Research Project
Grant-in-Aid for Scientific Research (A)
In this project, we investigate using compupuational physics and experiments for Pd catalyst on zeolite and on sulfer-covered gold plate.Pd K-edge extended XAFS analysis for USY zeolite reveals the presence of molecular-like PdO and a mixture of Pd/PdO before and after the reaction, respectively.Pd stabilized by Al sites is present at the II sites of the Y-type zeolite, as estimated using first-principles calculations. The structure of the Pd catalyst, named sulfur-modified gold-supported palladium (SAPd), has been determined to be composed of multi-layered Pd nanoparticles. NEXAFS analysis revealed that the organic matter containing sulfate and xylene as a major ingredient is distributed between Pd nanoparticles.The computational physics approach find the suitable sites on zeolite inner space for Pd catalyst. Moreover,we find the role of SO4 in the case of SAPd that SO4 on gold surface leave gold and adsorb on Pd nano particles. The same mechanism will occor for Ni, also.
All 2015 2014 2013 2012 2011 Other
All Journal Article (64 results) (of which Peer Reviewed: 62 results, Acknowledgement Compliant: 12 results, Open Access: 9 results) Presentation (113 results) (of which Invited: 15 results) Book (2 results) Remarks (3 results) Patent(Industrial Property Rights) (3 results) (of which Overseas: 1 results)
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