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Argonne Leadership Computing Facility

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Revealing the Galaxy–Halo Connection through Machine Learning

Publications The Astrophysical Journal Letters

Simple Approach for Reconciling Cyclic Voltammetry with Hydrogen Adsorption Energy for Hydrogen Evolution Exchange Current

Publications The Journal of Physical Chemistry Letters

Performance Portability Evaluation of Blocked Stencil Computations on GPUs

Publications SC-W '23: Proceedings of the SC '23 Workshops of The International Conference on High Performance Computing, Network, Storage, and Analysis

Accurate Force Fields for Atomistic Simulations of Oxides, Hydroxides, and Organic Hybrid Materials up to the Micrometer Scale

Publications Journal of Chemical Theory and Computation

First Principles Simulation of Reacting Hypersonic Flow over a Blunt Wedge

Publications Physics of Fluids

Osteocalcin: Promoter or Inhibitor of Hydroxyapatite Growth?

Publications Langmuir

Explainability and Extrapolation of Machine Learning Models for Predicting the Glass Transition Temperature of Polymers

Publications Journal of Polymer Science

Conformationally Selective 2-Aminotetralin Ligands Targeting the alpha2A- and alpha2C-Adrenergic Receptors

Publications ACS Chemical Neuroscience

DAFNI: A Computational Platform to Support Infrastructure Systems Research

Publications Proceedings of the Institution of Civil Engineers - Smart Infrastructure and Constrution

Scalable Riemann Solvers with the Discontinuous Galerkin Method for Hyperbolic Network Simulation

Publications PASC '23: Proceedings of the Platform for Advanced Scientific Computing Conference

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