NRAC Awards for quarter 2, 2004 (4/1/2004 - 6/30/2004)
Richard Alkire, University of Illinois at Urbana-Champaign
Multi-Scale Simulations of Electrochemical Systems
NCSA IBM P690: 250,000
NCSA Xeon Linux Cltr: 100,000
Ioan Andricioaei, University of Michigan, All Campuses
Multiple-Path Samping Methods for Biomolecular Conformational Changes
NCSA Xeon Linux Cltr: 50,000
Jacobo Bielak, Carnegie Mellon University
High Resolution Forward and Inverse Earthquake Modeling On Distributed Terascale Systems
PSC HP Marvel: 20,000
PSC TeraScale: 500,000
TeraGrid Cluster: 108,000
Bruce Boghosian, University of California-San Diego
Large Scale Lattice Boltzmann and Molecular Dynamics for Soft Condensed Matter and Biological Applications
NCSA IA64 Linux: 50,000
PSC TeraScale: 25,000
Robert Brunner, University of Illinois at Urbana-Champaign
the Laboratory for Cosmological Data Mining
NCSA Xeon Linux Cltr: 135,000
TeraGrid Cluster: 25,000
Roberto Car, Princeton University
Terascale Simulation Techniques for Chemistry,Materials Science, and Biology
PSC TeraScale: 2,500,000
Renyue Cen, Princeton University
Simulating the Clearing of the Cosmological Fog and the Evolution of the Intergalactic Medium
NCSA IBM P690: 20,000
NCSA Xeon Linux Cltr: 250,000
PSC TeraScale: 250,000
David Ceperley, Natl Center for Supercomputing App
Simulation of Quantum Systems
NCSA Xeon Linux Cltr: 75,000
PSC TeraScale: 200,000
SDSC NPACI IBM P690: 172,500
Thomas Cheatham, University of Utah
Insight Into Biomolecular Structure, Dynamics, Interactions and Energetics From Simulation
NCSA IA64 Linux: 10,000
NCSA IBM P690: 10,000
NCSA Xeon Linux Cltr: 300,000
PSC TeraScale: 70,000
TeraGrid Cluster: 100,000
Kyeongjae Cho, Stanford University
Multi-Scale Simulations of Materials Properties and Nanostructures
SDSC TG IBM P690: 30,000
Marvin Cohen, University of California-Berkeley
Theoretical Condensed Matter Physics
SDSC IBM DataStar Power4: 500,000
Yuni Dewaraja, University of Michigan, All Campuses
Accurate Quantification and Dosimetry in I-131 Radionuclide Therapy
SDSC IBM DataStar Power4: 100,000
Ahmed Elgamal, University of California-San Diego
Parcyclic: Three-Dimensional Simulation of Earthquake Liquefaction Response
SDSC IBM DataStar Power4: 100,000
Shanhui Fan, Stanford University
Computational Micro and Nanophotonics
NCSA IA64 Linux: 108,500
NCSA IBM P690: 75,000
PSC TeraScale: 247,000
Arthur Freeman, Northwestern Univ
Fundamentals of Dislocation and Fracture Properties of Intermetallics: Theory Starting From First Principles
NCSA IA64 Linux: 40,000
NCSA IBM P690: 37,000
NCSA Xeon Linux Cltr: 130,000
SDSC IBM DataStar Power4: 140,000
Natalia Gondarenko, University of Maryland at College Park
Mesoscale Structuring of High Latitude Plasma Patches
PSC TeraScale: 100,000
SDSC IBM DataStar Power4: 25,000
Charles Goodrich, Boston University
Center for Inteegrated Space Weather Modeling
PSC TeraScale: 150,000
SDSC IBM DataStar Power4: 318,000
SDSC TG IBM P690: 38,000
TeraGrid Cluster: 80,000
Keith Gubbins, North Carolina State University at Raleigh
Molecular Simulation of Structured Nano-Phases: Confinement Effects and Self-Assembly in Solution
PSC HP Marvel: 20,000
SDSC IBM DataStar Power4: 65,000
TeraGrid Cluster: 10,000
Peter Hauschildt, University of Georgia
Non-Standard Stellar Atmospheres
SDSC IBM DataStar Power4: 100,000
Chi-Yu Hu, California State University-Long Beach
Multichannel Scattering Cross Sections Via the Faddeev Method
PSC TeraScale: 450,000
SDSC IBM DataStar Power4: 80,000
John Joannopoulos, Massachusetts Institute of Technology
Ab-Initio Simulations of Materials Properties
NCSA Xeon Linux Cltr: 214,500
PSC TeraScale: 535,500
George Karniadakis, Brown University
Parallel Multi-Level Cfd Simulation
NCSA Xeon Linux Cltr: 250,000
PSC TeraScale: 750,000
SDSC IBM DataStar Power4: 180,000
John Ketterson, Northwestern Univ
Advanced Tetrahedrally-Bonded Ferromagnetic Semiconductors for Spintronic Applications
SDSC IBM DataStar Power4: 15,000
John Kim, University of California-Los Angeles
Numerical Study of Turbulent Boundary Layers
NCSA Xeon Linux Cltr: 150,000
PSC TeraScale: 50,000
SDSC IBM DataStar Power4: 150,000
TeraGrid Cluster: 125,000
Anatoly Klypin, New Mexico State University, All Campuse
Modeling Formation and Evolution of Galaxies and Galaxy Clusters
NCSA IBM P690: 120,000
NCSA Xeon Linux Cltr: 80,000
Keh-Fei Liu, University of Kentucky, All Campuses
Lattice Calculation of Hadronic Physics
PSC TeraScale: 300,000
SDSC IBM DataStar Power4: 10,000
Mordecai-Mark Mac Low, Natl Center for Supercomputing App
Formation of Stars and Stellar Clusters in the Turbulent Interstellar Medium
NCSA Xeon Linux Cltr: 20,000
PSC TeraScale: 576,000
Alexander Mackerell, University of Maryland at Baltimore
Atomic Detail Investigations of the Structural and Dynamic Properties of Biological Systems
NCSA Xeon Linux Cltr: 200,000
PSC HP Marvel: 21,000
PSC TeraScale: 300,000
Jeffry Madura, Duquesne University
Computational Support of the Critical Assessment of Structure Prediction of Proteins-Round 6
NCSA Xeon Linux Cltr: 100,000
PSC TeraScale: 800,000
SDSC IBM DataStar Power4: 100,000
Manos Mavrikakis, University of Wisconsin-Madison
Catalyst Design From First-Principles
SDSC IBM DataStar Power4: 50,000
J Andrew Mccammon, University of California-San Diego
Theory of Biomolecular Structure and Dynamics
SDSC IBM DataStar Power4: 400,000
George Morales, University of California-Los Angeles
Particle-in-Cell Simulations of Alfvenic Phenomenons of Small Transverse Scales
NCSA IA64 Linux: 10,000
SDSC IBM DataStar Power4: 80,000
Nate Newman, Arizona State University Main
Nitride-Based Materials for Spintronic Applications: Investigations By Density-Functional Theory
NCSA Xeon Linux Cltr: 30,000
Michael Norman, University of California-San Diego
Projects in Astrophysical and Cosmological Structure Formation
PSC TeraScale: 100,000
SDSC NPACI IBM P690: 225,000
SDSC IBM DataStar Power4: 458,000
SDSC TG IBM P690: 50,000
TeraGrid Cluster: 200,000
Kim Olsen, San Diego State University
Southern California Earthquake Center (Scec) Earthquake Simulation Project
SDSC IBM DataStar Power4: 100,000
Gregory Olson, Northwestern Univ
First-Principles Study of Metal/Ceramic Interfaces for High-Strngth Steels
PSC TeraScale: 20,000
Jeremiah Ostriker, Princeton University
the Structure of Dark Matter Halos and the Lcdm Model
NCSA Xeon Linux Cltr: 407,500
PSC TeraScale: 250,000
Philip Pritchett, University of California-Los Angeles
Collisionless Dissipative Processes in the Magnetotail and At the Magnetopause Boundary
SDSC IBM DataStar Power4: 80,000
Thomas Quinn, University of Washington
Gravitational N-Body Simulations: Planet Formation to Cosmology
NCSA IBM P690: 20,000
PSC HP Marvel: 50,000
PSC TeraScale: 225,000
Joachim Raeder, University of New Hampshire
Global Modeling of Earth's Magnetosphere
NCSA IA64 Linux: 40,000
NCSA IBM P690: 133,000
NCSA Xeon Linux Cltr: 415,000
SDSC IBM DataStar Power4: 50,000
Harold Scheraga, Cornell University, All Campuses
Design and Parametrisation of A Force Field and Global Optimization Procedure for Ab Initio Protein Structure Prediction Based On A Hierarchical Structure of the Energy Landscape.
NCSA Xeon Linux Cltr: 250,000
PSC TeraScale: 590,000
H Edward Seidel, Louisiana State Univ, All Campuses
Numerical Relativity and Black Hole Mergers
NCSA Xeon Linux Cltr: 400,000
TeraGrid Cluster: 200,000
Carlos Simmerling, SUNY at Stony Brook, All Campuses
Computer Simulations of Biomolecular Structure and Dynamics
NCSA Xeon Linux Cltr: 957,600
Wai-Mo Suen, Washington University
Computational General Relativistic Astrophysics
NCSA Xeon Linux Cltr: 300,000
TeraGrid Cluster: 100,000
Kendall Thomson, Purdue University, All Campuses
Computational Methodology for Integrated Materials-to-Product Design
NCSA IBM P690: 50,000
NCSA Xeon Linux Cltr: 300,000
Joel Tohline, Louisiana State Univ, All Campuses
Numerical Hydrodynamics of Mass-Transferring Binary Star Systems
NCSA Xeon Linux Cltr: 400,000
Juri Toomre, University of Colorado, All Campuses
Coupling of Turbulent Compressible Solar Convection With Rotation, Shear and Magnetic Fields
PSC TeraScale: 780,000
SDSC IBM DataStar Power4: 400,000
Henry Tufo, University of Colorado, All Campuses
Simulation of Transition in Vascular Flows
PSC TeraScale: 150,000
Ralph Wheeler, University of Oklahoma, All Campuses
Simulating Electron and Ion Transport
SDSC IBM DataStar Power4: 100,000
Robert Wilhelmson, University of Illinois at Urbana-Champaign
the Numerical Simulation of Convective Clouds and Boundaries
NCSA Xeon Linux Cltr: 100,000
TeraGrid Cluster: 27,000
Roy Williams, California Institute of Technology
the Nsf National Virtual Observatory
TeraGrid Cluster: 257,000
| Platform | Total PIs | Total SUs |
| NCSA IA64 Linux | 6 | 258,500 |
| SDSC IBM DataStar Power4 | 23 | 3,601,000 |
| PSC TeraScale | 24 | 9,918,500 |
| TeraGrid Cluster | 11 | 1,232,000 |
| NCSA Xeon Linux Cltr | 24 | 5,614,600 |
| NCSA IBM P690 | 9 | 715,000 |
| PSC HP Marvel | 4 | 111,000 |
| SDSC TG IBM P690 | 3 | 118,000 |
| SDSC NPACI IBM P690 | 2 | 397,500 |
