Workshop III: Materials Design in Chemical Compound Space

May 2 - 6, 2011

Schedule


Monday, May 2, 2011

9:00 - 9:50
Gerbrand Ceder (Massachusetts Institute of Technology)

 

10:15 - 11:05
Chris Wolverton (Northwestern University)

 

11:30 - 12:20
Stefano Curtarolo (Duke University)

 

2:30 - 3:20
Alex Zunger (National Renewable Energy Laboratory)

The Inverse Problem: Finding structures with Target Electronic Properties

4:00 - 4:50
Matthias Scheffler (Fritz-Haber-Institut der Max-Planck-Gesellschaft)

Screening the Chemical Compound Space from First Principles: Accessing the Accuracy and Reliability of the Base of Multi-Scale Modeling
PDF Presentation


Tuesday, May 3, 2011

9:00 - 9:50
Tamar Seideman (Northwestern University)

Toward Coherent Control in the Nanoscale

10:15 - 11:05
11:30 - 12:20
2:30 - 3:20
Suljo Linic (University of Michigan)

Using electronic structure descriptors to identify new catalysts

4:00 - 4:50
Kristin Persson (Lawrence Berkeley Laboratory)

 


Wednesday, May 4, 2011

9:00 - 9:50
10:15 - 11:05
Ralf Drautz (Ruhr-Universit├Ąt Bochum)

Phase stability in complex alloys

11:30 - 12:20
2:30 - 3:20
4:00 - 4:50

Thursday, May 5, 2011

9:00 - 9:50
10:15 - 11:05
Denis Andrienko (Max Planck Institute for Polymer Research)

 

11:30 - 12:20
Vidvuds Ozolins (University of California, Los Angeles (UCLA))

 

2:30 - 3:20
4:00 - 4:50
David Sholl (Georgia Institute of Technology)

Computationally-aided development of membranes for high performance gas separations


Friday, May 6, 2011

9:00 - 9:50
Steven Lustig (DuPont Central Research and Development)

 

10:15 - 11:05
11:30 - 12:35
Graeme Henkelman (University of Texas at Austin)

 

2:30 - 3:20
4:00 - 4:50
Sidney Yip (Massachusetts Institute of Technology)

Toward Materials Ageing
PDF Presentation
Presentation (PowerPoint File)