Electronic structure study of platinum clusters
EMSL Project ID
9090
Abstract
Edo Apra has been invited as a visiting scientist within the Molecular Modeling Laboratory at the Institute for the Physical-Chemical Processes (IPCF) of the Italian National Research Council (CNR) to start collaborative work on platinum clusters.
New software developments needed for studying platinum nanoparticles will result in enhanced capabilities of the NWChem code (with obvious benefits for EMSL, PNNL, and other NWChem users).
New software developments needed for studying platinum nanoparticles will result in enhanced capabilities of the NWChem code (with obvious benefits for EMSL, PNNL, and other NWChem users).
Project Details
Project type
Exploratory Research
Start Date
2004-05-04
End Date
2006-11-02
Status
Closed
Released Data Link
Team
Principal Investigator
Team Members
Related Publications
Lebarbier VMC, D Mei, DH Kim, A Andersen, JL Male, JE Holladay, RJ Rousseau, and Y Wang. 2011. "Effects of La2O3 on the mixed higher alcohols synthesis from syngas over Co catalysts: A combined theoretical and experimental study." Journal of Physical Chemistry C 115(35):17440-17451. doi:10.1021/jp204003q