A proof-of-concept Bitter-like HTS electromagnet fabricated from a silver-infiltrated (RE)BCO ceramic bulk

A novel concept for a compact high-field magnet coil is introduced. This is based on stacking slit annular discs cut from bulk rare-earth barium cuprate ((RE)BCO) ceramic in a Bitter-like architecture. Finite-element modelling shows that a small 20 turn stack (with a total coil volume of <20 cm3) is capable of generating a central bore magnetic field of >2 T at 77 K and >20 T at 30 K. Unlike resistive Bitter magnets, the high-temperature superconducting (HTS) Bitter stack exhibits significant non-linear field behaviour during current ramping, caused by current filling proceeding from the inner radius outwards in each HTS layer. Practical proof-of-concept for this architecture was then demonstrated through fabricating an uninsulated four-turn prototype coil stack and operating this at 77 K. A maximum central field of 0.382 T was measured at 1.2 kA, with an accompanying 6.1 W of internal heat dissipation within the coil. Strong magnetic hysteresis behaviour was observed within the prototype coil, with ≈30% of the maximum central field still remaining trapped 45 min after the current had been removed. The coil was thermally stable during a 15 min hold at 1 kA, and survived thermal cycling to room temperature without noticeable deterioration in performance. A final test-to-destruction of the coil showed that the limiting weak point in the stack was growth-sector boundaries present in the original (RE)BCO bulk

Julian of Norwich and her children today: Editions, translations and versions of her revelations

The viability of such concepts as "authorial intention," "the original text," "critical edition" and, above all, "scholarly editorial objectivity" is not what it was, and a study of the textual progeny of the revelations of Julian of Norwich--editions, versions, translations and selections--does little to rehabilitate them. Rather it tends to support the view that a history of reading is indeed a history of misreading or, more positively, that texts can have an organic life of their own that allows them to reproduce and evolve quite independently of their author. Julian's texts have had a more robustly continuous life than those of any other Middle English mystic. Their history--in manuscript and print, in editions more or less approximating Middle English and in translations more or less approaching Modern English--is virtually unbroken since the fifteenth century. But on this perilous journey, many and strange are the clutches into which she and her textual progeny have fallen

Singlet fission efficiency in tetracene-based organic solar cells

Singlet exciton fission splits one singlet exciton into two triplet excitons. Using a joint analysis of photocurrent and fluorescence modulation under a magnetic field, we determine that the triplet yield within optimized tetracene organic photovoltaic devices is 153% ± 5% for a tetracene film thickness of 20 nm. The corresponding internal quantum efficiency is 127% ± 18%. These results are used to prove the effectiveness of a simplified triplet yield measurement that relies only on the magnetic field modulation of fluorescence. Despite its relatively slow rate of singlet fission, the measured triplet yields confirm that tetracene is presently the best candidate for use with silicon solar cells.United States. Dept. of Energy. Office of Basic Energy Sciences (Award DE-SC0001088)National Science Foundation (U.S.). Graduate Research Fellowship (Grant 1122374

From Sensors to Silencers: Quinoline- and Benzimidazole-Sulfonamides as Inhibitors for Zinc Proteases

Derived from the extensive work in the area of small molecule zinc(II) ion sensors, chelating fragment libraries of quinoline- and benzimidazole-sulfonamides have been prepared and screened against several different zinc(II)-dependent matrix metalloproteinases (MMPs). The fragments show impressive inhibition of these metalloenzymes and preferences for different MMPs based on the nature of the chelating group. The findings show that focused chelator libraries are a powerful strategy for the discovery of lead fragments for metalloprotein inhibition

Anthracene Diphosphate Ligands for CdSe Quantum Dots; Molecular Design for Efficient Upconversion

Quantum dot (QD)-sensitized photon upconversion follows a multi-step energy transfer process from the QD to transmitter ligand to a soluble annihilator. Using a novel 10-R-anthracene-1,8-diphosphoric acid (R = octyl, 2-hexyldecyl, phenyl) ligand with high binding affinity for CdSe QD surfaces, we demonstrate a photon upconversion process that is limited by the transmitter to annihilator transfer efficiency. Using 1H NMR spectroscopy, we demonstrate that these bidentate diphosphate ligands rapidly and irreversibly displace two carboxylate ligands. These ligands mediate energy transfer from the photoexcited QDs to a triplet annihilator (1,10-diphenylanthracene), producing overall photon upconversion quantum efficiencies as high as 17%, the highest for QDs with no shells. Transient absorption spectroscopy shows that the anthracene dihydrogen phosphate (ADP) ligand supports a 3.4 fold longer triplet state lifetime compared to 9-anthracene carboxylic acid (299.9 ± 9.5 vs 88.2 ± 2.1 μs), increasing the probability of energy transfer

Evaluation of machine-learning methods for ligand-based virtual screening

Machine-learning methods can be used for virtual screening by analysing the structural characteristics of molecules of known (in)activity, and we here discuss the use of kernel discrimination and naive Bayesian classifier (NBC) methods for this purpose. We report a kernel method that allows the processing of molecules represented by binary, integer and real-valued descriptors, and show that it is little different in screening performance from a previously described kernel that had been developed specifically for the analysis of binary fingerprint representations of molecular structure. We then evaluate the performance of an NBC when the training-set contains only a very few active molecules. In such cases, a simpler approach based on group fusion would appear to provide superior screening performance, especially when structurally heterogeneous datasets are to be processed

Elaboration of tetra-orthogonally-substituted aromatic scaffolds towards novel EGFR-kinase inhibitors

Nitration of three regioisomers of bromo-fluorobenzaldehyde proceeds regioselectively, notably with H2SO4/HNO3 at 0 °C. The thereby synthesized tetrasubstituted aromatics, endowed with orthogonal substituents, can be elaborated via Pd-catalysed coupling, reduction and reductive amination reactions. As a test-case, these compounds were converted into EGFR inhibitors related to Gefitinib, whose activity was rationalised by docking studies

Characterisation of the mechanical failure and fracture mechanisms of single grain Y–Ba–Cu–O bulk superconductors

Abstract: The widespread use of melt processed, single grain (RE)–Ba–Cu–O bulk superconductors [(RE)BCO], where RE = Y, Gd or Sm, is limited predominantly by the poor mechanical properties of these inherently brittle, ceramic-like materials. The high density of flaws, such as cracks and voids, within the single grain microstructure leads directly to a low fracture toughness. As a result, the Lorentz forces, generated when these materials carry current in the presence of a large magnetic field, create stresses sufficiently large to cause brittle failure. The addition of Ba–Cu–O (liquid phase) and Ag to the precursor composition prior to melt-growth has been demonstrated to be effective in improving the mechanical properties of these technologically important materials. In this work, we characterise the mechanical failure of single grain YBCO bulk superconductors in terms of a Weibull statistical distribution. In addition, differences in fracture mechanisms have been studied to provide a better understanding of how the provision of additional liquid phase and silver produces YBCO single grains with better resulting mechanical properties and how these can be improved further