Projects

ALCF projects cover many scientific disciplines, ranging from biology and physics to materials science and energy technologies. Filter ongoing and past projects by allocation program, scientific domain, and year.

Award Aurora ESP
Domain Chemistry
PI David Bross, Argonne National Laboratory

Exascale Computational Catalysis

Chemical transformation technologies are present in virtually every sector, and their continued advancement requires a molecular-level understanding of underlying chemical processes. This project will facilitate and accelerate the quantitative description of crucial gas-phase and coupled heterogeneous catalyst/gas-phase chemical systems through the development of data-driven tools designed to revolutionize predictive catalysis and address DOE grand challenges.

Bross Aurora ESP

Award ALCC
Domain Physics
Hours 50 Million Core-Hours
PI Sergey Syritsyn, RIKEN BNL Research Center

Nucleon Structure and Electric Dipole Moments with Physical Chiral-symmetric Quarks

Award ALCC
Domain Physics
PI Petros Tzeferacos, University of Chicago/Argonne National Laboratory

Simulations of Laser Experiments to Study MHD Turbulence and Non-thermal Charged Particles

Award ALCC
Domain Earth Science
Hours 35 Million Core-Hours
PI Mark Petersen, Los Alamos National Laboratory

Investigating the Impact of Improved Southern Ocean Processes in Antarctic-focused Global Climate Simulations

Award ALCC
Domain Energy Technologies
Hours 20 Million Core-Hours
PI Peter Nugent, Lawrence Berkeley National Laboratory

HPC4EnergyInnovation ALCC End-Station

Award ALCC
Domain Physics
Hours 10 Million Core-Hours
PI Katrin Heitmann, Argonne National Laboratory

Emulating the Universe

Award ALCC
Domain Materials Science
Hours 20 Million Core-Hours
PI Wissam Saidi, University of Pittsburgh

Impact of Grain Boundary Defects on Hybrid Perovskite Solar Absorbers

Pb trimer

Award ALCC
Domain Chemistry
Hours 30 Million Core-Hours
PI Paul Fischer, Argonne National Laboratory

High-fidelity Simulations of Flow and Heat Transfer during Motored Operation of an Internal Combustion Engine

Award ALCC
Domain Computer Science
Hours 110 Million Core-Hours
PI T.P. Straatsma, Oak Ridge National Laboratory/University of Tennessee

Portable Application Development for Next Generation Supercomputer Architectures

Award ALCC
Domain Energy Technologies
Hours 83.5 Million Core-Hours
PI Aleksandr Obabko, Argonne National Laboratory

High-fidelity Numerical Simulation of Wire-wrapped Fuel Assemblies

Award ALCC
Domain Materials Science
Hours 90 Million Core-Hours
PI Phay Ho, Argonne National Laboratory

Imaging and Controlling Elemental Contrast of Nanocluster in Intense X-ray Pulses

Award ALCC
Domain Computer Science
Hours 100 Million Core-Hours
PI Robert Voigt, Leidos Inc.

Demonstration of the Scalability of Programming Environments by Simulating Multi-Scale Applications

Award ALCC
Domain Materials Science
Hours 42 Million Core-Hours
PI J. Ilja Siepmann, University of Minnesota

Predictive Modeling and Machine Learning for Functional Nanoporous Materials

Award ALCC
Domain Materials Science
Hours 100 Million Core-Hours
PI Giulia Galli, University of Chicago/Argonne National Laboratory

Large Scale Simulations of Heterogeneous Materials for Energy Conversion Applications

Award ALCC
Domain Energy Technologies
Hours 140 Million Core-Hours
PI Elia Merzari, Argonne National Laboratory

High-Fidelity Simulation for Molten Salt Reactors: Enabling Innovation through Petascale Computing

Award ALCC
Domain Physics
Hours 162 Million Core-Hours
PI Thomas Blum, University of Connecticut

Hadronic Light-by-light Scattering and Vacuum Polarization Contributions to the Muon Anomalous Magnetic Moment from Lattice QCD with Chiral Fermions

Award ALCC
Domain Physics
Hours 80 Million Core-Hours
PI Eric Lancon, Brookhaven National Laboratory

Scaling LHC proton-proton collision simulations in the ATLAS detector

Award ALCC
Domain Materials Science
Hours 80 Million Core-Hours
PI Brian Wirth, Oak Ridge National Laboratory/University of Tennessee

Modeling Fusion Plasma Facing Components

Award ALCC
Domain Physics
Hours 247 Million Core-Hours
PI Ruth Van de Water, Fermilab

Semileptonic B- and D-meson form factors with high precision

Award ALCC
Domain Engineering
Hours 51.5 Million Core-Hours
PI Anupam Sharma, Iowa State University

Analysis and Mitigation of Dynamic Stall in Energy Machines