Organization

Advisory Panel

VLab is overseen by an Advisory Panel. Its role is to provide feedback on scientific, educational, and technological issues to the consortium via its director. The members are: Profs. James R. Chelikowsky (U. of Texas), Richard Martin (U. of Illinois at Urbana-Champaign), Andrew Odlyzko (U. of Minnesota), David Yuen (U. of Minnesota), Alexandra Navrotsky (UC-Davis and COMPRES), Robert Lieberman (SUNY-Stony Brook and COMPRES), Donald Weidner (SUNY-Stony Brook and COMPRES), Shun-ichiro Karato (Yale and COMPRES), G. David Price (UCL, UK), and Stefano Baroni (Democritos, Italy).

Director

Prof. Renata Wentzcovitch

PS and ITS Groups

IT Scientists (ITS):

Profs. Dave Yuen, Gorden Erlebacher (Coordinator), Bijaya Karki, and Drs. Marlon Pierce, Stefano Cozzini, and Kerstin Kleese-Van-Dam.

Physical Scientists (PS):

Profs. Philip Allen, Bijaya Karki, David Yuen, David Price, Michael Gillan, Stefano Baroni, Stefano de Gironcoli, Frank Spera, Donald Truhlar, Iljya Siepmann, and Renata Wentzcovitch (coordinator).

Administrative and Technical Support

Administrative and technical support on all aspects of high-performance scientific computing is provided by the Minnesota Supercomputing Institute.

Research Plan and Time Table

Year 1 Year 2 Year 3 Year 4
Methodology development Methodologies combination Research Research Transport Properties in Iron
UCL, SUNY, UMN
Methodologies exploration Methodologies exploration research Research Research Properties of mantle minerals
UMN, DEMOCRITOS
Methodology development Methodologies combination Research Research Properties of H2O-ice and hydrous MgSiO3
UMN, DEMOCRITOS
Methodologies combination Methodologies combination Research Research Elements partitioning in solid/liquid iron
UCL, UMN
Methodologies exploration Methodologies combination Integration within VLab Availability within VLab PWscf implementation
UMN, DEMOCRITOS
Investigate tools at Daresbury Lab (DL) Visualization Code and hdw Integration within VLab Integration within VLab Metadata
All participating institutions
First principles elasticity & integration within VLab Fully operative methodology available for external users Task Automation
LSU, UMN, DEMOCRITOS
Two client/two servers WEB-IS for large datasets Steering between identical apps. Steering between heterogeneous applications Visualization
FSU, LSU, UMN, DL
WSDL Topic dictionary Topic discovery GSI security NaradaBrokering
FSU, DL
Existing portal deployment Incorporate SRB Smart Schedulers Consistent views WSDL plug-ins Integration Project manager, portals
UMN, FSU, UI, DL, LSU, DEMOCRITOS
-Workshop
-Summer internship
-Workshop
-Summer internship
-Workshop
-Tutorial
-Summer internship
-Workshop
-Tutorial
-Summer internship
Education and Outreach
UMN, FSU, UI, SUNY, DEMOCRITOS, DL, LSU



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