Generation of coherent tunable deep UV radiation for detection and absorption studies of explosives RDX and TNT

We report a technique for the efficient generation of tunable coherent deep UV radiation and its application in studies of RDX and TNT at the ppm level on the basis of their absorption characteristics. The obtained experimental absorption data are compared with conventional spectrophotometric data. The UV radiation in the range 200–260 nm has been generated by the type-I noncollinear third harmonic of the dye laser radiation (600–700 nm) and also by sum frequency mixing (SFM) of Nd:YAG output (1064 nm) with the second harmonic of the dye laser in β-barium borate (BBO) crystal. The maximum conversion efficiency of the generated signal is estimated to be 57.5% at λ = 218.9 nm wavelength. Apart from measurements of the absorbance of RDX and TNT at different concentrations in their respective solutions, the minimum detection concentrations have also been ascertained. The estimated minimum detectable concentration of RDX is 8.47·10⁻⁹ M, whereas that for TNT is 35.7·10⁻⁹ M. The data were obtained using only ∼100 μJ/pulse of laser energy. Published in Zhurnal Prikladnoi Spektroskopii, Vol. 74, No. 6, pp. 516–521, July–August, 2007.     

Synthesis, characterization and photovoltaic properties of poly(thiophenevinylene-alt-benzobisoxazole)s

Herein we report the synthesis of two solution processible, conjugated polymers containing the benzobisoxazole moiety. The polymers were characterized using (1)H NMR, UV-Vis and fluorescence spectroscopy. Thermal gravimetric analysis shows that the polymers do not exhibit significant weight loss until approximately 300 °C under nitrogen. Cyclic voltammetry shows that the polymers have reversible reduction waves with estimated LUMO levels at -3.02 and -3.10 eV relative to vacuum and optical bandgaps of 2.04-2.17 eV. Devices based on blends of the copolymers and [6,6]-phenyl C61 butyric acid methyl ester (PCBM) exhibited modest power conversion efficiencies. Theoretical models reveal that there is poor electron delocalization along the polymer backbone, leading to poor performance. However, the energy levels of these polymers indicate that the incorporation of benzobisoxazoles into the polymer backbone is a promising strategy for the synthesis of new materials.     

Fractional Crank–Nicolson–Galerkin finite element scheme for the time‐fractional nonlinear diffusion equation

This article presents a finite element scheme with Newton's method for solving the time‐fractional nonlinear diffusion equation. For time discretization, we use the fractional Crank–Nicolson scheme based on backward Euler convolution quadrature. We discuss the existence‐uniqueness results for the fully discrete problem. A new discrete fractional Gronwall type inequality for the backward Euler convolution quadrature is established. A priori error estimate for the fully discrete problem in L²(Ω) norm is derived. Numerical results based on finite element scheme are provided to validate theoretical estimates on time‐fractional nonlinear Fisher equation and Huxley equation.     

Physicochemical and Transmission Electron Micrograph (TEM) Studies of Few Carbohydrate Molecules with Aqueous and Aqueous Geraniol Oil Mixtures

Densities (ρ/10³ kg m^?3), viscosities (η/0.1 N s m^?2) and surface tension (γ/mN m^?1) of aqueous 0.005 to 0.02 mol L^?1 mannitol, glucose and fructose at an interval of 0.005 mol L^?1 and the 0.02, 0.025, and 0.03 v% aqueous geraniol oil were studied. The similar carbohydrates were also studied with 0.025 v% aqueous geraniol. TEM were recorded for sizes of molecules for analysis of probable energy consumption in flow through a capillary of Survismeter, like blood capillaries. The ρ values were used for viscosities (η) and surface tensions (γ). The η were fitted with extended Jones-Dole equation for B/L mol^?1 and D/(L mol^?1)² coefficients to explain carbohydrate-geraniol interactions. The B and γ values illustrate structural behavior of carbohydrates irrespective of the compositions. These data analyze hydrophilic and hydrophobic interactions of geraniol and carbohydrates where electron micrographs depict shortening of sizes and intermolecular distances with geraniol. The size with and without geraniol remained from 0.019–0.035 nm and 0.016–0.038 nm, respectively. The geraniol increased the densities and decreased the surface tension to almost one half of the binary systems with an effective intermixing.     

Ionic Liquid-Mediated Facile Synthesis and Antimicrobial Study of Thiazolo [2,3-b]Benzo[h]Quinazolines and Thiazino[2,3-b] Benzo-[h]Quinazolines

Abstract

8-Methoxy-4-phenyl-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione, obtained by the condensation of 2-benzylidene-6-methoxy-3,4-dihydronapthalene-1(2H)-one with thiourea, on reaction with chloroacetic acid and 3-chloropropanoic acid in the presence of the ionic liquid N-methylpyridinium tosylate furnishes 3-methoxy-7-phenyl-7,10-dihydro-5H- benzo[h]thiazolo[2,3-b]quinazoline-9(6H)-one and 3-methoxy-7-phenyl-5,6,10,11-tetrahydro- benzo[h][1,3]thiazino[2,3-b]quinazoline-9(7H)-one. Further, condensation of the thione with 1,2-dibromoethane and 1,3-dibromopropane yields 3-methoxy-7-phenyl-6,7,9,10-tetrahydro-5 H-benzo[h]thiazolo[2,3-b]quinazoline and 3-methoxy-7-phenyl-5,6,7,9,10,11-hexahydrobenzo [h][1,3]thiazino[2,3-b]quinazoline respectively. Arylidene derivatives have been obtained by two routes. The structures of the cyclized compounds have been established on the basis of elemental analysis and spectroscopic data. The synthesized compounds were screened for antimicrobial activity. Some of the compounds showed promising antimicrobial activities.     

Bioactive versatile azomethine complexes of organotin(IV) and organosilicon(IV)

Diorganotin(IV) and diorganosilicon(IV) derivatives of the types R₂MCl(TSCZ) and R₂M(TSCZ)₂ (where TSCZ is the anion of a thiosemicarbazone ligand, R=Ph or Me and M=Sn or Si) have been synthesized and characterized by elemental analyses, molecular weight determinations and conductivity measurements. The mode of bonding has been established on the basis of IR and ¹H, ¹³C ²⁹Si and ¹¹⁹Sn NMR spectroscopic studies. Some of the representative complexes have also been evaluated for their antimicrobial effects on different species of pathogenic fungi and bacteria in vivoas well as in vitro.The results of these investigations are reported. © 1998 John Wiley & Sons, Ltd.     

A loop-by-loop defect rectification procedure for optimal synthesis of Stephenson III path generators

This paper presents a formulation of constraints for the synthesis of Stephenson III mechanism and a loop-by-loop defect-rectification procedure. The procedure divides the Stephenson III mechanism into two loops, namely, Loop I, i.e., four-bar, and Loop II, i.e., five-bar mechanisms. Then, the defects are identified using the established methodology to formulate the defect-specific constraints in the simplified form. Based on the constraints, an optimization problem is formulated to synthesize a Stephenson III mechanism for path generation. A well-established meta-heuristic algorithm is used to solve the constrained optimization problem. For demonstrating the effectiveness of the formulated constraints, two numerical examples are considered, in which Stephenson III path generator mechanisms are synthesized. It is found that the mechanisms synthesized using the proposed procedure are defect-free when constraints are imposed, which is verified using the stick-diagram.

     

Hollow‐Core Magnetic Colloidal Nanocrystal Clusters with Ligand‐Exchanged Surface Modification as Delivery Vehicles for Targeted and Stimuli‐Responsive Drug Release

The fabrication of hierarchical magnetic nanomaterials with well‐defined structure, high magnetic response, excellent colloidal stability, and biocompatibility is highly sought after for drug‐delivery systems. Herein, a new kind of hollow‐core magnetic colloidal nanocrystal cluster (HMCNC) with porous shell and tunable hollow chamber is synthesized by a one‐pot solvothermal process. Its novelty lies in the “tunability” of the hollow chamber and of the pore structure within the shell through controlled feeding of sodium citrate and water, respectively. Furthermore, by using the ligand‐exchange method, folate‐modified poly(acrylic acid) was immobilized on the surface of HMCNCs to create folate‐targeted HMCNCs (folate‐HMCNCs), which endowed them with excellent colloidal stability, pH sensitivity, and, more importantly, folate receptor‐targeting ability. These assemblages exhibited excellent colloidal stability in plasma solution. Doxorubicin (DOX), as a model anticancer agent, was loaded within the hollow core of these folate‐HMCNCs (folate‐HMCNCs‐DOX), and drug‐release experiments proved that the folate‐HMCNCs‐DOX demonstrated pH‐dependent release behavior. The folate‐HMCNCs‐DOX assemblages also exhibited higher potent cytotoxicity to HeLa cells than free doxorubicin. Moreover, folate‐HMCNCs‐DOX showed rapid cell uptake apart from the enhanced cytotoxicity to HeLa cells. Experimental results confirmed that the synthesized folate‐HMCNCs are smart nanovehicles as a result of their improved folate receptor‐targeting abilities and also because of their combined pH‐ and magnetic‐stimuli response for applications in drug delivery.