Tobias Morawietz, Ph.D.
Affiliations: | 2016- | Chemistry | Stanford University, Palo Alto, CA |
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Parents
Sign in to add mentor| Jörg Behler | grad student | Ruhr University–Bochum, Bochum, German | |
| Christoph Dellago | post-doc | ||
| Thomas E. Markland | post-doc |
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Publications
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| Atsango AO, Morawietz T, Marsalek O, et al. (2023) Developing machine-learned potentials to simultaneously capture the dynamics of excess protons and hydroxide ions in classical and path integral simulations. The Journal of Chemical Physics. 159 |
| Montoya-Castillo A, Chen MS, Raj SL, et al. (2022) Optically Induced Anisotropy in Time-Resolved Scattering: Imaging Molecular-Scale Structure and Dynamics in Disordered Media with Experiment and Theory. Physical Review Letters. 129: 056001 |
| Chen MS, Morawietz T, Mori H, et al. (2021) AENET-LAMMPS and AENET-TINKER: Interfaces for accurate and efficient molecular dynamics simulations with machine learning potentials. The Journal of Chemical Physics. 155: 074801 |
| Morawietz T, Artrith N. (2020) Machine learning-accelerated quantum mechanics-based atomistic simulations for industrial applications. Journal of Computer-Aided Molecular Design |
| Chen MS, Zuehlsdorff TJ, Morawietz T, et al. (2020) Exploiting Machine Learning to Efficiently Predict Multidimensional Optical Spectra in Complex Environments. The Journal of Physical Chemistry Letters |
| Morawietz T, Urbina AS, Wise PK, et al. (2019) Hiding in the Crowd: Spectral Signatures of Overcoordinated Hydrogen Bond Environments. The Journal of Physical Chemistry Letters |
| Singraber A, Morawietz T, Behler J, et al. (2019) Parallel Multistream Training of High-Dimensional Neural Network Potentials. Journal of Chemical Theory and Computation |
| Singraber A, Morawietz T, Behler J, et al. (2018) Density anomaly of water at negative pressures from first principles. Journal of Physics. Condensed Matter : An Institute of Physics Journal |
| Morawietz T, Marsalek O, Pattenaude SR, et al. (2018) The Interplay of Structure and Dynamics in the Raman Spectrum of Liquid Water over the Full Frequency and Temperature Range. The Journal of Physical Chemistry Letters |
| Morawietz T, Handl M, Oldani C, et al. (2018) Influence of Water and Temperature on Ionomer in Catalytic Layers and Membranes of Fuel Cells and Electrolyzers Evaluated by AFM Fuel Cells. 18: 239-250 |