Dioxygen binding and activation at metal centers are of major importance in a wide range of
catalytic and biological processes. Metal oxides and dioxygen complexes are potential …

Reactions of small neutral iron oxide clusters (FeO1− 3 and Fe2O4, 5) with carbon
monoxide (CO) are investigated by experiments and first-principle calculations. The iron …

Mixed oxides, α-Fe 2 O 3/Bi 2 WO 6, were prepared using a mechanical mixing procedure
by adding to the Bi 2 WO 6 previously obtained by hydrothermal method the corresponding …

The title reaction was theoretically investigated, where cis-[RhH2 (PH3) 3]+ and cis-[RhH2
(PH3) 2 (H2O)]+ were adopted as models of the catalyst. The first step of the catalytic cycle is …

The atomic structure and properties of nanoparticulate Fe2O3 are characterized starting
from its smallest Fe2O3 building unit through (Fe2O3) n clusters to nanometer-sized Fe2O3 …

Oxygen reduction reaction (ORR) is the cornerstone in the electrochemical energy
conversion devices such as fuel cells and metal–air batteries. It remains a great challenge to …

Extreme pressures and temperatures are known to drastically affect the chemistry of iron
oxides, resulting in numerous compounds forming homologous series n FeO m Fe 2 O 3 and …

Iron oxide is a key compound to understand the state of the deep Earth. It has been believed
that previously known oxides such as FeO and Fe 2 O 3 will be dominant at the mantle …

Reactions of neutral iron oxide clusters (⁠ Fe m O n⁠, m= 1–2⁠, n= 0–5⁠) with methanol
(CH 3 OH) in a fast flow reactor are investigated by time of flight mass spectrometry …

Global minimum structures of neutral (Fe2O3) n clusters with n= 1–5 were determined
employing the genetic algorithm in combination with ab initio parameterized interatomic …