Direct Implemientations of Electron Propogators
Lead Institution
Kansas State University
Principal Investigator
J Vincent Ortiz
Project type
Exploratory Research
Formulation and Implementation of AO Based Methods which Include High Correlation
Lead Institution
University of Utah
Principal Investigator
Jack Simons
Project type
Exploratory Research
Multiscale Design of Advanced
Materials based on Hybrid Ab-Initio
and Quasicontinuum Methods
Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
Eric Bylaska
Project type
Exploratory Research
X-ray Photoemission Study of Graphite
Lead Institution
UCAR Carbon Company Inc.
Principal Investigator
Samina Azad
Project type
Exploratory Research
Molecular Recognition at the Electronic Level
Lead Institution
University of Nebraska - Lincoln
Principal Investigator
John Stezowski
Project type
Exploratory Research
The biogeochemical mechanisms controlling reduced radionuclide particle formation properties and stability.
Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
Matthew Marshall
Project type
Exploratory Research
Exploratory Synthesis of Novel Cluster-Based Nanomaterials
Lead Institution
University of Missouri - Rolla
Principal Investigator
Massimo Bertino
Project type
Exploratory Research
Radionuclide Reduction by Anaeromyxabacter dehalogenans
Lead Institution
University of Tennessee
Principal Investigator
Frank Loeffler
Project type
Exploratory Research
Advanced Computer Architecture Codes - MMP Semi-Emperical Electronic Structure Theory Codes for MPPs
Lead Institution
Organisch-Chemisches Institute
Principal Investigator
Walter Thiel
Project type
Exploratory Research
Advanced Shared-Memory Programming Models and Tools for High Performance Computing
Lead Institution
IBM Singapore
Principal Investigator
Steven Chin
Project type
Exploratory Research
Radiation Damage in Oxide Materials
Lead Institution
University of Tennessee
Principal Investigator
William Weber
Project type
Exploratory Research
Immiscibility of Silicates
Lead Institution
Private (Keefer)
Principal Investigator
Keith Keefer
Project type
Exploratory Research
Mobilities of Ions at High Temperature
Lead Institution
University of Maine
Principal Investigator
Jay Rasaiah
Project type
Exploratory Research
Eignesolver
Lead Institution
IBM
Principal Investigator
Fred Gustavson
Project type
Exploratory Research
Glass Simulation
Lead Institution
Massachusetts Institute of Technology
Principal Investigator
Michael Brenner
Project type
Exploratory Research
Separation Science Project
Lead Institution
Indiana State University
Principal Investigator
Eric Glendening
Project type
Exploratory Research
Heats of Formation of Organic Molecules
Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
James Franz
Project type
Exploratory Research
Application of Variational Transition State Theory to Reactions in Condensed Phase
Lead Institution
Eastern Washington University
Principal Investigator
Robin McRae
Project type
Exploratory Research
Interface Chemistry and electronics of ZnSe and ZnS upon Culn2Se3
Lead Institution
Washington State University
Principal Investigator
Peter Eschbach
Project type
Exploratory Research
Hydrogen Bonding in Super Critical Fluids
Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
Bruce Palmer
Project type
Exploratory Research