2011 Annual Meeting

Session: Computational Catalysis I - Databases and Informatics

Co-Chair

Kitchin, J. R., Carnegie Mellon University

Presentations

08:30 AM

(18a) Database Driven Discovery of Materials and Catalysts
Bligaard, T.

09:10 AM

(18b) Fuels and Chemicals From Biomass: Challenges and Opportunities From a Systems Perspective

09:30 AM

(18c) Materials Design Workbench: An Open-Access Database for Materials and Molecular Design
Ferguson, G. A., Greeley, J., Zapol, P., Nestorov, S. E., Foster, I. T., Landis, D., Jacobsen, K. W., Hummelshøj, J. S., Bligaard, T.

09:50 AM

(18d) Model-Based Design of Catalysts
Delgass, W. N., Abu-omar, M., Ribeiro, F. H., Thomson, K. T., Medvedev, G., Wang, J., Clay, J., Jones, M., Lee, W., Pazmino, J., Sabnis, K., Shakhar, M., Stamatis, S. D., Switzer, J. M., Travia, N., Williams, W. D.

10:10 AM

Panel Discussion