Building the Science Case for Ultra Scale Simulation
Documents from the applications community

Final-Release Documents
[PDF format]

• Reasserting U.S. Leadership in Scientific Computation
  Edward Oliver, Director
  Office of Advance Scientific Computing Research
    [added August 6, 2002]
• Computational Design of Catalysts
    [added August 12, 2002]
• Autoignition and Control of 'Flameless' Combustion
  DOE point of contact: Walt Stevens, SC/BES;
  Technical point of contact: Jackie Chen, Sandia National Laboratories
    [added August 12, 2002]
• The Fundamentals of Soot Birth and Growth
  DOE point of contact: Walt Stevens, SC/BES;
  Technical points of contact: Theresa Windus, Pacific Northwest National Laboratories,
  Albert Wagner, Argonne National Laboratory, Mark Gordon, Iowa State University, Ames Laboratory,
  Alison Kubota, William Pitz and Charles Westbrook, Lawrence Livermore National Laboratory,
  Larry Rahn, Sandi National Laboratory
    [added August 12, 2002]
• Accelerating the Revolution in Computational Materials Science
    [added October 16, 2002]
• Design Optimization via Supercomputing -- Fusion Energy Sciences
    [added October 16, 2002]
• U. S. Leadership in Scientific Computation -- Fusion Energy Sciences
    [added October 16, 2002]
• Accelerating Climate Prediction
  Ari Patrinos, Office of Biological and Environmental Research, U.S. Department of Energy
    [added October 16, 2002]
• Simulating Real-World Combustion Devices
  William H. Kirchhoff, Chemical Sciences Division, Office of Basic Energy Sciences, U.S. Department of Energy
    [added October 16, 2002]
• Computational Nanoscience on Earth Simulator Class Machines: A Revolution in Materials Science
  M. Jarrell, Univ. Cincinnati, D.P. Landau, Univ. Georgia, T.C. Schulthess, ORNL, G.M. Stocks, ORNL, and N.S. Wingreen, NEC Res. Inst.
    [added November 5, 2002]
• Coping with the Ultrascale Tsunami of Scientific Data
  John van Rosendale, Program Manager, Office of Advanced Scientific Computing Research
    [added November 15, 2002]
• Biophysical Simulations Enabled by Ultrasimulation Facility
    [added April 3, 2003]

Working Documents
[PDF format, except as noted]

• An Astrophysics Response to the Challenge of the Earth Simulator
  Julian Borrill, Peter Nugent, John Shalf, and Martin White, Lawrence Berkeley National Laboratory;
  Stan Woosley, University of California at Santa Cruz
    [added August 12, 2002]

• Computational Environmental Molecular Science
  D.A. Dixon, R.J. Harrison, T. Windus
  Pacific Northwest National Laboratory
    [added August 12, 2002]

• Turbulence and ‘Self Accelerated’ Combustion  [DRAFT]
  DOE point of contact: Walt Stevens, SC/BES;
  Technical POCs: Scott Wunsch, Alan Kerstein, Larry Rahn, Sandia National Laboratories
  Stan Woosley, UC Santa Cruz
    [added August 12, 2002]

• Grand Challenges in Computational Structural and Systems Biology
  D.A. Dixon, T.P. Straatsma, T. Head-Gordon
  Pacific Northwest National Laboratory & Lawrence Berkeley National Laboratory
    [added August 12, 2002]

• Computational Fusion Energy Research: The Need for New Levels of Supercomputing
    [added August 19, 2002]
• Benefits of an Earth Simulator Class Machine for US Climate Science
    [added August 26, 2002]
• Impact of Earth Simulator-Class Computers on Computational Nanoscience and Materials Science
  François Gygi, Giulia Galli, Jeffrey C. Grossman, Vasily Bulatov
  Lawrence Livermore National Laboratory   [added September 11, 2002]
• UltraNet — enabling scientific insight
    [added September 13, 2002]
• Realizing the Potential of the Genome Revolution: Facilities for 21st Century Systems Biology Science (DRAFT)
    [added October 16, 2002]
• Computational Structural Genomics  [HTML]
    [added October 16, 2002]
• Protecting the Nation's Groundwater  [HTML]
    [added October 16, 2002]
• Computational Materials Science  [HTML]
    [added October 16, 2002]
• High Energy and Nuclear Physics
    [added October 16, 2002]
• Ultrascale Visualization — gleaning insight through scientific visualization
  John van Rosendale, Program Manager, Office of Advanced Scientific Computing Research
    [added November 18, 2002]
• Ultrascale Computing in Accelerator Science & Technology: Scientific Opportunities and Impact
    [added December 31, 2002]
• Biophysical Simulations Enabled by Ultrasimulation Facility
  Michael Colvin, Lawrence Livermore National Laboratory
    [added April 3, 2003]

Last update: April 3, 2003