Evaluation of Nanoporous Aluminum Silicate Including Active Oxygen Species
نویسندگان
چکیده
منابع مشابه
Energetics of Zn2+ adsorption in silicate MEL-type nanoporous material
Density-functional-based and ab initio calculations were implemented at different computational levels to estimate the binding energy of Zn2+ ion adsorbed on the available sites of a silicate MEL-type adsorbent. B3LYP and MP2 were used in combination with the 6-31G*, 6-31+G*, LanL2DZ, 6-311+G*, and Def2-TZVP basis sets. The zinc cation was found to preferentially occupy the 6MR sites followed b...
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ژورنال
عنوان ژورنال: Journal of the Japan Institute of Metals
سال: 2007
ISSN: 0021-4876,1880-6880
DOI: 10.2320/jinstmet.71.103