Electronic and optical properties of Sr3X2 (X=N,P, As,Sb and Bi) compounds: first principles study

ABSTRACT

Direct bandgap semiconductors are very essential to fulfil the demand for the advancement in optoelectronic devices. Therefore it is important to predict new potential candidates having such unique features. In current work, Sr₃X₂ (X=N, P, As, Sb and Bi) compounds have been reported for the first time by well trusted FP-APW+lo method. For the better prediction of the energy band gap, mBJ is used alongwith routine generalised gradient approximation (GGA). The results show small and direct energy band gaps at Γ-Γ symmetry points with magnitude in the range from 0.62?eV (Sr₃P₂) to zero energy band gap (Sr₃Bi₂). In partial density of state Sr-d state and X-p state are contributed in the band structure. The compounds show mostly covalent bonding nature. The frequecy dependent optical properties in the linear optical range are also investigated.     

In-vitro drug–drug interaction studies of diltiazem with floroquinolones

Diltiazem is an established cardiovascular drug mainly used for the management of hypertension specifically for the angina pectoris. Fluoroquinolones are widely prescribed against the treatment of severe infections. In vitro relations of diltiazem with fluoroquinolones (ciprofloxacin, levofloxacin, norfloxacin, and ofloxacin) were examined using spectrophotometric and separation techniques, i.e., RP-HPLC. Diltiazem’s availabilities were observed to be predisposed highly in the presence of fluoroquinolones. To investigate the mechanism of interaction in a variety of dissolution environments, i.e., simulating body environments with regard to pH on these interactions has been studied. Moreover, complex of diltiazem–fluoroquinolones were prepared and elucidated through IR spectroscopy and confirmed by computational molecular modeling.     

Parity violation in SLAC experiment and left-right symmetric gauge models

It is shown that the left-right symmetric gauge models based on the group $\text{G}$ = SU(2)_L × SU(2)_R × U(1)_L × U(1)_R can accommodate quite naturally the results of the recent SLAC experiment concerning parity violation in neutral currents. The possibility of finding a light neutral gauge boson in the PETRA-PEP energy range remains particularly interesting.     

Differential equation approach for the energy average of the scattering function

An exact differential equation is given to evaluate the energy average of the scattering function. The advantage of the differential equation as compared to the earlier methods based on series expansion is that one has to evaluate only single sums over the complex poles of the S-matrix. Using Wigner’s semicircle law for the distribution of the real parts of the poles of the scattering matrix, the earlier expression for the energy average of the scattering function is rederived.     

On an integral over the surface ofN-dimensional unit sphere

An integral which occurs in the new matrix ensembles and the width fluctuation factor is evaluated using a transformation which changes a Gaussian into an exponential. It is expressed in the form of a series whose terms are found using a simple recursion relation. It is shown that the series can be summed in closed form for the two-dimensional case.     

Analysis of multiparticle production data on proton-nucleus collisions using a new variable

Multiparticle production data on proton-nucleus collisions have been analyzed taking the number of ‘created’ charged particles instead of the observed number of shower particles as the variable. The mean normalized multiplicity,R _A , has been found to be independent of energy in the energy range (7–8000) GeV and its mass number dependence has been obtained. The modified analysis introduces some more regularities in the experimental results onp-nucleus collisions like the invariance with respect to energy of the relationshipR _A = α + βN _h and the KNO-like scaling of the multiplicity distributions of the created charged particles. The functional form of the scaling function has been calculated.     

A new route to alumoxane gel: a versatile precursor to gamma-alumina and alumina-based ceramic oxides

We present a new route for the preparation of gamma-alumina and YAG nanoparticles. Metal salts of ethylhexanoic acids provide good solubility in hydrocarbon solvents and allow efficient ultrasonication. The sonication product is an alumioxane gel, which can reversibly collapse and reform, depending on the solvent used. The dried gel nanoparticles are calcined at temperatures significantly lower than those used in conventional syntheses, resulting in gamma-alumina nanoparticles. This is due to the complete mixing of elements at the atomic level and the small size of the formed nanoparticles.     

Testing Monotonicity

at arguments of its choice, the test always accepts a monotone f, and rejects f with high probability if it is ε-far from being monotone (i.e., every monotone function differs from f on more than an ε fraction of the domain). The complexity of the test is O(n/ε). The analysis of our algorithm relates two natural combinatorial quantities that can be measured with respect to a Boolean function; one being global to the function and the other being local to it. A key ingredient is the use of a switching (or sorting) operator on functions. Received March 29, 1999     

Encapsulation and characterization of flurbiprofen loaded poly(є-caprolactone)–poly(vinylpyrrolidone) blend micropheres by solvent evaporation method

Flurbiprofen loaded PCL/PVP blend microspheres were prepared by o/w solvent evaporation method using various concentrations of gelatin as emulsifying agent. Microsphere recovery decreased with a decrease in the concentration of the emulsifier in the dispersion. Encapsulation efficiency and drug loading of microspheres increased with decrease in concentration of emulsifying agent. Hydration rate, encapsulation efficiency and drug loading of microspheres increased with increase in concentration of PVP. Rheological properties showed free flowing nature of microspheres. SEM (Scanning electron microscope) revealed microspheres were discrete, spherical and became porous with decrease in concentration of emulsifying agent but smooth with higher concentration of emulsifying agent. FTIR (Fourier transform infrared spectroscopy) spectra of pure and encapsulated flurbiprofen in all formulation showed no significant difference in characteristic peaks, suggesting stability of flurbiprofen during encapsulation process. X-RD (X-ray powder diffractometry) of pure flurbiprofen shows sharp peaks, which decreases on encapsulation, indicating dispersion at molecular level and hence decrease in the crystallinity of drug in microspheres. Microspheres showed an enteric nature at pH 1.2 and a sustained release pattern at pH 6.8. Rapid drug release was observed in microspheres with higher concentration of PVP (polyvinylpyrrolidone), PVP acts as channeling agent. Formulation with low concentration of emulsifying agent also showed a fast release due to porous structure. Drug release kinetics followed zero order at pH 1.2 while at pH 6.8 Higuchi model was best fitted and was found non fickian.