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Argonne Leadership Computing Facility

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Computational Discovery of Intermolecular Singlet Fission Materials Using Many-Body Perturbation Theory

Publications The Journal of Physical Chemistry C

Circular Polarization of Simulated Images of Black Holes

Publications The Astrophysical Journal

Atomically Thin Superfluid and Solid Phases for Atoms on Strained Graphene

Publications Physical Review B

Applications of Flow Models to the Generation of Correlated Lattice QCD Ensembles

Publications Physical Review D

Accelerating Fusion Plasma Collision Operator Solves with Portable Batched Iterative Solvers on GPUs

Publications ISC High Performance 2024 International Workshops

A Characterization of Soft-Error Sensitivity in Data-Parallel and Model-Parallel Distributed Deep Learning

Publications Journal of Parallel and Distributed Computing

Riemannian Manifold HMC with Fermions

Publications The 40th International Symposium on Lattice Field Theory (LATTICE2023)

Compressible Turbulent Convection at Very High Rayleigh Numbers

Publications International Journal of Heat and Mass Transfer

Optimal Molecular Design: Generative Active Learning Combining REINVENT with Precise Binding Free Energy Ranking Simulations

Publications Journal of Chemical Theory and Computation

Energy Exascale Computational Fluid Dynamics Simulations with the Spectral Element Method

Publications Journal of Fluids Engineering

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