Synthesis of nanosized TiO2/SiO2 particles using microwave processes and their photocatalytic activity on the decomposition of orange II

The nanosized titania and TiO₂/SiO₂ particles were prepared by the microwave-hydrothermal method. The effect of physical properties TTIP/TEOS ratio and calcination temperature has been investigated. The major phase of the pure TiO₂ particle is of the anatase structure, and a rutile peak was observed above 800°C. In TiO₂/SiO₂ particles, however, no significant rutile phase was observed, although the calcination temperature was 900°C. No peaks for the silica crystal phase were observed at either silica/titania ratio. The crystallite size of TiO₂/SiO₂ particles decreases as compared to pure TiO₂ at high calcination temperatures. The TiO₂/SiO₂ particles show higher activity on the photocatalytic decomposition of orange II as compared to pure TiO₂ particles.     

Diastereoselective synthesis of unsaturated 1,2-amino alcohols from α-hydroxy allyl ethers using chlorosulfonyl isocyanate

Diastereoselective synthesis of 1,2-amino alcohols was achieved from a highly diastereoselective allylic amination reaction of α-hydroxy allyl ethers using chlorosulfonyl isocyanate. Diastereoselectivities varied depending on the stereochemistry of the ethers used and the stability of the carbocation intermediate obtained during the reaction. We propose that this CSI reaction is the results of either a S_Ni or S_N1 mechanism, according to the stability of the carbocation intermediate.     

Ab initio and DFT studies on hydrolyses of phosphorus halides

Hydrolyses of phosphorus halides, (RO)(2)POX where R = H or Me and X = F or Cl, in the gas phase and in the reaction field have been investigated theoretically with ab initio and the density functional theory (DFT). The free energy of activation in the reaction field was also estimated using the Onsager method with a correction of entropy change and basis set superposition error (BSSE). The reaction of (MeO)(2)POF proceeds through a path with bifunctional catalysis regardless of the medium, but the reaction of (MeO)(2)POCl proceeds through bifunctional and general base catalysis in the gas phase and in water, respectively. The estimated free energy barrier of 23 kcal/mol for the hydrolysis of (MeO)(2)POF is in good agreement with the experimental values of 24 kcal/mol, and relative barrier of 3 kcal/mol to the (MeO)(2)POCl is also in good agreement with the experimental values of 5 kcal/mol of diisopropyl phosphorus halides ((Pr(i)O)(2)POX, X = F and Cl).     

Hole centres in proton irradiated CaO and SrO

Isolated V^? centres with g⊥ values of 2.0672 and 2.0667 are observed after proton irradiation of CaO and SrO. The behaviour of these centres after thermal and γ-irradiation treatment of the sample indicates that a vacancy aggregate or complex is proton irradiation. The V_OH centre is formed at a higher temperature consistent with the hypothesis that the original proton reacts to form a hydroxyl group.     

Final state interactions in deuteron breakup by protons at 585 and 800 MeV

Neutron-proton final state interactions (FSI) were observed in the deuteron breakup reaction ²H(p, 2p)n-via a kinematically complete experiment at incident proton energies of 585 and 800 MeV. Kinematic conditions were chosen which allowed the final state proton and neutron to have small relative energies; data were taken at four proton c.m. scattering angles at 800 MeV, ranging from 71° to 119° and at 94° and 106° at 585 MeV. The data are analyzed in terms of the Goldberger-Watson formalism for final state interactions, and the individual contributions of the ¹S₀ and ³S₁ np states are determined. The ${}^3\text{S}{}_1{}^1\text{S}{}_0$ ratio is large, as expected from some reaction models. The ratio of ³S₁ (almost elastic) to pd elastic cross sections is in good agreement with FSI analysis.