The recognition of boron compounds is well developed as boronic acids but untapped as organotrifluoroborate anions (R−BF3−). We are exploring the development of these and other designer anions as anion-recognition motifs by considering them as substituted versions of the parent inorganic ion. To this end, we demonstrate strong and reliable binding of organic trifluoroborates, R−BF3−, by cyanostar macrocycles that are size-complementary to the inorganic BF4− progenitors. We find that recognition is modulated by the substituent's sterics and that the affinities are retained using the common K+ salts of R−BF3− anions. 相似文献
We prove a well-posedness result for two pseudo-parabolic problems, which can be seen as two models for the same electrical conduction phenomenon in heterogeneous media, neglecting the magnetic field. One of the problems is the concentration limit of the other one, when the thickness of the dielectric inclusions goes to zero. The concentrated problem involves a transmission condition through interfaces, which is mediated by a suitable Laplace-Beltrami type equation. 相似文献
In wireless sensor networks (WSNs), the appearance of coverage holes over a large target field is mostly possible. Those holes reduce network performance and may affect the network efficiency. Several approaches were proposed to heal coverage holes in WSNs, but they still suffer from some weaknesses. In this paper we suggest a distributed algorithm, named hybrid hole healing algorithm (3HA), to find the minimum effective patching positions to deploy additional nodes to cover the holes. A hole manager node of each hole is responsible for operating the 3HA algorithm which requires two phases. The first phase finds all candidate patching positions using a Voronoi diagram. It takes all Voronoi vertices within the hole as the initial patching positions list. The second phase reduces as much as possible this list based on integer linear programming and on a probabilistic sensor model. The 3HA algorithm repeats the above phases in rounds, until all Voronoi vertices are covered. Simulation results show that our solution offers a high coverage ratio for various forms and sizes of holes and reduces the number of additional sensors when compared to some algorithms like the Perimeter-based, the Delaunay triangulation-based, the Voronoi-based, and the Trees-based coverage hole healing methods.
Transition‐metal complexes containing stimuli‐responsive systems are attractive for applications in optical devices, photonic memory, photosensing, as well as luminescence imaging. Amongst them, photochromic metal complexes offer the possibility of combining the specific properties of the metal centre and the optical response of the photochromic group. The synthesis, the electrochemical properties and the photophysical characterisation of a series of donor–acceptor azobenzene derivatives that possess bipyridine groups connected to a 4‐dialkylaminoazobenzene moiety through various linkers are presented. DFT and TD‐DFT calculations were performed to complement the experimental findings and contribute to their interpretation. The position and nature of the linker (ethynyl, triazolyl, none) were engineered and shown to induce different electronic coupling between donor and acceptor in ligands and complexes. This in turn led to strong modulations in terms of photoisomerisation of the ligands and complexes. 相似文献
We have determined the various parameters of the electric field gradient (EFG) for different Fe-oxygen configurations. This was achieved by analyses of a variety of spectra using a procedure which allows fitting of all spectra of oriented 1-2-3 compounds obtained at different tilt angles β simultaneously, taking into account the degree of texture. The use of a point charge model is invalidated because of the high degree of estimated covalence. The Mössbauer parameters are rationalized. The absence of any observed anisotropy of the mean square displacement of the dopant at the Cu(1) site is rather intriguing. 相似文献
Low concentrations of bromine (0.008–0.06M) were used to initiate photopolymerization of MMA in bulk and in diluted (near bulk) systems, the diluents or solvents used being benzene, toluene, dioxane, tetrahydrofuran, carbon tetrachloride, chloroform, methylene chloride, and methanol. Polymerization in bulk follows usual free-radical kinetics. Inert solvents (benzene, toluene) as well as the other solvents used enhance the rate of polymerization MMA even when used in the range of catalytic concentrations (0.04–0.4M). An initiation mechanism involving solvent molecules appears to be predominant in diluted systems. 相似文献
We have simulated the dissociation reactionAn→An?1+A for small clusters (L-J argon) with well defined internal energy and total angular momentum. Reaction rates and kinetic energy release distributions are compared to the predictions of several statistical theories, including RRK, the “Engelking” model, and phase space theory (PST). We have applied classical phase space theory in an essentially exact formulation using accurate anharmonic vibrational densities of states (and no adjustable parameters). We present a critical evaluation of the different theories and sensitivity of the results to the underlying assumptions. 相似文献