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Athanassios Z Panagiotopoulos

25PUBLICATIONS
29CO-AUTHORS
Transport properties and non-equilibrium processesStructure and dynamics of materialsComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Theoretical quantum chemistrySemi- and unsupervised learning
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Journal

Publications (25)

Sort by Publication Date:
|Nov 14, 2021
Activity coefficients of aqueous electrolytes from implicit-water molecular dynamics simulations.

Sina Hassanjani Saravi, Athanassios Z Panagiotopoulos

|Oct 02, 2021
Phase separation vs aggregation behavior for model disordered proteins.

Ushnish Rana, Clifford P Brangwynne, Athanassios Z Panagiotopoulos

|Jul 09, 2021
Vapor-liquid equilibrium of water with the MB-pol many-body potential.

Maria Carolina Muniz, Thomas E Gartner, Marc Riera

|Mar 09, 2021
Erratum: "Note: Smooth torsional potentials for degenerate dihedral angles" [J. Chem. Phys. 146, 226101 (2017)].

Michael P Howard, Antonia Statt, Athanassios Z Panagiotopoulos

|Jan 27, 2021
When do short-range atomistic machine-learning models fall short?

Shuwen Yue, Maria Carolina Muniz, Marcos F Calegari Andrade

|Jul 17, 2020
Molecular simulation of liquid-vapor coexistence for NaCl: Full-charge vs scaled-charge interaction models.

Dina Kussainova, Anirban Mondal, Jeffrey M Young

Pageof 5

Frequent Collaborators

5 joint publications

Michael P Howard

5 joint publications

Pablo G Debenedetti

4 joint publications

Hao Jiang

4 joint publications

Antonia Statt

4 joint publications

Wesley F Reinhart

3 joint publications

Shuwen Yue

3 joint publications

Arash Nikoubashman

2 joint publications

Maria Carolina Muniz

2 joint publications

Amir Haji-Akbari

2 joint publications

M Scott Shell

Frequent Collaborators

5 joint publications

Michael P Howard

5 joint publications

Pablo G Debenedetti

4 joint publications

Hao Jiang

4 joint publications

Antonia Statt

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