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Cover Picture: Catalytic Reaction Mechanism of Mn‐Doped Nanoporous Aluminophosphates for the Aerobic Oxidation of Hydrocarbons (Chem. Eur. J. 46/2010)
Author(s) -
GómezHortigüela Luis,
Corà Furio,
Sankar Gopinathan,
ZicovichWilson Claudio M.,
Catlow C. Richard A.
Publication year - 2010
Publication title -
chemistry – a european journal
Language(s) - English
Resource type - Reports
SCImago Journal Rank - 1.687
H-Index - 242
eISSN - 1521-3765
pISSN - 0947-6539
DOI - 10.1002/chem.201090227
Subject(s) - supramolecular chemistry , thermal stability , nanoporous , chemistry , catalysis , amide , carbon fibers , chromophore , molecule , density functional theory , reaction mechanism , organic chemistry , materials science , computational chemistry , composite number , composite material
The full reaction mechanism for the environmentally benign aerobic oxidation of hydrocarbons, catalyzed by Mn‐doped aluminophosphates, has been characterized by electronic‐structure computational methods based on hybrid‐exchange density functional theory. For more information see the Full Paper by L. Gómez‐Hortigüela et al. on page 13638 ff.