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Nature Communications|September 5, 2020
Identifying domains of applicability of machine learning models for materials scienceChristopher Sutton, Mario Boley, Luca M Ghiringhelli, et al.
Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|June 13, 2015
Ice nucleation on carbon surface supports the classical theory for heterogeneous nucleationRaffaela Cabriolu, Tianshu Li
The Journal of Physical Chemistry. B|May 23, 2014
Probing methane hydrate nucleation through the forward flux sampling methodYuanfei Bi, Tianshu Li
The Journal of Chemical Physics|May 6, 2026
Interfacial density difference governs ice nucleation beyond lattice matchWanyu Zhao, Tianshu Li
International Journal of Nanomedicine|June 19, 2014
Enhanced cellular uptake of maleimide-modified liposomes via thiol-mediated transportTianshu Li, Shinji Takeoka
The Journal of Physical Chemistry. B|May 18, 2010
Exploring the rehydroxylation reaction of pyrophyllite by ab initio molecular dynamicsEsther Molina-Montes, Davide Donadio, Alfonso Hernández-Laguna, et al.
The Journal of Physical Chemistry. A|June 20, 2008
DFT research on the dehydroxylation reaction of pyrophyllite 2. Characterization of reactants, intermediates, and transition states along the reaction pathEsther Molina-Montes, Davide Donadio, Alfonso Hernández-Laguna, et al.
ACS Physical Chemistry Au|March 31, 2025
Heavy Solution for Molecular Thermal Management: Phonon Transport Suppression with Heavy AtomsWilliam Bro-Jørgensen, Andreas Juul Bay-Smidt, Davide Donadio, et al.
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