Three-dimensional through-bond homonuclear-heteronuclear correlation experiments for quadrupolar nuclei in solid-state NMR applied to (27)Al-O-(31)P-O-(27)Al networks

We present here the first 3D homonuclear/heteronuclear correlation experiment applied to quadrupolar nuclei and making use of the sole scalar J-coupling. This experiment, based on the 2D-Homonuclear-Heteronuclear Single Quantum Correlation (H-HSQC) experiment, uses a relayed transfer from the (27)Al central transition to neighbouring (31)P spins and to the central transition of a second (27)Al. It confirms the correlation map characterizing the two (27)Al and the (31)P NMR signatures of (27)Al-O-(31)P-O-(27)Al chemically bonded molecular motifs.     

Quasi-equational bases for graphs of semigroups,monoids and groups

The graph of an algebra A is the relational structure G(A) in which the relations are the graphs of the basic operations of A. Let denote by the class of all graphs of algebras from a class . We prove that if is a class of semigroups possessing a nontrivial member with a neutral element, then does not have finite quasi-equational basis. We deduce that, for a class of monoids or groups with a nontrivial member, also does not have finite quasi-equational basis.     

Distinct distances between a collinear set and an arbitrary set of points

We consider the number of distinct distances between two finite sets of points in ${\mathbb{R}}^k$, for any constant dimension $k\ge 2$, where one set $P_1$ consists of $n$ points on a line $l$, and the other set $P_2$ consists of $m$ arbitrary points, such that no hyperplane orthogonal to $l$ and no hypercylinder having $l$ as its axis contains more than $O\left(1\right)$ points of $P_2$. The number of distinct distances between $P_1$ and $P_2$ is then

$\Omega \left(min\left\{n^{2∕3}{m}^{2∕3},\frac{n^{10∕11}{m}^{4∕11}}{{log}^{2∕11}m},n^2,m^2\right\}\right).$

Without the assumption on $P_2$, there exist sets $P_1$, $P_2$ as above, with only $O(m+n)$ distinct distances between them.     

The Elekes–Szabó Theorem in four dimensions

Let F ∈ C[x, y, s, t] be an irreducible constant-degree polynomial, and let A,B,C,D ? C be finite sets of size n. We show that F vanishes on at most O(n^8/3) points of the Cartesian product A × B × C × D, unless F has a special group-related form. A similar statement holds for A,B,C,D of unequal sizes, with a suitably modified bound on the number of zeros. This is a four-dimensional extension of our recent improved analysis of the original Elekes–Szabó theorem in three dimensions. We give three applications: an expansion bound for three-variable real polynomials that do not have a special form, a bound on the number of coplanar quadruples on a space curve that is neither planar nor quartic, and a bound on the number of four-point circles on a plane curve that has degree at least five.     

Projection-Iterative Methods for a Class of Difference Equations

We develop a theoretical framework for projection-iterative methods to solve operator equations of the form Au + Bu = f, where A is a Toeplitz operator in a Banach space , B is considered as a perturbation (of general form) of A, and f is a given element in this space. The methods are adopted for application to general situations, in particular, to the equations in which A need not be a Fredholm operator. The idea to involve iteration procedures and the technique which we apply allow to obtain conditions on perturbations for convergence and effective error estimates in terms of some weighted spaces (without any restrictions on the norms for perturbations). Based on established evaluations we derive further information about decaying properties of the solutions. The obtained results are illustrated by considering concrete classes of equations as, for instance, equations corresponding to Jacobi type operators.      

An apparent critical point in binary mixtures: experimental and simulation study

We report the experimental and simulation studies for the system of nitrobenzene-cyclododecane, showing an apparent critical point, which lies in their metastable, experimentally inaccessible state, below their melting point, affecting physical and chemical properties of this system in the stable liquid phase. The nonlinear dielectric effect (NDE) was measured in the mixture of nitrobenzene with cyclododecane. The mixture has been found to show an apparent critical point which lies below the melting point, manifested as anomalous NDE behavior in the vicinity of the critical concentrations in the stable liquid phase. The melting temperature of this system was estimated using the differential scanning calorimetry method. For such a system, we also performed Monte Carlo (MC) simulations that aimed to analyze the kinds of phase transitions observed and the conditions of their occurrence in Lennard-Jones mixture. The enthalpy, configurational energy, and radial distribution function have been estimated by the MC simulation method in the N-P-T system. Immiscibility conditions according to the approach by Schoen and Hoheisel [Mol. Phys. 57, 65 (1986)] are also discussed.     

Modified SBA-15 as the carrier for metoprolol and papaverine: Adsorption and release study

A series of modified SBA-15 materials were applied in drug delivery systems. The internal surface of siliceous hexagonal structure of SBA-15 was modified with different amount of (3-mercaptopropyl)trimethoxysilane (MPTMS) and oxidized in the presence of hydrogen peroxide. The sulfonated material was loaded with metoprolol tartrate or papaverine hydrochloride. Both drugs indicated strong chemical interaction with modified mesoporous surface. The characteristic of the obtained materials was performed with XRD and DRUV-vis spectrometry, themogravimetry and nitrogen adsorption (BET) measurements. The obtained results show that modification of the mesoporous materials leads towards significant decrease of the drug delivery rate.     

1H and 19F ultra-fast MAS double-quantum single-quantum NMR correlation experiments using three-spin terms of the dipolar homonuclear Hamiltonian

Measuring internuclear distances through dipolar interaction is a major challenge for solid-state nuclear magnetic resonance (NMR) spectroscopy. Obtaining reliable interatomic distances provides an access to the local structure in ordered or disordered solids. We show that at magic angle spinning (MAS) frequencies larger than ca. 50 kHz, some of the three-spin terms of the homogeneous homonuclear dipolar Hamiltonian can be used to promote the creation of double-quantum coherences between neighbouring (1)H or (19)F spins without using dipolar recoupling pulse sequences in the Dipolar Homonuclear Homogeneous Hamiltonian (DH(3)) double-quantum/single-quantum correlation experiment. This makes it possible to probe inter-nuclear spatial proximity with limited risk of probe or sample damage from radio-frequency (RF) irradiation, and is fully appropriate for fast repetition rate offering sensitivity gains in favourable cases. Experimental demonstrations are supported by multi-spin numerical simulations, which points to new possibilities for the characterization of spin-system geometries.