期刊
JOURNAL OF PHYSICAL CHEMISTRY C
卷 119, 期 2, 页码 1113-1120出版社
AMER CHEMICAL SOC
DOI: 10.1021/jp510821g
关键词
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资金
- U.S. Department of Energy [DE-FG02-90ER14104, DE-FG02-05ER15730, DE-FG02-88ER13937]
- EFRC [DE-SC0001085]
- New York State Office of Science, Technology, and Academic Research (NYSTAR)
- National Science Foundation [CHE-07-01483, CHE-10-12058, DMR-1206768]
- LDRD program at LANL
- National Nuclear Security Administration of the U.S. Department of Energy [DE-AC5206NA25396]
- U.S. Department of Energy (DOE) [DE-FG02-90ER14104, DE-FG02-88ER13937] Funding Source: U.S. Department of Energy (DOE)
We report an experimental and theoretical investigation of the decomposition (partial oxidation) of deuterated methanol (CD3OD) on a single-crystal Fe3O4(111) surface. The crystal surface contains majority areas of a Fe-terminated Fe3O4(111) surface as well as smaller regions of O-terminated FeO(111) or biphase surface reconstruction. Our investigation uses a combination of scanning tunneling microscopy, temperature-programmed desorption, and density functional theory calculations to examine the surface reactions and adsorbates as a function of coverage. Our studies show that the reaction of methanol on this ironoxide surface is highly sensitive to atomic-level surface reconstructions.
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