Synthesis of novel thieno[3,2-b]thienobis(silolothiophene) based low bandgap polymers for organic photovoltaics

Thieno[3,2-b]thienobis(silolothiophene), a new electron rich hexacyclic monomer has been synthesized and incorporated into three novel donor-acceptor low-bandgap polymers. By carefully choosing the acceptor co-monomer, the energy levels of the polymers could be modulated and high power conversion efficiencies of 5.52% were reached in OPV devices.     

Germaindacenodithiophene based low band gap polymers for organic solar cells

We report the first synthesis of a fused germaindacenodithiophene monomer and its polymerisation with 2,1,3-benzothiadiazole by Suzuki polycondensation. The resulting polymer, PGeTPTBT, is semicrystalline, despite the presence of four bulky 2-ethylhexyl groups. Blends with P(70)CBM afford solar cells with efficiencies of 5.02%.     

Stereoselective synthesis and applications of nitrogen substituted donor-acceptor cyclopropanes (N-DACs) in the divergent synthesis of azacycles

A new, highly stereoselective intramolecular cyclopropanation of vinylogous carbamates with carbenes in the presence of Cu(acac)(2) as the catalyst has been developed for the construction of cyclopropapyrrolidinones. The 'syn' isomer of N-DAC can be converted to the 'anti' isomer by simple silica gel treatment. Regioselective cleavage of each of the cyclopropane bonds of these two acceptor substituted N-DACs led to a diverse array of azacycles.     

Metal ions as cofactors for aggregation of therapeutic peptide salmon calcitonin

The effects of multivalent metal ions (Cu(2+)/Zn(2+)/Al(3+)) on the aggregation of salmon calcitonin (sCT)--a therapeutic peptide used worldwide in the treatment of osteoporosis and Paget's disease--have been studied in vitro using NMR (both solution state and solid state), TEM, ThT-fluorescence, and FT-IR spectroscopy. Overall, the various results indicated that the metal-ions-induced conformational transitions in the peptide--mostly toward the β-sheet--facilitate the aggregation of sCT in solution. First, the solution NMR has been used to check the interaction between the peptide and the metal ions. Following this, the formation and characterization of calcitonin aggregates has been performed using TEM, solid state NMR, and FT-IR spectroscopy. The TEM and ThT-fluorescence results revealed that the sCT peptide incubated with Cu(2+) and Zn(2+) metal ions (in aqueous environment) forms globular aggregates, while that with Al(3+) ions forms fibrils. The solid state NMR and FT-IR studies revealed the presence of a substantial amount of β-sheet content in sCT aggregates (formed in the presence of these metal ions) compared to the monomeric sCT, indicating that the metal binding is concomitant with conformational changes. The present study becomes crucial while prescribing this drug peptide under physio-pathological conditions associated with an abnormal accumulation of metal ions (Cu(2+)/Zn(2+)/Al(3+)) in the body (i.e., abnormal metal ion homeostasis).     

Forming simulation of aluminum sheets using an anisotropic yield function coupled with crystal plasticity theory

This paper describes the application of a coupled crystal plasticity based microstructural model with an anisotropic yield criterion to compute a 3D yield surface of a textured aluminum sheet (continuous cast AA5754 aluminum sheet). Both the in-plane and out-of-plane deformation characteristics of the sheet material have been generated from the measured initial texture and the uniaxial tensile curve along the rolling direction of the sheet by employing a rate-dependent crystal plasticity model. It is shown that the stress–strain curves and R-value distribution in all orientations of the sheet surface can be modeled accurately by crystal plasticity if a “finite element per grain” unit cell model is used that accounts for non-uniform deformation as well as grain interactions. In particular, the polycrystal calculation using the Bassani and Wu (1991) single crystal hardening law and experimental electron backscatter data as input has been shown to be accurate enough to substitute experimental data by crystal plasticity data for calibration of macroscopic yield functions. The macroscopic anisotropic yield criterion CPB06ex2 (Plunkett et al., 2008) has been calibrated using the results of the polycrystal calculations and the experimental data from mechanical tests. The coupled model is validated by comparing its predictions with the anisotropy in the experimental yield stress ratio and strain ratios at 15% tensile deformation. The biaxial section of the 3D yield surface calculated directly by crystal plasticity model and that predicted by the phenomenological model calibrated with experimental and crystal plasticity data are also compared. The good agreement shows the strength of the approach. Although in this paper, the Plunkett et al. (2008) yield function is used, the proposed methodology is general and can be applied to any yield function. The results presented here represent a robust demonstration of implementing microscale crystal plasticity simulation with measured texture data and hardening laws in macroscale yield criterion simulations in an accurate manner.     

Potential Flow Past a Slightly Deformed Porous Circular Cylinder

A uniform potential flow past a porous circular cylinder with a core of different permeability is discussed. The porous circular cylinder is slightly deformed whose radius is r=r₁(1+ecosm q){r=r_1(1+\epsilon \cos m \theta)} , where | e | << 1{\mid\epsilon\mid\ll 1} and m is a positive integer. Here r, θ are the polar coordinates and r ₁ is the characteristic radius of the cylinder. The drag force exerted by the exterior flow on the surface of the cylinder is calculated and it depends on the thickness of the porous material and on the permeabilities of the two porous regions. As special cases, porous cylinder with hollow core, rigid core, and deformed cylinder is discussed.     

Stratified flow boiling heat transfer study of a HFC/HC refrigerant mixture in smooth horizontal tubes

The flow boiling heat transfer coefficients of R-134a/R-290/R-600a (91%:4.068%:4.932% by mass) refrigerant mixture are experimentally arrived in two tubes of diameter 9.52 and 12.7 mm. The tests are conducted to target the varied heat flux condition and stratified flow pattern found in evaporators of refrigerators and deep freezers. The varied heat flux condition is imposed on the refrigerant using a coaxial counter-current heat exchanger test section. The experiments are performed for mass flow rates of the refrigerant mixture between 3 and 5 g s⁻¹ and entry temperature between −8.59 and 5.33°C which are bubble temperatures corresponding to a pressure of 3.2 and 5 bar. The influences of heat flux, mass flow rate, pressure, flow pattern, tube diameter on the heat transfer coefficient are discussed. The profound effects of nucleate boiling prevailing even at higher vapor qualities in evaporators are highlighted. The heat transfer coefficient of the refrigerant mixture is also compared with that of R-134a.     

An empirical approach to the theory of particle and nuclear phenomena: Review and some new ideas

Experimental data on masses and lifetimes of unstable particles falls into a pattern, a brief review of some interesting consequences is presented here. From the experience in semiclassical methods and recent advances in quantum chromodynamics, it is proposed that an appropriate generalization of the Gutzwiller trace formula for field theories may lead to a systematic semiclassical chromodynamics theory. The theory can be developed to get appropriate dynamics leading to an explanation of pattern discovered in the empirical data.     

The Euler Class Group of a Noetherian Ring

For a commutative Noetherian ring A of finite Krull dimension containing the field of rational numbers, an Abelian group called the Euler class group is defined. An element of this group is attached to a projective A-module of rank = dim A and it is shown that the vanishing of this element is necessary and sufficient for P to split off a free summand of rank 1. As one of the applications of this result, it is shown that for any n-dimensional real affine domain, a projective module of rank n (with trivial determinant), all of whose generic sections have n generated vanishing ideals, necessarily splits off a free direct summand of rank 1.     

Purification of 233U from Thorium and Iron in the Reprocessing of Irradiated Thorium Oxide Rods

A two step precipitation using ammonium carbonate and oxalic acid as the precipitants for thorium and iron is developed for the purification of ²³³U. Ammonium carbonate is added to the feed to increase the pH of the solution. The effect of pH on the solubility of U, Th and Fe in an excess of ammonium carbonate is studied. This indicates that the solubility of Th and Fe is minimum at pH 7 and the recovery of uranium is maximum. The effect of the concentration of thorium and iron on the recovery of uranium at pH 7 is studied. This indicates that the ammonium carbonate precipitation tolerates 2 g/l of thorium and 10 g/l of iron keeping losses of uranium to a minimum. If the feed solution contains more than a tolerable concentration of thorium the precipitation is followed in two steps: (1) Bulk of the thorium is removed by oxalate precipitation, (2) the remaining thorium and iron in the supernatant are removed by ammonium carbonate precipitation. A flow sheet is proposed for the purification of ²³³U from thorium and iron present in a strip product concentrate obtained during the reprocessing of irradiated thorium rods.