Thomas E. Gartner

Modeling and Simulations of Polymers: A Roadmap

Thomas E. Gartner, Arthi Jayaraman · Macromolecules · 2019 · 508 citations · Full text

Engineering, Polymer Simulations, Computational Chemistry +18

Signatures of a liquid–liquid transition in an ab initio deep neural network model for water

Thomas E. Gartner, Linfeng Zhang, Pablo M. Piaggi et al. · Proceedings of the National Academy of Sciences · 2020 · 190 citations · Full text

Quantum Liquid, Engineering, Liquid-liquid Flow +17

Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model

Thomas E. Gartner, Kelly M. Hunter, Eleftherios Lambros et al. · The Journal of Physical Chemistry Letters · 2022 · 83 citations · Full text

Local Structure, Engineering, Many-body Mb-pol Model +21

Liquid-Liquid Transition in Water from First Principles

Thomas E. Gartner, Pablo M. Piaggi, Roberto Car et al. · Physical Review Letters · 2022 · 79 citations · Full text

Quantum Liquid, Engineering, Physics +13

pyPRISM: A Computational Tool for Liquid-State Theory Calculations of Macromolecular Materials

Tyler B. Martin, Thomas E. Gartner, Ronald L. Jones et al. · Macromolecules · 2018 · 54 citations · Full text