Cobalt Single‐Atom Catalysts with High Stability for Selective Dehydrogenation of Formic Acid

Metal–organic framework (MOF)‐derived Co‐N‐C catalysts with isolated single cobalt atoms have been synthesized and compared with cobalt nanoparticles for formic acid dehydrogenation. The atomically dispersed Co‐N‐C catalyst achieves superior activity, better acid resistance, and improved long‐term stability compared with nanoparticles synthesized by a similar route. High‐angle annular dark‐field–scanning transmission electron microscopy, X‐ray photoelectron spectroscopy, electron paramagnetic resonance, and X‐ray absorption fine structure characterizations reveal the formation of Co^IIN_x centers as active sites. The optimal low‐cost catalyst is a promising candidate for liquid H₂ generation.     

Organocatalytic synthesis of multiple substituted bicyclo[4.4.0]decalin system

An efficient and unprecedented organocatalytic reaction of γ-nitroketones with α,β-unsaturated aldehydes to give polyfunctionalized [4.4.0] bicyclic skeletons was developed. The diphenylprolinol silyl ether mediated nitro-Michael/Aldol reaction afforded the hexa-substituted decalin carboaldehydes with excellent diastereo- and enantioselectivity (up to >99:1 dr and >99% ee) via a formal [4 + 2] carbocyclization process.     

Uncovering molecular processes in crystal nucleation and growth by using molecular simulation

Exploring nucleation processes by molecular simulation provides a mechanistic understanding at the atomic level and also enables kinetic and thermodynamic quantities to be estimated. However, whilst the potential for modeling crystal nucleation and growth processes is immense, there are specific technical challenges to modeling. In general, rare events, such as nucleation cannot be simulated using a direct "brute force" molecular dynamics approach. The limited time and length scales that are accessible by conventional molecular dynamics simulations have inspired a number of advances to tackle problems that were considered outside the scope of molecular simulation. While general insights and features could be explored from efficient generic models, new methods paved the way to realistic crystal nucleation scenarios. The association of single ions in solvent environments, the mechanisms of motif formation, ripening reactions, and the self-organization of nanocrystals can now be investigated at the molecular level. The analysis of interactions with growth-controlling additives gives a new understanding of functionalized nanocrystals and the precipitation of composite materials.     

Optical single-particle detection in nanoholes towards simple parallel detection of molecular binding events

A novel scheme for the optical detection of a few or even single gold nanoparticle labels is introduced. It utilizes sub-wavelength holes in a chromium layer on a glass substrate, where a bioaffinity reaction could take place and the outcome (regarding particle label binding) can be monitored using optical means. Experiments in combination with simulations demonstrate that the presence of particles in such a chromium hole can be simply detected by using the color information of images by a charge couple device (CCD) camera without the need for additional spectroscopy setups. The presence of gold nanoparticles leads to a detectable red-shift in the images of the respective nanohole, which is the sensing principle of the sensor.     

Polymerization of Acrylonitrile Initiated by the Redox System Peroxydisulfate-Cyclohexanol in the Presence of Silver Ion Catalyst

The kinetics of the polymerization of acrylonitrile initiated by the redox system peroxydisulfate-cyclohexanol catalyzed by silver ion has been studied. The rate of polymerization was found to be directly proportional to the first power of monomer concentration and the square roots of peroxydisulfate, cyclohexanol, and silver ion concentrations. The effect of temperature has been investigated in the range of 35 to 60°C and the overall activation energy was found to be 4.6 kcal/mol from the Arrhenius plot. A plausible kinetic scheme has been proposed to account for the observations.     

Synthesis,characterization and study of antibacterial activity of enaminone complexes of zinc and iron

Complexes of enaminones; 4-N,N-diethylamine-pent-3-ene-2-one [HL¹], 4-N,N-di n-propylamine-pent-3-ene-2-one [HL²] and 4-N,N-dicyclohexylamine-pent-3-ene-2-one [HL³] with Fe(II) and Zn(II) ions were prepared by reacting the equimolar ethanolic solutions of the ligands (HL¹, HL² and HL³) with ethanolic metal solutions. The complexes formed, were characterized by infrared, ultraviolet and atomic absorption spectroscopy. Ligands and their metal complexes were tested against Escherichia coli and Staphylococcus aureus bacteria to assess their antibacterial action using disc diffusion method. Ligands were completely inactive against bacteria whereas the complex Zn (HL¹) has significant action on both bacteria, indicating that it has a good potential as bactericide. Other complexes have normal antiseptic character.     

Elemental analysis of limestone by instrumental neutron activation analysis

Limestone samples from Assuit Governrate in Upper Egypt were subjected to elemental analysis by instrumental neutron activation analysis and X-ray fluorescence techniques. The samples were properly prepared together with their standards and simultaneously irradiated in a neutron flux of the order 7 × 1011 n/cm² s using TRIGA research reactor at Mainz. After activation the samples were subjected to γ-ray spectrometry using a high purity germanium detection system and computerized multichannel analyzer. Nineteen elements: Na, Ca, Mn, Fe, Sc, Cr, Co, Zn, Sn, La, Ce, Nd, Eu, Sm, Yb, Lu, Hf, Th and U were analyzed. X-ray fluorescence spectrometry have been also used. The presence of any elements in higher or lower levels in certain limestone samples is contingent on the occurrence of its bearing minerals, nature of parent sediments and depositional environments of these sediments. The major elements in the samples were also observed to be among the elements that had high enrichment factors in the study of suspended dust particulate within and around cement industries. This confirms cement as the major contributor to the airborne particulate matter in the environs.     

Elemental analysis of soils from Toshki by using instrumental neutron activation analysis techniques

Instrumental neutron activation analysis has allowed performing a complete characterization of the chemical composition of thirty soil samples soil samples from ten locations collected from the Toshki area in Upper Egypt. The samples were irradiated with thermal neutrons at the Mainz TRIGA research reactor. Gamma-ray spectra were recorded using a high efficiency HPGe detector to determine the contents of major, minor and trace elements in these samples. As a result of the analysis, altogether 32 elements were identified qualitatively and quantitatively. These elements are: Al, As, Ba, Ca, Ce, Co, Cr, Cs, Eu, Fe, Ga, Hf, K, La, Lu, Mg, Mn, Na, Nb, Nd, Rb, Sc, Sm, Sn, Ta, Ti, Th, U, V, Yb, Zn and Zr. In several cases, X-ray fluorescence analysis was used for comparison. The results obtained for U and Th were compared with data reported in literature.