Simulation of the dynamics of oxidation of an aluminum nanoparticle

HPCC Prinicipal Investigators and Projects FY07/08

The following principal investigators and projects are supported by HPCC.

Joon AhnThe optimal search and replication strategy in the wirele ss sensor networks
Sushmita AllamAnalysis of elements of the nervous system pathway to interpret their importance to the physiological system
Todd AlonzoStatistical methods for medical tests and biomarkers
Thorsten BeckerGlobal mantle convection and crustal dynamics
Ganesha BhaskaraTopology generation for protocol testing and falsification
Jeb BinkleyHigh-Speed Analog to Digital Converter with Ternary Serial Output
Stephen BradforthDynamics of small molecule structure and reactiv ity in liquid water.
Giuseppe CaireSimulation of advanced decoders beyond beief propag ation
Ho Man ChanNonlinear Dynamic Modeling of Spike Train Transformations for Hippocampal-Cortical Prosthesis
Tu-nan ChangStructure study of of atoms/ions with core-excitation
wei-chung chengeometrically nonlinear analysis for the material w ith a periodic microstructure
Stephen CroninNumerical Simulation of Nanoscale Systems
Kannika DamrongplasitImpact of Marijuana Decriminalization on Marijuana Smoking Prevalence: Evidence from Australia
Yongheng DengCommercial mortgage credit risk analysis
Raja DeyMef2 structure and function
Julian DomaradzkiNumerical Simulations of Turbulent Flows
Shirin Ebrahimi-TaghizadehSystematic Testing of Robustness for Tr ansport Protocols with Congestion Control by Evaluation of Synthesized Scenarios
Fokion EgolfopoulosAerodynamic and Kinetics Processes in Homogene ous and Heterogeneous Reacting Flows
Pradip GangopadhyayExploration of the heliosphere by solar backsc attered Lyman Alpha Radiation:Interpretation of Voyager and Pioneer Lyman Alpha measurements
Panayiotis GeorgiouSpeech to Speech Translation
Robert GuralnickPermutation Representions of Finite Groups and Mo nodromy of Curves
Stephan HaasMagnetic Fields and Disorder in Quantum Spin Systems< /td>
Ralf HaigesComputational Chemistry
James HawComputational Studies of Supported Molecular Catalysts
John HeidemannLANDER
Thieo Hogen-EschComputational methods for the elucidation of the mechanisms of the Yamamoto polymerizations
Min-Hsiu HsiehQuantum low density parity check code
Laurent IttiLearning to attend - the surprise hypothesis
Rajiv KaliaMultimillion to Billion Atom Molecular Dynamics Simula tions of Materials
Thomas KatsouleasFull-scale modeling of high energy particle acc elerators
Kevin KnightStatistical-based Natural Language Processing
Anna KrylovChem 545 class: Theory and practice of electronic stru cture
Anna KrylovModeling photoelectron spectra of highly energetic cyc lic N3 and other energetic molecules
Anna KrylovDevelopment and applications of parallel quantum chemi stry
Ake LuAdvanced Imaging for Glaucoma
Yuxiang LuoDoubly excited resonances of Helium
Philip MaechlingSCEC/CME: Cyberinfrastructure for Earthquake Syst em Science
Janice McMahonCognitive Run-Time Systems
Aiichiro NakanoCSCI596 (Scientific Computing and Visualization)-- Scalable Molecular Dynamics and Quantum Dynamics Simulation Algorithms
Aiichiro NakanoCSCI653: High Performance Computing & Simulations< /td>
Aiichiro NakanoUltrascale Atomistic Simulation of Chemical Reacti ons
Tan Hung Marie NgA comparison of 5 methods for detecting interact ion
Neamati NouriMolecular mechanics simulations on several cancer dr ug targets
John O'BrienActive and Passive Integrated Circuit Components
hiroshi ochiumiCompensation Schemes for Forecaters
Maria Ogneva"Information Asymmetry Uncertainty and Pricing I mplications of Earnings Quality"
Nicos PetasisModeling of chemical structures and chemical reactio ns
Peter QinMolecular dynamics analyses of nitroxides attached to nu cleic acids
Joaquin RapelaCharacterization of responses of visual cells from natural images
Golam RasulAb initio/GIAO-MP2/CCSD(T) calculations of structures and NMR and other properties of highly reactive carbocations, carbodications, onium ions and di cations
Edward Rhodes, Jr.Helioseismic Studies of Solar Internal Structur e and Dynamics
Usman RiazLow Complexity Coding or Ultra Wide Band Radio
Lorenzo RossiOptimal Sink Deployment in Heterogeneous Environment s
Muhammad SahimiNon-equilibrium Molecular Dynamics Simulation of T ransport and Separation of Fluid Mixture through Membranes
Takahiro SakaiInternal wave motion in stratiried lake
Jefferey SellersInternational Metropolitan Observatory Project
Philip StephensVibrational Circular Dichroism Spectroscopy
Daniel StramWhole Genome Scan Design
Mark ThompsonExcited state calculations of transition metal compl exes
Priya VashishtaBillion Atom Molecular Dynamics Simulations of Ene rgetic Materials
P. VernierMolecular dynamics simulations of biomolecular structu res in nanosecond, megavolt-per-meter, pulsed electric fields
Engin VolkanSovereign Spread Volatility, Risk Averse Investors a nd Financial Contagion
Hai WangCombustion Kinetics
Arieh WarshelComputational Biophysics and Biochemistry
Tao WeiProtein Adsorption and Enzyme behavior in mixed organics< /td>
Fernando ZapateroAmerican Option Pricing under Variance Gamma Mod el
Fernando ZapateroIntegrated Asset-Liability Management
Liye ZhangComputer Simulation of Kondo Effect
Li ZhaoRegional and local seismic wave propagation and inversion< /td>
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