Yu Shi

3PUBLICATIONS
2CO-AUTHORS
Theoretical quantum chemistryMolecular imaging (incl. electron microscopy and neutron diffraction)
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Publications (3)

|Aug 03, 2022
Deep neural network based quantum simulations and quasichemical theory for accurate modeling of molten salt thermodynamics.

Yu Shi, Stephen T Lam, Thomas L Beck

|Oct 18, 2021
Condensed Phase Water Molecular Multipole Moments from Deep Neural Network Models Trained on Ab Initio Simulation Data.

Yu Shi, Carrie C Doyle, Thomas L Beck

|Nov 18, 2020
Absolute ion hydration free energy scale and the surface potential of water via quantum simulation.

Yu Shi, Thomas L Beck

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Frequent Collaborators

2 joint publications

Thomas L Beck

1 joint publications

Stephen T Lam