2008 Initial Allocation Awards
The following table lists the allocation awards for NERSC for the 2008 allocation year (Jan 8, 2008 through Jan 12, 2009). The list is in alphabetical order by the last name of the Principal Investigator.
Note - Letters following the repository name indicate the following:
'I' DOE ASCR INCITE award
'S' NERSC Startup award
A B C D E F G H I J K L M N O P Q R S T U V W X Y Z
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Adams, Paul Berkeley Lab 82625 m811 1,600,000 80,000 The Joint Bioenergy
Institute (JBEI)
Agarwal, Deborah Berkeley Lab 82542 m510 25,000 30,000 Berkeley Water Center
Agarwal, Deborah Berkeley Lab 82616 mpdsd 10,000 100,000 CRD Distributed Systems
Department Guest Accounts
Al-Jassim, Mowafak NREL 82189 mp308 160,000 500 Theoretical simulations of
effects of extended and
point defects on the
properties of advanced
materials
Aldering, Greg Berkeley Lab 82322 m112 40,000 1,600,000 The Nearby Supernova
snfactry Factory
Alhassid, Yoram Yale Univ 82539 mp69 450,000 1,000 Statistical Many-Body
Studies of Nuclei and
Quantum Dots
Alivisatos, Paul Berkeley Lab 82385 m387 600,000 10,000 Theory of nanostructured
materials
Andersen, Richard Berkeley Lab 82599 m782 50,000 500 Quantum Mechanical Studies
of how Organometallic
compounds of the actinide
metals utilize their 5f
and 6d orbitals in bonds
to CO and related ligands
Andricioaei, Ioan U. Michigan 82280 m739 7,000,000 25,000 Energetics of the Mechano-
Chemical Coupling in DNA-
Protein and DNA-
Nanoparticle Complexes
Annamalai, H. U. Hawaii 82443 m774 50,000 6,000 Future Projections of Mean
and Variability of the
Asian summer monsoon and
Indian Ocean climate
system
Arons, Jonathan UC Berkeley 82297 m677 1,000,000 25,000 Particle acceleration in
astrophysical
collisionless shocks
Aspuru-Guzik, Alan Harvard Univ 82559 m702 S 45,000 3,500 Computational design of
novel organic photovoltaic
materials with improved
hole- and electron-
transport properties.
Autrey, Tom PNNL 82676 m852 S 20,000 500 Control of Hydrogen
Release and Uptake in
Condensed Phases
Aydemir, Ahmet U. Texas 82550 mp77 25,000 2,000 Comprehensive modeling and
Austin transport studies at the
Institute for Fusion
Studies
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Babikov, Dmitri Marquette 82324 m409 1,000,000 5,000 Coherent Control of Ground
Univ Electronic State Molecular
Dynamics: Toward Bond
Selective Chemistry.
Baddourah, Majdi Saudi Aramco 82680 m854 S 40,000 500 Benchmark of POWERS Oil
Simulator
Baden, Scott UC San Diego 82641 m821 S 30,000 100 Non-SPMD graph-based
execution
Baer, Ferdinand U. Maryland 82307 mp188 80,000 20,000 Multi-resolution climate
modeling with the spectral
element method
Bagchi, Prosenjit Rutgers Univ 82600 m798 S 50,000 2,000 Massively large simulation
of dense suspension of
deformable
particles/drops/bubbles
Bai, Zhaojun UC Davis 82238 m746 50,000 1,000 Next Generation Multit-
Scale Quantum Simulation
Software for Strongly
Correlated Materials
Bailey, David Info Sciences 82270 m88 200,000 1,000 The Performance
Inst Engineering Research
Institute
Bailey, David Berkeley Lab 82420 mp207 20,000 100 Experimental Mathematics
and High-Precision
Software
Balaji, V Princeton 82434 m743 17,000,000 50,000 Coupled High-Resolution
Univ Modeling of the Earth
System
Balasubramanian, K. CSU East Bay, 82210 m719 500,000 500 Electronic Structure of
Hayward Tranisition Metal Clusters
and Environmental Actinide
Complexes
Balbuena, Perla Texas A&M 82331 m668 300,000 1,000 Catalyzed growth of carbon
Univ nanotubes
Balbuena, Perla Texas A&M 82349 m249 2,000,000 10,000 Computational chemistry
Univ search of efficient
catalysts
Bansil, Arun Northeastern 82204 m225 100,000 2,000 Correlation Effects,
Magnetism, and
Spectroscopy of Complex
Materials, including
Nanosystems
Barad, Michael Stanford Univ 82151 m502 3,000,000 40,000 Multiscale Simulations of
Oceanic Internal Gravity
Waves
Baron, Edward U. Oklahoma 82192 mp90 400,000 20,000 Synthetic Spectra of
Astrophysical Objects
Bartschat, Klaus Drake Univ 82695 m864 S 50,000 500 High-precision
calculations for electron
and photon interactions
with atoms and ions
Batista, Victor Yale Univ 82511 m410 300,000 1,000 QM/MM Studies of High-
Valent Manganese Complexes
Batista, Victor Yale Univ 82533 mp311 600,000 1,000 Simulations of electron-
hole relaxation dynamics
on functionalized TiO2-
anatase surfaces
Behling, Pat U. Wisc. 82464 m285 200,000 75,000 Towards the prediction of
Madison decadal to mult-century
processes in a high-
throughput climate system
model
Bell, John Berkeley Lab 82344 mp111 12,000,00 3,000,000 Applied Partial
Differential Equations
Center
Bell, John Berkeley Lab 82635 incite16 I 22,000,00 2,000,000 Interaction of Turbulence
and Chemistry in Lean
Premixed Laboratory Flames
Benedek, Roy Argonne 82219 mp169 100,000 500 First Principles
Calculations for Lithium-
Ion Battery Electrodes and
Electrode Coatings
Berg, Bernd Florida State 82667 m839 S 25,000 10,000 Deconfined Equilibrium
with Confined Boundary
Conditions in SU3 Lattice
Gauge Theory
Bergmann, Dan Livermore Lab 82341 mp163 150,000 20,000 Atmospheric Formation,
Transformation, and
Radiative Forcing of Acid-
Catalyzed Secondary
Organic Aerosols
Bethel, Edward (Wes) Berkeley Lab 82282 m636 50,000 200,000 SciDAC2 Visualization and
Analytics Center for
Enabling Technologies
Bhattacharjee, A. U. New 82294 m148 600,000 50,000 Center for Integrated
Hampshire Computation and Analysis
of Reconnection and
Turbulence
Boman, Erik Sandia Lab NM 82446 m708 S 10,000 1,000 Combinatorial scientific
computing: load balancing
and matrix ordering.
Bonoli, Paul MIT 82166 m77 3,000,000 2,000 Center for Simulation of
Wave-Plasma Interactions:
SciDAC Project
Borrill, Julian Berkeley Lab 82195 mp107 800,000 200,000 Cosmic Microwave
Background Data Analysis
For Sub-Orbital
Experiments
Borrill, Julian Berkeley Lab 82197 planck 2,000,000 500,000 Cosmic Microwave
Background Data Analysis
For The Planck Satellite
Mission
Borrill, Julian Berkeley Lab 82655 cmbpol S 50,000 5,000 Simulations and analyses
for CMBpol mission concept
studies
Bowman, Joel Emory Univ 82200 m651 3,500,000 2,000 Theoretical studies of
combustion dynamics
Braams, Bastiaan Emory Univ 82534 m631 1,250,000 2,000 Hydrocarbons in plasma
Branstetter, Marcia Oak Ridge 82507 m543 20,000 1,000 River Transport and
Hydrology in CCSM
Brieger, Leesa Renaissance 82543 m736 S 50,000 8,000 Impact of Cumulus
Comp Inst Parameterization Schemes
on 4 km Simulations
Bringa, Eduardo Livermore Lab 82485 mp43 120,000 15,000 Microstructure evolution
in irradiated materials
Broadbelt, Linda Northwestern 82394 m763 185,000 100 Mapping the Oxidative
Dehydrogenation of
Cyclohexane on Metal Oxide
Surfaces Using Density
Functional Theory
Brown, Eric Loyola U. 82567 m597 160,000 100 Ab Initio Study of the
Chicago Nonlinear Optical Response
Properties of Extended
Chromophores
Brown, Virginia MIT 82469 m173 2,000 1,000 Electroweak and
Electromagnetic
Interactions in the
Nucleon-Nucleon System;
Pion Production
Bruhwiler, David Tech-X Corp 82380 m327 1,500,000 2,000 Parallel Simulation of
Electron Cooling Physics
and Beam Transport
Burns, Patrick Colorado 82561 m723 S 10,000 1,000 Processing National Animal
State Identification System Data
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Cameron-Smith, P. Livermore Lab 82483 m411 500,000 300,000 Interaction of Atmospheric
Chemistry and Aerosols
with Climate
Canning, Andrew Berkeley Lab 82527 m619 S 20,000 1,000 EAD289C UC Davis graduate
course in Computational
Modelling
Canning, Andrew Berkeley Lab 82528 m126 300,000 20,000 Mathematical/Computational
Methods for Electronic
Structure Codes in
Nanoscience
Carlson, Joseph U. Washington 82224 m308 3,000,000 10,000 Low-Energy Nuclear Physics
National HPC Initiative:
Building a Universal
Nuclear Energy Density
Functional
Carrington, Laura SDSC 82675 m849 S 50,000 5,000 Using Performance Modeling
to Enable High-Frequency
Simulations of Global
Seismic Wave Propagation
Cassak, Paul West Virginia 82696 m866 S 50,000 5,000 Onset and Evolution of
Univ Magnetic Reconnection in
Three Dimensions
Cattaneo, Fausto U. Chicago 82537 m557 50,000 50,000 Magneto-rotational
instability and turbulent
angular momentum transport
Cessi, Paola Scripps Inst 82556 m699 14,625,00 5,000 The Role of Eddies in the
Meridional Overturning
Circulation
Chan, Yuen-Dat Berkeley Lab 82472 babar 70,000 Storage for Nuclear
e895 Physics Computations using
e896 PDSF at NERSC
mp46
na49 nsd
rhicthry
sno
Chan, Yuen-Dat Berkeley Lab 82541 majorana 20,000 Majorana - Neutrinoless
Double Beta Decay
Chang, Choong-Seock Courant Inst 82501 m499 4,000,000 100,000 Center for Plasma Edge
Simulation: SciDAC FSP
Prototype Center
Chelikowsky, James U. Texas 82378 m433 1,500,000 7,000 Scalable Methods for
Austin Electronic Excitations and
Optical Responses of
Nanosctructures:
Mathematics to Algorithms
to Observables
Chelikowsky, James U. Texas 82384 m175 500,000 5,000 Electronic, Magnetic and
Austin Structural Properties of
Localized Systems
Chen, Jacqueline Sandia Lab CA 82518 mp241 13,000,00 400,000 Direct Numerical
Simulations of Clean and
Efficient Combustion with
Alternative Fuels
Chen, Liu UC Irvine 82289 m92 2,500,000 10,000 Nonlinear Instability and
Turbulent Transport
Simulations
Chen, Yang U. Colorado 82320 mp118 1,000,000 2,000 Gyrokinetic simulation of
Boulder plasma microturbulence and
kinetic MHD phenomena
Chen, Yixin Washington 82560 m718 S 20,000 3,500 Efficient Large-Scale
Univ StLouis Nonlinear Constrained
Optimization Using
Constraint Partitioning
Cheng, Hai-Ping U. Florida 82409 mp261 1,000,000 5,000 Multiscale Simulations of
Particle-, Molecule-
Surface Interactions,
simulations of nanowires:
Structure, dynamics, and
quantum transport, and
structure and electronic
structure of cuprates
Childs, Hank Livermore Lab 82508 visit S 30,000 1,000 VisIt
Ching, Wai-Yim U. Missouri 82167 mp250 2,500,000 500 Theoretical Studies of the
KC Electronic Structures and
Properties of Complex
Ceramic Crystals and Novel
Materials
Chou, Mei-Yin Georgia Tech 82291 m663 80,000 5,000 Phase Stability and
Reaction Dynamics of Metal
Hydrides
Chou, Mei-Yin Georgia Tech 82292 mp258 140,000 5,000 First-Principles
Investigation of Complex
Materials Properties
Choudhary, Alok Northwestern 82668 m844 300,000 100 Parallel I/O software
infrastructure for large-
scale systems
Chow, Fotini UC Berkeley 82681 m859 50,000 5,000 atmospheric dispersion
modeling with large eddy
simulation
Chrzan, Daryl Berkeley Lab 82444 mp110 350,000 100 Computational Materials
Science
Chu, Jhih-Wei UC Berkeley 82601 m787 50,000 2,000 Multiscale Molecular
Modeling of Collagen
Fibers and its
Superstructures
Chuang, Catherine Livermore Lab 82248 m428 250,000 100,000 Aerosol Forcings and
Consequences on Climate
Changes
Cohen, Bruce Livermore Lab 82171 gc3 4,000,000 50,000 Magnetic Fusion Plasma
Microturbulence Project
Cohen, Bruce Livermore Lab 82172 mp2 500,000 30,000 LLNL MFE Supercomputing
Cohen, Marvin Berkeley Lab 82190 mp173 650,000 20,000 Ab Initio Prediction of
Structural and Electronic
Properties of Materials
Collins, William Berkeley Lab 82653 m833 S 50,000 10,000 Integrated Earth Systems
Climate Modeling and
Analysis
Colvin, Michael UC Merced 82245 m732 550,000 100 Comparative Study of
Unstructured Proteins
Using All-Atom and Coarse-
Grained Molecular Dynamics
Compo, Gil U. Colorado 82269 incite11 I 18,600,00 1,000,000 The 20th Century
Boulder Reanalysis Project
Comstock, Jennifer PNNL 82340 m738 500,000 8,000 Cloud Resolving Modeling
of Tropical Deep
Convection
Cramer, Stephen Berkeley Lab 82649 m828 S 50,000 2,000 Molecular Force Field and
DFT Calculations of Normal
Mode Structure in Fe-S
Cluster Enzymes
Craven, Mark U. Wisc. 82608 m804 250,000 100 Learning Inference of
Madison Probabilistic Models of
Gene-Regulatory Networks
Cui, Qiang U. Wisc. 82607 m803 750,000 500 Analysis and engineering
Madison of metal binding
selectivity in proteins
Cummings, Peter Vanderbilt 82261 mp138 500,000 5,000 Molecular-Based Simulation
Univ of Complex and
Nanostructured Fluids
Cummings, Peter Oak Ridge 82371 m535 600,000 5,000 Large scale quantum
transport: designing new
molecular electronic
devices at realistic
length scale
Curtiss, Larry Argonne 82454 m440 200,000 500 Catalytic Reaction
Mechanisms in Nanoporous
Membranes
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
D'Ippolito, Daniel Lodestar 82249 m376 500 500 Edge, SOL and Divertor
Corp. Modeling
Daggett, Valerie U. Washington 82376 m559 10,000,00 50,000 Molecular Dynameomics
Davidson, Ronald PPPL 82293 m74 400,000 10,000 Nonlinear Delta-f Particle
Simulation of Collective
Effects for Heavy Ion
Fusion Drivers and High
Intensity Particle
Accelerators
Davidson, Ronald PPPL 82492 m314 70,000 500 Simulations of Field-
Reversed Configuration and
Other Compact Tori Plasmas
Daw, Murray Clemson Univ 82304 m638 150,000 500 Theoretical modeling of
thermoelectric materials
De Jong, Wibe PNNL 82231 mp15 400,000 500 EMSL Molecular Science
Software Capability
Development, NERSC
Performance Improvement,
and Benchmarking
De Jong, Wibe PNNL 82658 m834 50,000 5,000 Modeling the Influence of
Solution Phase and
Interfacial Structure on
the Stability of Actinide
Oxidation States
DeWeaver, Eric U. Wisc. 82520 m431 50,000 15,000 Dynamics of Arctic and
Madison sub-Arctic climate and
atmospheric circulation:
diagnosis of mechanisms
and biases using data
assimilation
Dean, David Oak Ridge 82214 m203 1,500,000 1,000 Computational nuclear
many-body problem
Dean, Michael Nat Inst 82551 m724 S 20,000 1,000 Using HapMap Data for
Health Human Recombination
Mapping
Demmel, James UC Berkeley 82547 mp156 50,000 10,000 Linear Algebra Algorithms
on High Performance
Computers
Derenzo, Stephen Berkeley Lab 82523 m551 300,000 10,000 Electronic structure
calculations of new
scintillator materials
Detmold, William U. Washington 82475 m789 3,400,000 40,000 Physics of bottom baryons
in lattice QCD
Devereaux, Thomas SLAC 82426 m772 400,000 200 Simulation of Photon
Spectroscopies for
Correlated Electron
Systems
Diachin, Lori Livermore Lab 82611 m802 S 20,000 100 Iteroperable Technologies
for Advanced Petascale
Simulations
Diamond, Pat UC San Diego 82484 m786 3,500,000 50,000 Fusion SciDAC: Gyrokinetic
Particle Simulation of
Turbulent Transport in
Burning Plasmas
Dimitrov, Dimitre Tech-X Corp 82415 m446 120,000 6,600 3D Modeling of an Electron
Gun with a Diamond
Amplifier
Dobrovitski, V. Ames Lab 82235 m652 150,000 500 Quantum control of spin
dynamics
Doniach, Sebastian Stanford Univ 82490 m661 80,000 500 Electrostatic and
Conformational Entropy
Effects in Structured
Nucleic Acid Systems
Dorland, William UCLA 82286 m414 3,000,000 50,000 Fusion Science Center For
Multiscale Plasma Dynamics
Dorland, William U. Maryland 82422 mp217 2,500,000 200,000 Turbulence, Transport and
Magnetic Reconnection in
High Temperature Plasma
Dorr, Milo Livermore Lab 82441 m785 400,000 200,000 High-Resolution Methods
for Phase Space Problems
in Complex Geometries
Drake, John Oak Ridge 82571 m659 1,000,000 150,000 A Scalable and Extensible
Earth System Model for
Climate Change Science
Drazer, German Johns Hopkins 82678 m851 S 50,000 5,000 Separation of
Univ nanoparticles using
anisotropic microfluidic
devices: multiscale
simulations
Dunietz, Barry U. Michigan 82546 m467 50,000 100 Ab-initio design of
molecular scale electronic
devices and materials for
alternative fuel
technology.
Dupuis, Michel PNNL 82396 m544 400,000 1,000 Charge Transfer,
Transport, and Reactivity
in Complex Environments.
Dutoi, Anthony Northwestern 82624 m809 50,000 2,000 The Electron Dynamics
behind Molecular High
Harmonics Generation
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Elster, Charlotte Ohio Univ 82360 mp20 150,000 500 Three Nucleon Scattering
and Bound State
Calculations in Three
Dimensions
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Faller, Roland UC Davis 82354 m474 100,000 100 Polymers in confined
geometries
Fast, Jerome PNNL 82308 m754 200,000 190,000 Regional Multi-scale
Modeling of Aerosol
Radiative Impact on
Climate
Fawley, William Berkeley Lab 82218 mp197 2,000 100 Numerical Simulation of
Short-Wavelength Free-
Electron Lasers for Future
Light Sources
Felmy, Andrew PNNL 82544 mp119 500,000 100 Computational Studies in
Molecular Geochemistry
Feng, Wu-chun Virginia Tech 82554 m725 100,000 5,000 Scalable Genomic-Search
Software Architectures
Fleming, Graham Berkeley Lab 82424 mp364 500,000 15,000 Simulations of nonlinear
optical spectra and energy
transfer dynamics of
photosynthetic light-
harvesting complexes.
Fox-Rabinovitz, M. U. Maryland 82315 m527 500,000 400,000 Decadal Climate Studies
with Enhanced Variable and
Uniform Resolution GCMs
Using Advanced Numerical
Techniques
Franceschetti, A. NREL 82373 m352 300,000 100 Electronic excited states
in semiconductor quantum
dots
Freedman, Stuart Berkeley Lab 82367 kamland 4,000,000 Data Analysis and
Simulations for KamLAND
Freedman, Stuart UC Berkeley 82395 cuore 15,000 Data Analysis and
Simulation for the CUORE
Neutrinoless Double Beta
Decay Experiment
Freeman, Arthur Northwestern 82457 mp134 915,000 500 Electronic Structure and
Novel Properties in
Complex Oxides and Hetero-
interfaces
Fridlind, Ann NASA GISS 82665 m843 100,000 500 Arctic Stratus and
Tropical Deep Convection:
Integrating Measurements
and Simulations
Friedman, Alex Livermore Lab 82389 mp42 300,000 6,000 Simulation of intense
beams for heavy-ion-fusion
science
Fung, Inez UC Berkeley 82557 m189 1,000,000 60,000 Carbon Data Assimilation
with a coupled Ensemble
Kalman Filter
Furman, Miguel Berkeley Lab 82529 mp93 10,000 500 Beam dynamics issues in
the new high-intensity
particle colliders and
storage rings
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Galli, Giulia UC Davis 82525 m542 950,000 500 First principles
simulations of
nanostructures
Gao, Michael Carnegie 82613 m806 S 20,000 100 First Principles Design of
Mellon Al Alloys of High
Corrosion Resistance
Garfinkel, Alan UCLA 82250 m287 10,000 500 Mathematical Modeling of
Cardiac Arrhythmias
Garrett, Bruce PNNL 82499 mp329 1,500,000 500 Chemical reactivity,
solvation and multi-
component heterogeneous
processes in aqueous
environments
Gascon, Jose U. 82572 m601 20,000 500 Quantum Mechanical
Connecticut derivation of large scale
polarization effects in
bio-macromolecules:
Application to protein ion
channels and protein-
protein association.
Gatica, Silvina Howard Univ 82230 m667 S 10,000 100 Molecular Adsorption on
Nanostructures
Geddes, Cameron Berkeley Lab 82358 m558 10,000,00 100,000 Particle simulation of
laser wakefield particle
acceleration
Geissler, Phillip UC Berkeley 82314 m628 350,000 1,000 Rare but dramatic
evolutionary events in a
microscopic model of
protein-like chain
molecules
Gel, Aytekin Morgantown 82632 m813 S 20,000 1,000 Performance Improvement of
ETC MFIX with scalable linear
equation solvers (hypre)
Glimm, James SUNY Stony 82576 mp123 50,000 18,000 Front Tracking Simulations
Brook of DOE SciDAC priority
Problems
Gohar, Yousry Argonne 82217 m259 30,000 500 ANL Fusion Program
Goldschmidt, Yadin U. Pittsburgh 82246 m516 150,000 1,000 Simulations of flux lines
in high temperature
superconductors with
random pins
Gratta, Giorgio Stanford Univ 82168 saund S 8,000 Study of Acoustic
Underwater Neutrino
Detection
Gray, Stephen Argonne 82263 m430 800,000 5,000 Nanoscale Electrodynamics
Gray, Stephen Argonne 82264 mp166 150,000 5,000 Quantum Dynamics of
Chemical Reactions
Greene, Chris U. Colorado 82290 mp318 55,000 100 Molecular Dissociation by
Boulder Electron Impact
Grossman, Jeffrey UC Berkeley 82348 m655 1,500,000 1,000 Quantum Simulations of
Nanoscale Solar Cells
Grosvenor, Allan Ramgen Power 82633 m814 S 20,000 1,000 Accelerated Design Space
Sys Search and Optimization
for Computational Fluid
Dynamics Applications in
Turbomachinery
Guo, Hua U. New Mexico 82153 m627 400,000 100 Quantum dynamics of
combustion reactions
Guo, Jinghua Berkeley Lab 82545 m705 S 20,000 100 Electronics structure
study of hydrogen
adsorption on carbon
nanotubes and conductivity
in DNA
Gutowski, William Iowa State 82251 m612 85,000 5,000 Continuous Dynamic Grid
Adaptation in a Global
Atmospheric Model
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Haas, Stephan U. South 82519 m157 200,000 100 Quantum Spin Systems with
California Geometric Frustration in
High Magnetic Fields
Hammond, Jeff U. Chicago 82256 m750 250,000 100 QM/MM simulation of
nonlinear optical and
Raman spectroscopy of
molecules in solution
using coupled-cluster
response theory
Harmon, Bruce Ames Lab 82400 mp344 1,500,000 500 Electronic and structural
properties of surfaces and
interfaces
Harmon, Bruce Ames Lab 82476 mp101 50,000 500 Photonic Band Gap
Materials
Harris, Charles UC Berkeley 82306 m399 300,000 500 Computational Modeling and
Simulation of
Organometallic Complexes
in Solution
Hastings, Gary Georgia State 82646 m825 S 20,000 2,000 Calculation of the
chemical properties of
cofactors involved in
solar energy conversion in
photosynthetic reaction
centers
Head-Gordon, Martin Berkeley Lab 82265 mp54 1,000,000 1,000 Electronic structure and
simulation calculations of
reactive chemical systems
Head-Gordon, Teresa Berkeley Lab 82278 m506 750,000 1,000 Simulation Studies of Bulk
Water and Hydration Water
at Interfaces
Head-Gordon, Teresa UC Berkeley 82279 mp53 1,500,000 1,000 New Global Optimization
Approaches for Protein
Structure Prediction
Head-Gordon, Teresa UC Berkeley 82471 m657 1,500,000 1,000 Advanced Theoretical
Models to Characterize the
Alzheimers Abeta Peptide
Head-Gordon, Teresa Berkeley Lab 82500 m707 S 10,000 2,000 BE143/243: Class
Competition in Molecular
Simulation
Held, Eric Utah State 82448 m127 300,000 1,000 Application of Parallel
Kinetic Closures in NIMROD
for Fusion Plasma
Simulations
Hingerty, Brian Oak Ridge 82311 mp106 500 1,000 Crystallographic, NMR and
Molecular Modeling
Calculations of
Carcinogen Modified DNA,
Protein-DNA
Complexes and Cyclodextrin
Inclusion Complexes
Ho, Kai-Ming Ames Lab 82402 m529 300,000 600 Multiscale Studies of the
Formation and Stability of
Surface-Based
Nanostructures (a CMSN
Project)
Hoffmann, Roald Cornell Univ 82670 m846 S 50,000 5,000 Computational Studies of
Geometric and Electronic
Structures of Catalysts
under Uniaxial Stress
Hwang, David UC Davis 82629 m807 S 20,000 500 Computer Simulation of the
UC Davis Compact Toroid
(CTIX) Accelerator
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Im, Hong U. Michigan 82273 incite12 I 2,000,000 500,000 Direct Numerical
Simulation of Turbulent
Flame Quenching by Fine
Water Droplets
Im, Hong U. Michigan 82346 m217 1,000,000 50,000 High-Fidelity Direct
Numerical Simulations of
Turbulent Combustion with
Soot, Radiation, and Spray
Interaction
Izzo, Valerie General 82433 m455 600,000 100 Disruption and disruption
Atomics mitigation simulations
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Jacobs, Peter Berkeley Lab 82202 alice 50,000 500,000 Data analysis and
simulations for the ALICE
experiment at the LHC
Jardin, Stephen PPPL 82178 mp288 4,000,000 10,000 3D Extended MHD simulation
of fusion plasmas
Jardin, Stephen PPPL 82194 mp286 250,000 10,000 Analysis and Design of
Stellarator Configurations
Jardin, Stephen PPPL 82386 mp287 500,000 4,000 Magnetic Reconnection
Studies and Pellet
Injection in Tokamaks
using AMR
Jellinek, Julius Argonne 82347 m196 480,000 500 Structure, Energetics and
Dynamics of Metal,
Including Alloy,
Nanoparticles;
Interactions of Clusters
with Molecules and
Surfaces
Jena, Puru Virginia Comm 82671 m847 1,000,000 500 Carbon-based materials for
Univ high density hydrogen
storage
Ji, Chueng Ryong North 82258 m230 2,000 5,000 Quantum Chromodynamic
Carolina Analysis of Hadron
State Structure and Application
to Cosmology
Jiang, De-en Oak Ridge 82184 m697 350,000 350 Computational study for
chemistry of novel
separations
Johnson, Donald U. Wisc. 82455 m167 75,000 14,000 Coupled Climate -
Madison Chemistry Modeling
Juang, Henry NOAA 82312 m685 S 20,000 1,000 Ensemble Regional Seasonal
Forecast over USA by NCEP
Regional Spectral Model
Judd, Eleanor UC Berkeley 82319 euso 2,000 Extreme Universe Space
Observatory
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Kalinichev, Andrey Michigan 82594 m645 70,000 100 Molecular Dynamics of
State Geologically Important
Fluids and Mineral-Fluid
Interfaces
Karplus, Martin Harvard Univ 82232 gc8 1,500,000 70,000 Simulating biological
processes of interest to
biofuels, including
chemomechanical coupling
in ATP regulated molecular
motors, fidelity in DNA
replications, structure-
function relationships,
free energies and
dynamical coupling in
signal transduction.
Katsouleas, Thomas U. South 82196 mp275 150,000 1,000 Program for Plasma-Based
California Concepts for Future High-
Energy Accelerators
Kenny, Joseph Sandia Lab CA 82654 m832 S 25,000 500 Chemistry Framework using
Common Component
Architecture
Kent, Paul Oak Ridge 82577 m526 12,500,00 25,000 Computational Resources
for the Nanomaterials
Theory Institute at the
Center for Nanophase
Materials Sciences
Kerr, Christopher NOAA GFDL 82697 m865 50,000 1,000 Scaling Studies of the
Modular Ocean Model and
the Cubed-Sphere
Atmospheric Model.
Ketterson, John Northwestern 82627 m800 46,000 100 Sensors based on plasmon-
resonant hole arrays
Keyes, David Columbia Univ 82596 m125 10,000 100 Towards Optimal Petascale
Simulations
Kim, Kwiseon NREL 82401 m514 300,000 100 Electronic structure and
reactivity of FeFe-
hydrogenase
metalloclusters
Kim, Kwiseon NREL 82491 m322 550,000 5,000 Nanoscience Parallel
Optimization Algorithms
Kiryluk, Joanna Berkeley Lab 82488 icecube 7,000 Simulation and Analysis
for IceCube
Klein, Richard UC Berkeley 82332 m231 1,000,000 70,000 Low-Mass Star Formation
with Radiative Transfer
Ko, Kwok SLAC 82201 m349 1,050,000 10,000 Advanced Modeling for
Particle Accelerators
Kogan, Boris UCLA 82206 mp66 25,000 500 Fibrillation and
defibrillation of cardiac
simulated tissue in the
presence of Ca-induced
early and delayed after
depolarizations.
Koplik, Joel City College 82298 mp247 270,000 20,000 Particulate transport in
NY self-affine fractures
Kotamarthi, V. Rao Argonne 82562 m184 50,000 1,000 High-Spatial Resolution
Models of Atmospheric
Chemistry, Aerosols for
Regional Scale Climate
Simulations
Krakauer, Henry William & 82578 m393 200,000 100 Quantum Monte Carlo
Mary studies
Kral, Petr U. Illinois 82199 m624 600,000 100 Multiscale Modeling of
Chicago Molecular Transport in
Nanofluidic Systems
Kramer, William NERSC 82377 noexp 1,000 20,000 NERSC overhead account for
norepo users with no active repo
Kramer, William Berkeley Lab 82618 mphpcd 20,000 1,000 NERSC High Performance
Computing Department Guest
Accounts
Kritz, Arnold Lehigh Univ 82414 m649 400,000 8,000 Integrated modeling
simulations for the plasma
edge
Kronik, Leeor Weizmann Inst 82570 m716 150,000 1,800 GW calculations of
Science magnetic materials
Kronik, Leeor Weizmann Inst 82636 incite17 I 810,000 20,000 Understanding the
Science electronic structure of
novel electronic materials
using many-body
perturbation theory
Krueger, Steven U. Utah 82532 m205 20,000 10,000 Simulating Cloud Systems
Kruger, Scott Tech-X Corp 82460 m681 100,000 50,000 Fusion Application for
Core-Edge Transport
Simulations
Kruger, Scott Tech-X Corp 82470 mp21 1,500,000 12,000 NIMROD Project: Extended
Magnetohydrodynamic
Modeling for Fusion
Experiments
Kurien, Susan Los Alamos 82650 m829 S 50,000 5,000 Numerical Study of
Lab Multiscale Coupling in
Low-Aspect Ratio Rotating
Stratified Turbulence
Kwon, Young-Kyun UMass Lowell 82453 m775 100,000 4,000 Structural and Optical
Properties of Novel
Nanostructured Materials
for Sustainable Energy
Application
Kwon, Young-Kyun UMass Lowell 82458 m599 150,000 6,000 Computational Modeling and
Design for Nanotechnology
and Nanomanufacturing.
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Lacis, Andrew NASA GISS 82439 m238 20,000 500 Theoretical Calculation of
Water Vapor Continuum
Absorption
Lamarque, J. NCAR 82503 m330 500,000 25,000 Simulation of 20th-century
and 21st-century climate
and composition with
interactive chemistry in
CAM3: identifying the role
of climate and climate
composition in observed
trends and air quality
Lamb, Don U. Chicago 82513 m815 3,000,000 1,000,000 Validation Study of
Fundamental Properties of
Type Ia Supernovae Models
Landman, Uzi Georgia Tech 82243 mp97 350,000 30,000 Quantum and classical
simulations of clusters,
self-assembly. nano-scale
manupulations,
nanotribology, and
biological processes
Langston, Michael U. Tennessee 82391 m760 50,000 1,000 Scalable Computational
Methods for the Analysis
of High-Throughput
Biological Data
Lany, Stephan NREL 82438 m777 S 50,000 500 Designing New Materials
for Water Splitting from
Solid Solutions of
Semiconductor Compounds
Leboeuf, Jean-Noel UCLA 82257 mp28 200,000 20,000 Fusion Plasma Modeling
Using 3-D Particle-In-Cell
Simulations at UCLA
Leboeuf, Jean-Noel U. Alaska 82283 m616 50,000 10,000 Gyrokinetic Studies of
Non-Diffusive Transport
Leboeuf, Jean-Noel UCLA 82285 mp201 50,000 50,000 Turbulent and MHD behavior
of plasmas
Lee, Frank George Wash 82478 m102 800,000 400,000 Hadron Physics from
Univ Lattice Quantum
Chromodynamics
Lee, T. S. Harry Jefferson Lab 82239 m615 500,000 500 Dynamical Coupled-channel
Analysis of Nucleon
Resonances at Excited
Baryon Analysis Center
Lee, Wei-li PPPL 82403 mp19 6,000,000 40,000 Turbulent Transport and
Multiscale Gyrokinetic
Simulation
Lee, Xuhui NCAR 82329 m640 4,000,000 100,000 Influences of the Boundary
Layer Flow on Vegetation-
Air Exchanges of Energy,
Water and Carbon Dioxide
Lele, Sanjiva Stanford Univ 82661 m837 20,000 2,000 Simulations of turbulent
flows with strong shocks
and density variations
Lester, William Berkeley Lab 82253 mp208 8,000,000 2,000 Quantum Monte Carlo for
Electronic Structure of
Molecules
Lester, William Berkeley Lab 82254 m518 2,000,000 2,000 Application of Quantum
Monte Carlo Methods to
Biological Systems
Leung, Lai-Yung Ruby PNNL 82581 m546 100,000 40,000 North American Regional
Climate Change Assessment
Project (NARCCAP)
Li, Rui Jefferson Lab 82461 m728 150,000 1,000 Computer simulation
studies of electron
cooling and beam-beam
interaction for the
Electron-Ion Collider
based on CEBAF
Li, Rui Jefferson Lab 82462 mp159 5,000 100 Effects of Coherent
Synchrotron Radiation on
Accelerator Performance
and beam-beam simulations
Lin, Shi Ying U. New Mexico 82584 m740 S 20,000 500 Quantum dynamical study
for photodissociation of
NH3
Lin, Yu Auburn Univ 82275 m206 70,000 100 Gyrokinetic Electron and
Fully Kinetic Ion Particle
Simulation of
Collisionless Magnetic
Reconnection
Lin, Zhihong UC Irvine 82623 m808 5,000,000 100,000 SciDAC GSEP: Gyrokinetic
Simulation of Energetic
Particle Turbulenc and
Transport
Liu, Da-Jiang Ames Lab 82630 m812 100,000 500 Analysis of energetics and
kinetics of processes on
metal surfaces (single-
component crystals and
multi- component alloys)
Liu, Feng U. Utah 82370 m284 200,000 2,000 Tuning of Band Gap and
Charge Carrier Mobility by
Strain Engineering and
Mechanical Modification of
Organic Semi-Conducting
Molecules
Liu, Feng U. Utah 82674 m850 700,000 2,000 Quantum Modulation of
Surface Mass Transport and
Controlled Growth of
Nanoscale Metal Thin Films
Liu, Keh-Fei U. Kentucky 82227 mp7 15,000,00 1,500,000 Lattice QCD Monte Carlo
Calculation of Hadron
Structure and Spectroscopy
Liu, Ping Brookhaven 82673 catalyst 50,000 5,000 Computational studies of
Lab m848 supported nanoparticles in
heterogeneous catalysis
Loken, Stewart Berkeley Lab 82222 atlasdc 100,000 ATLAS Data Challenges
Loken, Stewart Berkeley Lab 82223 atlas 30,000 Simulation of ATLAS
Physics
Long, Charles PNNL 82173 m726 680,000 100,000 Simulating the tropical
cloud-climate interactions
during the TWPICE
experiment period with the
weather research and
forecasting model
Louie, Steven Berkeley Lab 82191 mp149 1,000,000 20,000 Computation of Electronic
Properties of Materials
from First Principles
Loveland, Walter Oregon State 82170 m136 40,000 200,000 Theoretical predictions
for superheavy elements
(SHE) using Relativistic
Coupled-Cluster method
Luk, Kam-Biu Berkeley Lab 82565 dayabay 30,000 Daya Bay Reactor Neutrino
Experiment
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Ma, Chung-Pei UC Berkeley 82510 m289 120,000 2,000 Evolution of Massive
Galaxies and Black Holes
Ma, Kwan-Liu UC Davis 82663 m842 S 50,000 10,000 Ultrascale Visualization
Makino, Kyoko Michigan 82359 m509 500,000 40,000 Modern Map Methods in
State Particle Beam Physics
Manson, Steven Georgia State 82228 m497 40,000 5,000 Inner and Outer Shell
Photoabsorption by
Positive and Negative Ions
and Neutral Atoms
Mao, Shaolin NCAR 82514 m646 S 50,000 5,000 Numerical simulation of
sub-canopy drainage flow
and their influence on
above-canopy measurements
Marques, Osni Berkeley Lab 82564 m340 44,000 100 Installation, Testing and
Evaluation of ACTS Tools
Mascarenhas, Angelo NREL 82465 mp306 100,000 4,000 Electronic structure of
non-conventional
semiconductor alloys and
nanostructures
Masunov, Artem U. Central 82580 m513 200,000 1,000 Design of nonlinear
Florida optical materials with
enhanced two- and three-
photon absorbing
properties
Mavrikakis, Manos U. Wisc. 82421 mp351 1,920,000 100 First-Principles Catalyst
Madison Design for Environmentally
Benign Energy Production
McCurdy, C. William Berkeley Lab 82447 mp74 225,000 1,500 Electron and Photon
Collisions with atoms and
molecules
Medvedeva, Julia U. Missouri 82526 m742 200,000 100 Multicomponent oxides as
Rolla novel transparent
conductors
Mei, Donghai PNNL 82301 m752 2,000,000 5,000 Computational Studies on
the Reactivity, Reaction
Mechanism and Kinetics of
Catalytic Systems
Mei, Donghai PNNL 82383 m761 50,000 1,000 First principles based
modeling of substrate
effect on reactivity of
supported transition metal
oxide catalysts
Menon, Surabi Berkeley Lab 82302 m464 20,000 100 Cloud Physics
Parameterizations for
arctic stratus and
convective cloud systems
Mezzacappa, Anthony Oak Ridge 82387 m764 4,000,000 250,000 Multidimensional
Simulations of Core
Collapse Supernovae
Mikkelsen, David PPPL 82410 m64 2,500,000 10,000 Experimental Tests of
Gyrokinetic Simulations of
Microturbulence
Militzer, Burkhard UC Berkeley 82369 m744 50,000 100 First-principles
simulation of hydrogen-
helium mixtures at high
pressure
Miller, Doug UNC Asheville 82215 m550 20,000 20,000 Follow on to Forecasting
Coupled Meteorology and
Air Quality at Very High
Resolutions
Miller, Thomas Cal Tech 82644 m822 S 20,000 500 Sampling diffusive
dynamics on long
timescales, and simulating
the coupled dynamics of
electrons and nuclei
Miller, William UC Berkeley 82152 mp14 800,000 500 Semiclassical approaches
for condensed matter
dynamics and for molecular
reaction dynamics
Miner, William SAI McLean 82652 m831 S 50,000 500 Free Electron Laser
Simulation
Mitchell, Julie U. Wisc. 82466 m780 250,000 500 Protein Engineering of
Madison Cellulases and Other
Bioenergy Bottlenecks
Mitchell, Julie U. Wisc. 82605 m801 350,000 500 High Performance Protein
Madison Docking Codes and
Cellulosome Assembly
Mori, Warren UCLA 82272 incite14 I 6,000,000 50,000 Petascale Particle-in-Cell
Simulations of Plasma
Based Accelerators
Mori, Warren UCLA 82333 mp113 500,000 70,000 continuing studies of
plasma based accelerators
Mori, Warren UCLA 82381 m412 800,000 25,000 Investigations of fast
ignition physics and
extreme states of matter
Morris, James Oak Ridge 82267 m435 80,000 500 Atomistic modeling of
novel alloy behavior
Muckerman, James Brookhaven 82477 m783 1,200,000 30,000 Computational Studies at
Lab BNL of the Chemistry of
Energy Production and Use
Mukamel, Shaul UC Irvine 82185 m639 75,000 250 Probing Vibrational and
Electronic Dynamics
through Nonlinear
Spectroscopy
Mundy, Christopher PNNL 82328 m452 1,500,000 1,000 Novel density functional
theory approaches to the
statistical mechanics of
hydrogen bonded systems
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Najm, Habib Sandia Lab CA 82425 m401 135,000 500 A Computational Facility
for Reacting Flow Science
Neff, Jason U. Colorado 82555 m745 S 20,000 1,000 The Role of Boreal and
Boulder Arctic Soils in Climate
Feedbacks; Model
Development and Testing
Negele, John MIT 82406 mp133 1,000,000 180,000 Exploration of Hadron
Structure using Lattice
QCD
Nelson, Brian U. Washington 82427 m172 250,000 4,000 Helicity Injected Torus
Current Drive and Compact
Toroid Studies
Nelson, Brian U. Washington 82429 m489 600,000 4,000 The Plasma Science and
Innovation Center
Nemeth, Karoly Argonne 82487 m634 400,000 300 Parallel Computation for
Laser Plasma Interactions
at Relativistic
Intensities
Newman, Gregory Berkeley Lab 82437 m372 1,000,000 100 Large Scale 3D Geophsycial
Inversion & Imaging
Ng, Cheuk-Yiu UC Davis 82198 m319 280,000 100 State-of-the-Art ab initio
Calculations of Energetics
and Spectroscopic
Properties of Molecular
Neutrals/Cations/Radicals
for Comparison with Highly
Accurate Experimental
Measurements
Ng, Esmond Berkeley Lab 82353 mp127 60,000 2,500 High Performance Sparse
Matrix Algorithms
Nolen, Jerry Argonne 82259 mp362 400,000 80,000 Radioactive Beam
Facilities - Target,
Shielding, Fragment
Separators and Accelerator
Studies
Notaro, Michael U. Wisc. 82412 m731 125,000 40,000 Ecosystem response to
Madison future climate change and
the impact of vegetation
feedback in the Southwest
United States
Nozik, Arthur NREL 82236 m72 200,000 20,000 Experimental and
Theoretical Studies of
Semiconductor Systems for
Improved Solar Energy
Technologies
Nugent, Peter Berkeley Lab 82388 m779 50,000 800,000 Baryon Oscillation
Spectroscopic Survey
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Odette, G. Robert UC Santa 82375 m720 150,000 50,000 Multiscale Ab-Initio
Barbara Modeling and Simulation of
Manoclusters in Advanced
Ferretic Alloys
Odyniec, Grazyna Berkeley Lab 82451 gc5 ppdg 4,000,000 STAR Detector Simulations
rhstar and Data Analysis
Oefelein, Joseph Sandia Lab CA 82154 m295 1,000,000 100,000 Large Eddy Simulation of
Turbulence-Chemistry
Interactions in Reacting
Multiphase Flows
Ogut, Serdar U. Illinois 82313 m567 300,000 10,000 Optical Properties of
Chicago Noble Metal Clusters from
First Principles
Oliker, Leonid Berkeley Lab 82548 m650 200,000 200 Scientific Application
Performance on Candidate
PetaScale Platforms
Orginos, Kostas William 82334 m762 3,500,000 50,000 Electromagnetic properties
& Mary of resonances.
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Parvin, Bahram Berkeley Lab 82233 lowdose S 20,000 700,000 Mechanism of DNA Damage
m823 and Repair Nuclear
Imaging of Gene Expression
Penner, Joyce U. Michigan 82188 mp231 250,000 87,000 Three-dimensional Global
Atmospheric Aerosol and
Chemistry Modeling
Pennycook, Stephen Oak Ridge 82416 mp221 350,000 700 Numerical Simulations of
Interfaces, Grain
Boundaries, and
Nanocrystals
Perlmutter, Saul Berkeley Lab 82522 m219 225,000 140,000 SNAP Simulation and
snap Analysis
Perlmutter, Saul Berkeley Lab 82524 deepsrch 250,000 Optimal Photometric
Reduction of Supernova
Images for Cosmological
Measurements
Pfreundt, F. Fraunhofer 82452 m282 10,000 1,000 Integrated Performance
ITWM Germany Analysis of Distributed
Computer Systems
Phillips, Carolyn U. Michigan 82682 m857 S 50,000 2,000 Impact of polydispersity
on the phase diagram of
the tethered nanoparticle
system
Pieper, Steven Argonne 82372 mp26 200,000 40,000 Exact Calculations of
Light Nuclei, Nucleonic
Matter and Electroweak
Interactions Using
Realistic Interactions
Pinar, Ali Berkeley Lab 82435 m674 S 10,000 500 Algorithms for Discrete
and Continuous
Optimization
Pindzola, Michael Auburn Univ 82162 m41 4,000,000 10,000 Computational Atomic
Physics for Fusion Energy
Plewa, Tomasz Florida State 82531 m461 400,000 300,000 Thermonuclear Supernovae:
Stellar Explosions in
Three Dimensions
Poppitz, Erich U. Toronto 82685 m858 S 50,000 500 Lattice Chiral Gauge
Canada Theory and Decoupling of
Mirror Fermions
Pordes, Ruth Fermilab 82363 m670 osg 600,000 200,000 Extending the Open Science
Grid
Potter, Gerald Livermore Lab 82327 mp193 800,000 2,000,000 Program for Climate Model
Diagnosis and
Intercomparison
Pratt, Larry Fisk Univ 82549 incite9 I 900,000 500 Reactions of lithium
carbenoids, lithium
enolates, and mixed
aggregates
Primack, Joel UC Santa Cruz 82405 mp363 975,000 150,000 Galaxy Formation
Simulations
Prinz, Fritz Stanford Univ 82361 m622 250,000 50 Solid oxide materials for
next generation renewable
energy applications
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Qiang, Ji Berkeley Lab 82637 incite18 I 5,000,000 20,000 Beam Delivery System
Optimization for X-Ray
Free Electron Lasers
Quinlan, Daniel Livermore Lab 82732 ROSE S 35,000 500 ROSE
m871
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Rajopadhye, Sanjay Colorado 82679 m853 S 55,000 5,000 Introduction to Parallel
State Processing (Education)
Ram, Abhay MIT 82397 m224 2,000,000 50,000 Computational studies in
plasma physics and fusion
energy
Randall, David Colorado 82467 m328 1,000,000 30,000 Global cloud modeling
State
Randall, David Colorado 82638 incite19 I 1,000,000 5,000,000 Simulation of Global
State Cloudiness
Rashkeev, Sergey Idaho 82393 m647 200,000 50 Numerical Simulations of
National Lab Defects and Chemical
Reactions at Surfaces and
Interfaces
Ratcliff, Jay US Army Corps 82498 m566 500,000 500 Coastal Storm Surge
Engr MVN Analyses
Rauchwerger, LawrenceTexas A&M 82530 m493 70,000 500 SmartApps: Middle-ware for
Univ Adaptive Applications on
Reconfigurable Platforms
Ray, Asok U. Texas 82216 m701 1,000,000 1,000 A Fully Relativistic
Arlington Density Functional Study
of the Role of 5f
Electrons in Chemical
Bonding in Transuranium
Elements
Reboredo, Fernando Oak Ridge 82505 m337 400,000 500 First Principles
Simulations of
Nanostructured Materials
under Pressure
Rehr, John U. Washington 82351 mp313 50,000 500 High Performance
Computation of Photon
Spectroscopies and
Electronic Excited States
Reichler, Thomas U. Utah 82186 m730 20,000 15,000 Dynamics and Variability
of the Coupled
Stratosphere-Troposphere
System
Ren, Chuang U. Rochester 82390 m792 400,000 10,000 Study of laser-plasma
interactions relevant to
direct-drive ICF
implosions
Ren, Chuang U. Rochester 82634 incite15 I 2,000,000 400,000 Three-Dimensional
Particle-in-Cell
Simulations of Fast
Ignition
Riley, Pete SAI San Diego 82573 m700 S 20,000 5,000 High-Resolution
Simulations of Coronal
Mass Ejections and the
Ambient Structure of the
Solar Corona
Rinke, Patrick UC Santa 82684 m856 S 40,000 2,000 First principles
Barbara characterization of
materials for
photovoltaics and energy
efficient lighting
Roche, Kenneth Oak Ridge 82569 m397 20,000 100 Software Effectiveness
Metrics
Rogers, Barrett Dartmouth 82664 m841 50,000 10,000 Gyrokinetic Simulations of
College Fusion Plasmas
Rollett, Tony Carnegie 82266 mp262 500,000 1,000 Microstructural Evolution
Mellon Based on Fundamental
Interfacial Properties: a
DOE sponsored
Computational Materials
Science Network
Romanowicz, Barbara UC Berkeley 82207 m554 500,000 500 Calibration of 3D Upper
Mantle Structure in
Eurasia Using Regional and
Teleseismic Full Waveform
Seismic Data
Rubin, Edward JGI 82362 m342 20,000 1,330,000 Optimizing Genomic Data
Storage for Wide
Accessibility
Ryne, Robert Berkeley Lab 82225 m669 950,000 50,000 Frontiers in Accelerator
Design: Advanced Modeling
for Next-Generation BES
Accelerators
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Saad, Yousef U. Minnesota 82241 m684 100,000 1,000 Pseudopotential Algorithm
for Real Space Electronic
Calculations
Sallerson, Amber UNC Chapel 82669 m845 S 50,000 5,000 Simulating Multiphase
Hill Transport Phenomena in
Porous Medium Systems
Saravanan, RamalingamTexas A&M 82296 m788 200,000 20,000 High-resolution Coupled
Univ Regional Climate Modeling
in the Atlantic
Savage, Martin U. Washington 82240 m747 4,000,000 130,000 Hadron-Hadron Interactions
with Lattice QCD
Saykally, Richard UC Berkeley 82309 m696 800,000 5,000 X-ray Absorption Spectra
of Aqueous Solutions from
First Principles
Calculations
Schaefer, Henry U. Georgia 82449 m170 800,000 500 Computations of Properties
to Chemical Accuracy
Schatz, George Northwestern 82643 m826 S 50,000 500 Modeling optical
properties of metal
particle arrays
Scheibe, Timothy PNNL 82247 m749 500,000 10,000 Hybrid Numerical Methods
for Multiscale Simulations
of Subsurface
Biogeochemical Processes
Schiavilla, Rocco Jefferson Lab 82305 m69 70,000 100 Electroweak Structure of
Light Nuclei
Schuchardt, Karen PNNL 82563 m706 S 50,000 2,000 Community Access to Global
Cloud Resolving Model Data
and Analyses
Schultz, David Oak Ridge 82163 mp48 500,000 3,000 Theoretical Atomic Physics
for Fusion Energy
Seidel, Edward Louisiana 82430 m152 2,000,000 100,000 Physics of Binary Black
State Hole Mergers
Seki, Ryoichi CSU 82496 m451 725,000 5,000 nuclear lattice
Northridge calculation
Selloni, Annabella Princeton 82660 m836 500,000 900 Theoretical Research
Univ Program on Bio-inspired
Inorganic Hydrogen
Generating Catalyst and
Electrodes
Shang, Shunli Penn State 82497 m679 200,000 50,000 First-principles
investigations of phonon
and mechanical properties
of Ni-based alloys
Shapiro, Marjorie Berkeley Lab 82592 cdf 40,000 Physics Analysis of CDF
fermi (Collider Detector at
Fermilab) Data
Shay, Michael U. Delaware 82480 m733 400,000 16,000 Kinetic Physics of
Magnetic Reconnection
Shigemitsu, Junko Ohio State 82295 mp268 200,000 50,000 Heavy-Light Physics with
NRQCD Heavy and Improved
Staggered Light Quarks
Simon, Horst Berkeley Lab 82619 mphpcrd 20,000 1,000,000 CRD High Performance
Computing Research
Department Guest Accounts
Simon, Horst Berkeley Lab 82657 mp309 S 50,000 5,000 Class Account for UCB
CS267 / CS194
"Applications of Parallel
Computing"
Sinclair, Donald Argonne 82268 mp27 6,000,000 80,000 Lattice Gauge Theory
Simulations
Skinner, David Berkeley Lab 82628 m629 S 20,000 1,000 Integrated Performance
Monitoring of HPC
Workloads
Smoot, George Berkeley Lab 82408 astrogfs 70,000 Large Astrophysical Data
Sets: Data analysis and
simulation of astro-
physical neutrinos, dark
matter and dark energy in
AMANDA, IceCube and SNAP
Snurr, Randall Northwestern 82212 m538 180,000 100 Molecular Modeling of
Oxidation and Reduction
Reactions in Zeolites and
Metal-Organic Frameworks
Snyder, Philip General 82399 mp94 1,400,000 50,000 Simulation of Magnetically
Atomics Confined Fusion Plasmas
Sosonkina, Masha Ames Lab 82468 m419 60,000 5,000 Interoperable software for
modern high-performance
applications
Souza, Ivo UC Berkeley 82310 m755 50,000 2,000 Magnetic and optical
properties of solid and
liquid metals from first-
principles
Sovinec, Carl U. Wisc. 82436 mp200 2,000,000 2,000 Fluid and Hybrid Modeling
Madison of Electromagnetic
Activity in MFE Plasmas
Spentzouris, P. Fermilab 82463 m778 5,000,000 31,000 Community Petascale
Project for Accelerator
Science and Simulation
Spera, Frank UC Santa 82445 m178 200,000 5,000 Large-Scale Molecular
Barbara Dynamics of Geomaterials:
The Glass Transition,
Nanoscale Structure-
Property Correlations,
Shock Wave Simulations and
Role of Water on Liquid
Properties at High-
Pressure and Applications
to Earth and Planets
Spong, Don Oak Ridge 82287 mp202 700,000 10,000 Plasma Confinement,
Stability, Heating and
Optimization in
Stellarators and Tokamaks
Sposito, Garrison Berkeley Lab 82183 mp47 1,035,000 1,000 Clay Mineral Surface
Geochemistry
Sprangle, Phillip Naval 82419 mp343 2,000,000 500 High Energy Laser-Driven
Research Lab Acceleration Based on the
Laser Wakefield
Accelerator
Stocks, G. Malcolm Oak Ridge 82431 m641 6,000,000 10,000 Computational Materials
Theory
Straus, David George Mason 82442 m773 1,250,000 100,000 Interactive Ensemble and
Univ Climate Change
Striolo, Alberto U. Oklahoma 82234 m530 200,000 100 Interfacial Phenomena:
Aqueous Systems at Solid-
Fluid Interfaces
Striolo, Alberto U. Oklahoma 82262 m751 45,000 100 Intelligent Simulation-
Assisted Catalyst Design
Strohmaier, Erich Berkeley Lab 82489 m283 50,000 50 Performance
Characterization and
Benchmarking of HPC
Systems
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Tainer, John Berkeley Lab 82717 m870 S 50,000 500 Solution structure
modeling for small angle
X-ray scattering
Tang, Xianzhu Los Alamos 82574 mp204 900,000 5,000 nonlinear studies of
Lab magnetically confined
plasmas
Tang, Xianzhu Los Alamos 82575 m139 250,000 500 Nonlinearly implicit MHD
Lab and two-fluids simulation
of fusion plasmas
Thakur, Bhupender U. Delaware 82288 m673 S 20,000 500 Density Matrix
Renormalization Group
method for Large scale
nuclear structure
calculations.
Thirumalai, Dave U. Maryland 82558 m704 60,000 500 Understanding function of
biological nanomachines
Tillett, Jason U. Rochester 82614 m799 S 50,000 1,000 Large Scale Bio-acoustic
Propagation Simulator
Tokmakian, Robin Naval PS 82459 m528 120,000 1,000 Decadal to century coupled
ocean/ice simulations at
high resolution (0.20)
Toon, Owen U. Colorado 82323 mp192 360,000 7,000 Large-eddy simulations of
Boulder aerosol-cloud interactions
Toussaint, Doug U. Arizona 82274 mp13 30,000,00 50,000 Quantum Chromodynamics
with three flavors of
dynamical quarks
Tysinger, Thomas Fluent Inc. 82271 incite10 I 1,000,000 100,000 CAE Simulation of full
vehicle Windnoise and
other CFD phenomena
Tyson, Trevor New Jersey IT 82610 m805 100,000 1,000 Constrained Structural
Optimization of Complex
Metal Oxides
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Vahala, George William & 82208 mp32 2,500,000 200,000 Lattice Boltzmann
Mary Simulations for Plasmas
Vanderbilt, David Rutgers Univ 82482 m784 120,000 5,000 Strained Films of
Ferroelectric Alloys
Vary, James Iowa State 82418 m94 4,000,000 20,000 Structure and Reactions of
Hadrons and Nuclei; Non-
perturbative Solutions of
Strongly Interacting
Particles and Fields
Vladimirova, Natalia U. Chicago 82698 m867 S 50,000 5,000 Rayleigh-Taylor (RT)
unstable flames: adapting
Nek5000 code for
fundamental studies of
reactive turbulence in
RT-unstable flames.
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Wang, Cai-Zhuang Ames Lab 82407 m769 300,000 400 Ab initio molecular
dynamics simulation of
metallic liquid and glass
Wang, Haobin New Mexico 82321 m93 1,500,000 1,000 Quantum Dynamical Study of
State Charge and Energy Tranfer
Processes in the Condensed
Phase
Wang, Jun U. Central 82648 HP-IO S 50,000 5,000 A Lightweight, High-
Florida m827 performance I/O Management
Package for Data-intensive
Computing
Wang, Lin-Wang Berkeley Lab 82494 mp304 2,500,000 60,000 Large scale nanostructure
electronic structure
calculations
Ware, Andrew U. Montana 82440 mp205 1,000,000 200 Theory of Turbulent Heat
and Particle Fluxes in ExB
Shear Flow and
Computational Modeling of
the Stability of Novel
Stellarators
Washington, Warren NCAR 82226 mp9 30,000,00 4,000,000 Climate Change Simulations
with CCSM3: Moderate and
High Resolution Studies
Washington, Warren NCAR 82639 incite20 I 8,502,000 250,000 Climate-Science Grand
Challenge Simulations with
CCSM3
Weber, William PNNL 82392 mp148 200,000 1,000 Defects, Defect Processes,
and Ion-Solid Interactions
in Ceramics
Wei, Suhuai NREL 82237 mp252 750,000 40,000 Doping bottleneck, van der
Waals interaction, and
novel ordered alloy
Weinert, Michael U. Wisc. 82566 mp330 250,000 1,000 Electronic Structure of
Milwaukee Alloys, Surfaces, and
Nanostructures
Weitzner, Harold New York Univ 82160 mp338 120,000 500 Advanced Toroidal Theory
and Computation
Weitzner, Harold New York Univ 82161 m191 20,000 100 Advanced Stellarator
Theory
Wellein, Gerhard RRZ Erlangen 82450 m635 S 30,000 1,000 Application Performance
Germany Characteristics of Leading
Edge Supercomputers
Wen, Zhaofang Sandia Lab NM 82169 m407 100,000 500 BEC library for Unified
Parallel C
Werthimer, Dan UC Berkeley 82355 seti S 50,000 900,000 Berkeley High Resolution
Neutral Hydrogen Sky
Survey
White, Martin UC Berkeley 82174 m68 100,000 40,000 Constraining dark energy
with clusters of galaxies
Whiteson, Daniel UC Irvine 82666 atlasuci 5,000 ATLAS Simulation at UC
Irvine
Wilkins, John Ohio State 82325 mp160 12,500,00 1,000 Modeling Dynamically and
Spatially Complex
Materials
Woodruff, Simon Woodruff 82299 m633 260,000 40,000 Simulations of the
Scientific Formation, Compression and
LLC Merging of Compact Tori
Woosley, Stan UC Santa Cruz 82156 m106 3,000,000 50,000 Computational Astrophysics
Consortium
Wu, Jianzhong UC Riverside 82552 m618 350,000 5,000 Atomic density functional
theory for crystal
nucleation and growth
Wu, Meng-Shiou Ames Lab 82504 m664 50,000 5,000 Computational Quality of
Service for Chemistry
Software
Wu, Ruqian UC Irvine 82493 m532 200,000 100 First Principles
Exploration for the Origin
of Ferromagnetism in
Diluted Magnetic
Semiconductors
Wu, Ruqian UC Irvine 82495 mp244 300,000 100 First Principles
Investigations and
Simulations for Catalytic
Properties of Metal/Oxide
Surfaces
Wuebbles, Donald U. Illinois 82374 mp79 550,000 150,000 Parallel modeling of
U-C climate, chemistry, and
physics affecting the
global atmosphere
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Xiang, Nong U. Colorado 82693 m863 S 40,000 5,000 Simulations of electron
Boulder Bernstein waves in a
three-dimensional geometry
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Yan, Yanfa NREL 82213 m721 200,000 100 Theory of metal oxides for
potential applications of
PEC water spliting
Yang, Chao Berkeley Lab 82423 m653 1,500,000 200 Three-dimension Image
Reconstruction of
Macromolecular Assemblies
from Cryo-EM Data
Yelick, Katherine Berkeley Lab 82255 mpnersc 20,000 1,000 NERSC Division Guest
Accounts
Yelick, Katherine Berkeley Lab 82579 mp215 100,000 10,000 UPC and Titanium
Yeung, Pui-kuen Georgia Tech 82368 m442 300,000 100,000 Chemical Reactions and
Intermittency in high
Reynolds number turbulence
Yin, Jianjun Florida State 82318 m758 920,000 100,000 Climate Simulation with
CCSM3/HYCOM
Yunn, Byung Jefferson Lab 82242 m216 150,000 200 Accelerator Physics
Studies of Applications of
Superconducting Linacs
Principal Site Request Repo SP HPSS Project Title
Investigator Id Hours SRUs
Zapol, Peter Argonne 82535 m548 20,000 100 Computational studies of
Electrocatalysis for Low
Temperature Fuel Cell
Cathodes
Zapol, Peter Argonne 82536 m441 40,000 500 Soft/hard interfaces in
nanomaterials
Zhang, Bin Arkansas 82211 m688 S 50,000 2,000 Dynamics of Relativistic
State Heavy Ion Collisions
Zhang, Guoping Indiana St U 82159 m713 2,000,000 2,000 Ultrafast magnetization in
ferromagnets
Zhang, Zhenyu Oak Ridge 82432 m108 500,000 100 First principles studies
of hydrogen storage on
light element based
nanostructures and quantum
metal alloys.
Zhang, Zhenyu Oak Ridge 82474 m781 50,000 100 First principles studies
of optimal dopant control
via n-p copdoing
Zhu, Ping U. Wisc. 82343 m572 250,000 10,000 MHD Modeling of Nonlinear
Madison Ballooning Instabilities
in Fusion and Space
Plasmas
Zunger, Alex NREL 82356 mp70 4,000,000 1,000 Computational
Semiconductor Physics
Zunger, Alex NREL 82357 m346 4,000,000 2,000 Predicting the electronic
Properties of 3D, Milion-
Atom Semiconductor
Nanostructure
Architectures
Zunger, Alex NREL 82512 m790 800,000 1,000 Computational modeling and
design of new materials
for photovoltaics
Zyla, Piotr Berkeley Lab 82481 pdg 9,000 Particle Data Group
Zyla, Piotr Berkeley Lab 82509 e871 250,000 HyperCP (FNAL E871)
