Catalytic Oxidation of Water with High-Spin Iron(IV)–Oxo Species: Role of the Water Solvent
Sign Up to like & getrecommendations! Published in 2017 at "ACS Catalysis"
DOI: 10.1021/acscatal.7b00568
Abstract: We use density functional theory (DFT) and ab initio molecular dynamics to study the conversion of H2O into H2O2 in water solution by the FeIVO2+ group under room-temperature and -pressure conditions. We compute the free… read more here.
Keywords: high spin; oxo species; water; iron oxo ... See more keywords
Slow magnetization relaxation of a high-spin iron(III) in mayenite Ca12Al14O33.
Sign Up to like & getrecommendations! Published in 2024 at "Inorganic Chemistry Frontiers"
DOI: 10.1039/d4qi00480a
Abstract: Samples of the Fe(III) doped calcium aluminate with an anti-zeolite type structure were prepared. The crystal structure parameters were determined, and dc and ac magnetic properties were studied. It is... read more here.
Keywords: magnetization relaxation; iron iii; spin iron; slow magnetization ... See more keywords