Superior performance of the machine-learning GAP force field for fullerene structures

Structural Chemistry - Carbon force fields are widely used for obtaining structural properties of carbon nanomaterials. We evaluate the performance of a wide range of carbon force fields for...     

Novel model of FM-noise conversion in a UMZI using RF external phase modulation of lasers: Theoretical and experimental results

In this paper, we propose and demonstrate a new and original model for theoretical calculation and experimental measurement of the noise power spectral density (NPSD) in phase-modulated optical links. The phase modulation is operated in the RF frequency range by an external phase modulator. The NPSD is derived for the first time in interferometric systems, by considering all effects such as the 1/f FM noise of the laser and white noise applied to light from a 1550 nm DFB laser, with phase modulation. The results show for the first time the influence of the phase modulation index, modulation frequency and interferometric delay in the phase-to-intensity noise conversion. The experimental and simulation results of conversion of FM-noise to intensity noise in an optical link by considering the external RF phase modulation are shown with good agreement.     

Homogeneous liquid-liquid extraction of uranium(VI) using tri-n-octylphosphine oxide.

A simple and efficient method for the selective separation and preconcentration of uranium(VI) using homogeneous liquid-liquid extraction was developed. Tri-n-octylphosphine oxide (TOPO) and tri-n-butylphosphate (TBP) were investigated as complexing ligands, and perfluorooctanoate ion (PFOA-) was applied as a phase separator agent under strongly acidic conditions. Under the optimal conditions ([PFOA-] = 1.7 x 10(-3) M, [TOPO] = 5.4 x 10(-4) M, [HNO3] = 0.3 M, [acetone] = 3.2% v/v) 10 microg of uranium in 40 ml aqueous phase could be extracted quantitatively into 8 microl of the sedimented phase. The maximum concentration factor was 5000-fold. However, an effort for the quantitative extraction using TBP was inefficient and the percent recovery was at most 56.7. The influence of the type and concentration of acid solution, optimum amount of the ligand, type and volume of the organic solvent, concentration of PFOA, volume of the aqueous sample and effect of different diverse ions on the extraction and determination of uranium(VI) were investigated. The proposed method was applied to the extraction and determination of uranium(VI) in natural water samples.     

Kinetic determination of silver ion by its perturbation on Belousov-Zhabotinskii oscillating chemical reaction using potentiometric method.

Silver ion can perturb the Belousov-Zhabotinskii (B-Z) oscillating chemical reaction. Therefore, the B-Z oscillating system was applied in the determination of silver ion by using a platinum wire as an indicator electrode in the potentiometric method. The amplitude of the potentiometric oscillation increased linearly in proportion to [Ag+] in the range of 9.42 x 10(-6) M to 2.54 x 10(-4) M, with a correlation coefficient of 0.999 under the optimum conditions. The obtained LOD (2sigma) was 8.85 x 10(-6) M and the relative standard deviation (RSD) for five measurements of 1 x 10(-4) M silver ion was 5%. The influence of some potentially interference was also investigated.     

Simultaneous kinetic-spectrophotometric determination of hydrazine and acetylhydrazine in micellar media using the H-point standard addition method.

The H-point standard addition method (HPSAM), based on a spectrophotometric measurement for the simultaneous determination of hydrazine and acetylhydrazine, is described. This method is based on the difference between the rates of their reactions with N,N-dimethylaminobenzaldehyde (DAB) in the presence of sodium dodecyl sulfate (SDS) in acidic media. The results showed that hydrazine and acetylhydrazine could be determined simultaneously in the range of 0.020 - 0.70 and 0.20 - 5.0 mg L(-1), respectively. Under the working conditions, the proposed method was successfully applied to the simultaneous determination of hydrazine and acetylhydrazine in several synthetic mixtures and plasma and water samples.     

Optical properties of Fe-doped silica films on Si

Optical properties of Fe-doped silica films on Si were investigated by ellipsometric technique in the region 1-5 eV. Samples were produced by sol-gel method. Precursors were prepared by mixing tetraethoxysilane (TEOS) solution in ethanol and water with aqueous solution of Fe-chloride or Fe-acetate. The coating solution was deposited on Si substrates by spin on technique. The size of Fe-containing nanometric-sized particles depended on technology and varied from 20 to 100 nm. Optical response of complex hybrid samples SiO₂:Fe/Si was interpreted in a multi-layer model. In the inverse problem, the Maxwell equations were solved by transfer matrix technique. Dielectric function of Fe-doped silica layers was calculated in the model of effective media. Analysis of optical data has shown that various Fe-oxides formed. Experimental data for films obtained from precursors with Fe-acetate and annealed in hydrogen were well described by the model calculations taking into account a small contribution 1-5% of metal Fe imbedded in silica. The Fe/Fe-O contribution to optical response increased for samples grown from FeCl₃-precursor. Ellipsometric data for Fe-doped silica films on Si were interpreted taking into account the structural AFM studies as well as the results of magnetic measurements.     

Black-body radiation of noncommutative gauge fields

The black-body radiation is considered in a theory with noncommutative electromagnetic fields; that is noncommutativity is introduced in field space, rather than in real space. A direct implication of the result on cosmic microwave background map is argued.