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Department of Energy Correlation of Theory and Function in Well-defined Bimetallic Electrocatalysts 09/2009 - 08/2012, PI Prof. Richard Crooks |
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Department of Energy Energy Frontier Research Center: Understanding Charge Separation and Transfer at Interfaces in Energy Materials and Devices 08/2009 - 07/2014, PI Prof. Paul Barbara |
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National Science Foundation CAREER: Methods for calculating molecular dynamics over long time scales CHE-0645497, 03/2007 - 02/2012 |
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National Science Foundation NIRT: Functionalization of alloy metal nanoparticles for enhanced transport and catalysis in membranes CBET-0708779, 08/2007 - 07/2011 |
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Advanced Research Program Correlating the structure and function of bimetallic nanoparticles for catalysis 003658-0015-2007, 05/2008 - 05/2010, with co-PI Prof. Richard Crooks |
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Welch Foundation First-principles calculations of catalytic reactions on metal surfaces and nanoparticles F-1601, 06/2008 - 05/2011 |
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Texas Advanced Computing Center Simulating the ripening dynamics and catalytic activity of metal nanoparticles A-chgh, 06/2005 - 05/2009 |
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Molecular Science Computing Facility, Pacific Northwest National Laboratory First principles adaptive kinetic Monte Carlo calculations of catalytic reactions at supported nanoparticles, EMSL-25428, 06/2007 - 05/2009, with co-PI Dr. Donghai Mei |
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Center for Nanoscale Materials, Argonne National Laboratory First principles calculations of catalytic reactions at bimetallic nanoparticles using adaptive kinetic Monte Carlo, CNM 689, 10/2008 - 09/2009 |
Funding
Each of the following have provided funds or computational resources
for research in the Henkelman group.