Hi Shelly, I believe that Melissa Denecke has done some similar work with polarized EXAFS, but I think they rotated the uranyl group rather than moving it around if I remember correctly. Greathouse JA, Stellalevinsohn HR, Denecke MA, et al. Uranyl surface complexes in a mixed-charge montmorillonite: Monte Carlo computer simulation and polarized XAFS results CLAYS AND CLAY MINERALS 53 (3): 278-286 JUN 2005 Bosbach D, Denecke MA, Dardenne K, et al. Uranyl uptake at the calcite(104) single crystal surface - a spectroscopic and microscopic study GEOCHIMICA ET COSMOCHIMICA ACTA 68 (11): A503-A503 Suppl. S JUN 2004 Denecke MA, Bosbach D, Dardenne K, et al. P-GIXAFS study of uranyl sorption onto natural calcite LITHOS 73 (1-2): S25-S25 Suppl. S MAR 2004 Denecke MA, Rothe J, Dardenne K, et al. Grazing incidence (GI) XAFS measurements of Hf(IV) and U(VI) sorption onto mineral surfaces PHYSICAL CHEMISTRY CHEMICAL PHYSICS 5 (5): 939-946 2003 Sincerely, Wayne Lukens On Jul 21, 2005, at 8:14 AM, Kelly, Shelly D. wrote:
Hello all, I am working on a project were I trick feffit into moving an atom around on the surface of a plane to refine polarization dependent surface EXAFS data. I made a quick literature search and have not found any other EXAFS papers that do such a thing. Are you aware of similar work? I would like to give credit in our manuscript. Shelly _______________________________________________ Ifeffit mailing list Ifeffit@millenia.cars.aps.anl.gov http://millenia.cars.aps.anl.gov/mailman/listinfo/ifeffit