesDamien E Coupry, Matthew A Addicoat, Thomas HeinePageof 61