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 INCITE
Domain Materials Science
Hours 22 Million Core-Hours
PI William George, National Institute of Standards and Technology

High-Fidelity Simulation of Complex Suspension Flow for Practical Rheometry

High-Fidelity Simulation of Complex Suspension Flow for Practical Rheometry

Award INCITE
Domain Computer Science
Hours 10,000,000 Core-Hours
PI Maya B. Gokhale

Fault-Oblivious Exascale Computing Environment

Award INCITE
Domain Chemistry
Hours 4,000,000 Core-Hours
PI William A. Lester, Jr. , University of California-Berkeley

Energetic Aspects of CO2 Absorption by Ionic Liquids from Quantum Monte Carlo

Award INCITE
Domain Engineering
Hours 45,000,000 Core-Hours
PI Umesh Paliath, GE Global Research

Enabling Green Energy and Propulsion Systems via Direct Noise Computation

GE propulsion systems

Award INCITE
Domain Earth Science
Hours 2,000,000 Core-Hours
PI Thomas Jordan, University of Southern California

CyberShake3.0: Physics-Based Probabilistic Seismic Hazard Analysis

Award INCITE
Domain Energy Technologies
Hours 10,000,000 Core-Hours
PI Saivenkataraman Jayaraman, Sandia National Laboratories

Atomistic Adaptive Ensemble Calculations of Eutectics of Molten Salt Mixtures

Award INCITE
Domain Engineering
Hours 40 Million Core-Hours
PI Kenneth Jansen, University of Colorado

Adaptive Detached Eddy Simulation of a Vertical Tail with Active Flow Control

Adaptive Detached Eddy Simulation of a Vertical Tail with Active Flow Control

Award INCITE
Domain Earth Science
Hours 10 Million Core-Hours
PI Thomas Jordan , Southern California Earthquake Center

Using Supercomputers to Improve Seismic Hazard Maps

seismic hazard map

Award ALCC
Domain Physics
Hours 36 Million Core-Hours
PI Michael Borland, Argonne National Laboratory

Direct Multiobjective Optimization of Storage Ring Lattices for the APS Upgrade and Beyond

Dynamic aperture for 50 error ensembles overlaid on frequency map

Award INCITE
Domain Materials Science
Hours 15 Million Core-Hours
PI Giulia Galli, University of California-Davis

First Principles Simulations of the Infrared Spectrum of Liquid Water

Infrared spectra of liquid water

Award INCITE
Domain Physics
Hours 40 Million Core-Hours
PI Peter Coveney, University College London

Large scale condensed matter and fluid dynamics simulations

Large-Scale Condensed Matter and Fluid Dynamics Simulations
,
Large-Scale Condensed Matter and Fluid Dynamics Simulations

Award INCITE
Domain Energy Technologies
Hours 7 Million Core-Hours
PI John Tonge, UCLA

Peta-Scale Particle-In-Cell Simulations of Fast Ignition

Image generated from a simulation of the PIC code OSIRIS; Luís Silva, IST, Portu

Award Mira ESP
Domain Energy Technologies
Hours 50 Million Core-Hours
PI Larry Curtiss , Argonne National Laboratory

Materials Design and Discovery: Catalysis and Energy Storage

Thirty-three atom silver cluster

Award ALCC
Domain Engineering
Hours 50 Million Core-Hours
PI Parviz Moin, Stanford University

A Center for Turbulence Research - Argonne Leadership Computing Facility Collaboratory for Very Large Scale Turbulence Simulations on Petascale Computing Platforms

Models for the solid electrolyte interphase in Li batteries: Amorphous alumina on graphite.

Award ALCC
Domain Energy Technologies
Hours 38 Million Core-Hours
PI Michael Smith , Argonne National Laboratory

Scalable, Explicit Geometry, Whole Core Nuclear Reactor Simulations

Scalable, Explicit Geometry, Whole Core Nuclear Reactor Simulations

Award ALCC
Domain Chemistry
Hours 28.5 Million Core-Hours
PI Benoit Roux , University of Chicago

Simulation of Large Conformational Transitions in Macromolecular Systems using Leadership Computing

MD simulations in explicit water-membrane environment

Award ALCC
Domain Energy Technologies
Hours 75 Million Core-Hours
PI Andrew Siegel, Argonne National Laboratory

Improving Light Water Reactor Fuel Reliability Via Flow Induced Vibration Simulations

217-pin

Award ALCC
Domain Engineering
PI Jixian Yao, GE Research

Aerodynamics Exploration for Advanced Aero-Propulsion Technologies

Award Mira ESP
Domain Physics
Hours 150 Million Core-Hours
PI Paul Mackenzie, Fermilab

LatticeQCD - Early Science

summary of Lattice QCD averages

Award Mira ESP
Domain Biological Sciences
Hours 80 Million Core-Hours
PI Benoit Roux, Argonne National Laboratory & University of Chicago

NAMD - The Engine for Large-Scale Classical MD Simulations of Biomolecular Systems Based on a Polarizable Force Field

NAMD