Pd(0)-guanidine@MCM-41: a very effective catalyst for rapid production of bis (pyrazolyl)methanes

In this research, a rapid, green and efficient protocol for synthesis of bis (pyrazolyl)methane derivatives in the presence of Pd(0)-guanidine@MCM-41 catalysts under solvent-free conditions by the following two methods has been reported: (i) via the one-pot pseudo five-component reaction among phenylhydrazine (2 equivalents), ethyl acetoacetate (2 equivalents) and aromatic aldehydes (1 equivalent); and (ii) the one-pot pseudo three-component reaction between 3-methyl-1-phenyl-1H-pyrazol-5(4H)-one (2 equivalents) and aromatic aldehydes (1 equivalent). Some advantages of this protocol include: green conditions, extremely short times, high efficiency, proper one-pot operation, generality of method, easy work-up and recyclability, and reusability of the catalyst up to five times without significant loss in catalytic activity.     

An Evolutionary Approach to Optimizing Teleportation Cost in Distributed Quantum Computation

International Journal of Theoretical Physics - Distributed quantum computing has been well-known for many years as a system composed of a number of small-capacity quantum circuits. Limitations in...     

Multicomponent reaction of amine,carbon disulfide,and fluoronitrobenzene via nucleophilic attack on the fluorinated carbon for the synthesis of nitrophenyl methylcarbamodithioates

In this paper, multicomponent reaction of amine, carbon disulfide and fluoronitrobenzene is reported for the synthesis of nitrophenyl methylcarbamodithioate derivatives. The method is based on the nucleophilic attack of the activated methylcarbamodithioate salt to fluoronitrobenzene. Several starting materials are tested and successfully produced the corresponding nitrophenyl methylcarbamodithioate. A possible mechanism for the reaction is suggested.     

Techno-economic analysis of new integrated system of humid air turbine,organic Rankine cycle,and parabolic trough collector

Journal of Thermal Analysis and Calorimetry - Microgas turbines are one of the most well-known technologies for distributed generation. Unfortunately, their efficiency is not as high as it should...     

Bilayer Cylindrical Conduit Consisting of Electrospun Polycaprolactone Nanofibers and DSC Cross‐Linked Sodium Alginate Hydrogel to Bridge Peripheral Nerve Gaps

Herein, a bilayer cylindrical conduit (P‐CA) is presented consisting of electrospun polycaprolactone (PCL) nanofibers and sodium alginate hydrogel covalently cross‐linked with N,N′‐disuccinimidyl carbonate (DSC). The bilayer P‐CA conduit is developed by combining the electrospinning and outer–inner layer methods. Using DSC, as a covalent crosslinker, increases the degradation time of the sodium alginate hydrogel up to 2 months. The swelling ratio of the hydrogel is also 503% during the first 8 h. The DSC cross‐linked sodium alginate in the inner layer of the conduit promotes the adhesion and proliferation of nerve cells, while the electrospun PCL nanofibers in the outer layer provide maximum tensile strength of the conduit during surgery. P‐CA conduit promotes the migration of Schwann cells along the axon in a rat model based on functional and histological evidences. In conclusion, P‐CA conduit will be a promising construct for repairing sciatic nerves in a rat model.     

Preparation of a dual-functionalized fumed silica nanoparticle catalysis for synthesis of azaluorenone derivatives

Research on Chemical Intermediates - A dual-functional silica-based catalyst was prepared by treating fumed silica with amino-containing silane then 1,4-butane sultone. The presence of functional...     

Moving least squares reconstruction for sharp interface immersed boundary methods

We propose a new approach for reconstructing velocity boundary conditions in sharp-inerface immersed boundary (IB) methods based on the moving least squares (MLS) interpolation method. The MLS is employed to not only reconstruct velocity boundary conditions but also to calculate the pressure and velocity gradients in the vicinity of the immersed body, which are required in fluid structure interaction problems to obtain the force exerted by the fluid on the structure. To extend the method to arbitrarily complex geometries with nonconvex shaped boundaries, the visibility method is combined with the MLS method. The performance of the proposed curvilinear IB MLS (CURVIB-MLS) is demonstrated by systematic grid-refinement studies for two- and three-dimensional tests and compared with the standard CURVIB method employing standard wall-normal interpolation for reconstructing boundary conditions. The test problems are flow in a lid-driven cavity with a sphere, uniform flow over a sphere, flow on a NACA0018 airfoil at incidence, and vortex-induced vibration of an elastically-mounted cylinder. We show that the CURVIB-MLS formulation yields a method that is easier to implement in complex geometries and exhibits higher accuracy and rate of convergence relative to the standard CURVIB method. The MLS approach is also shown to dramatically improve the accuracy of calculating the pressure and viscous forces imparted by the flow on the body and improve the overall accuracy of FSI simulations. Finally, the CURVIB-MLS approach is able to qualitatively capture on relatively coarse grids important features of complex separated flows that the standard CURVIB method is able to capture only on finer grids.     

Characterization of Mazuj galls of Quercus infectoria tree as green corrosion and scale inhibitor for effective treatment of cooling water systems

Research on Chemical Intermediates - The corrosion and scale inhibition efficiency of Mazuj gall extract in simulated cooling water has been evaluated. Potentiodynamic polarization, electrochemical...     

Spline methods for the solution of hyperbolic equation with variable coefficients

In this study, we developed the methods based on nonpolynomial cubic spline for numerical solution of second‐order nonhomogeneous hyperbolic partial differential equation. Using nonpolynomial cubic spline in space and finite difference in time directions, we obtained the implicit three level methods of O(k² + h²) and O(k² + h⁴). The proposed methods are applicable to the problems having singularity at x = 0, too. Stability analysis of the presented methods have been carried out. The presented methods are applied to the nonhomogeneous examples of different types. Numerical comparison with Mohanty's method (Mohanty, Appl Math Comput, 165 (2005), 229–236) shows the superiority of our presented schemes. © 2007 Wiley Periodicals, Inc. Numer Methods Partial Differential Eq, 2007     

Energy-consuming micromechanisms in the fracture of glassy polymers. I. Chain scission in polystyrene

The number of chain scissions per unit area that occur during the fracture of partially annealed latex films from M_n ? 180,000 g/mol polystyrene particles of about 275 Å radius were measured and correlated to annealing times. A curve with four regimes was found. At short annealing times the curve is nearly flat, in what is called the chain pull-out regime. In the second regime, the number of chains broken per unit area increases with a 0.8 power of annealing time as entanglement of the diffusing polymer chains increases in neighboring host particles. This is in good agreement with Wool's theory which predicts a 0.75 power dependence. Then, after reaching a peak, the number of scissions decreases in the third regime, indicating a change in fracture mechanism. The number of chain scissions increases again in the fourth regime, as final healing of the film interface takes place. Fracture surface analysis reveals a rough surface for short annealing times and a smooth surface for longer annealing times. The number of polymer chain scissions per unit area of fracture surface showed no dependence on initial molecular weights for t ? τ_r where t and τ_r are annealing and relaxation times, respectively. The number of chain bridges crossing a unit area of interface was suggested as the basic molecular property. © 1992 John Wiley & Sons, Inc.