Search results for "Stack"
showing 10 items of 392 documents
Prediction of Weak Topological Insulators in Layered Semiconductors
2012
We report the discovery of weak topological insulators by ab initio calculations in a honeycomb lattice. We propose a structure with an odd number of layers in the primitive unit-cell as a prerequisite for forming weak topological insulators. Here, the single-layered KHgSb is the most suitable candidate for its large bulk energy gap of 0.24 eV. Its side surface hosts metallic surface states, forming two anisotropic Dirac cones. Though the stacking of even-layered structures leads to trivial insulators, the structures can host a quantum spin Hall layer with a large bulk gap, if an additional single layer exists as a stacking fault in the crystal. The reported honeycomb compounds can serve as…
Correlation between ball milling conditions and planar effects on Cu-nanostructured powders
2002
It is most often proposed that the process of ball milling introduces a variety of defects (vacancies, dislocations, grain boundaries, stacking faults,...) which raise the free energy of the system making it possible to produce metastable phases. But there are very few investigations that deal with the characterization and quantification of the defects produced in milled powders. XRD is really a valuable technique for a characterization in terms of size and morphology of crystallites and imperfections. In this paper, a new line profile analysis method is proposed in order to take into account the dependence of the crystallite size, of the residual strains as well as of the planar defects, o…
Competition of Dzyaloshinskii-Moriya and Higher-Order Exchange Interactions in Rh/Fe Atomic Bilayers on Ir(111)
2018
Using spin-polarized scanning tunneling microscopy and density functional theory we demonstrate the occurrence of a novel type of noncollinear spin structure in $\mathrm{Rh}/\mathrm{Fe}$ atomic bilayers on Ir(111). We find that higher-order exchange interactions depend sensitively on the stacking sequence. For fcc-$\mathrm{Rh}/\mathrm{Fe}/\mathrm{Ir}(111)$, frustrated exchange interactions are dominant and lead to the formation of a spin spiral ground state with a period of about 1.5 nm. For hcp-$\mathrm{Rh}/\mathrm{Fe}/\mathrm{Ir}(111)$, higher-order exchange interactions favor an up-up-down-down ($\ensuremath{\uparrow}\ensuremath{\uparrow}\ensuremath{\downarrow}\ensuremath{\downarrow}$) s…
The Stackelberg equilibrium as a consistent conjectural equilibrium
2011
International audience; We consider a static game with conjectural variations where some firms make conjectures while others do not. Two propositions are proved. We first show that there exists a continuum of conjectural variations such that the conjectural equilibrium locally coincides with the Stackelberg equilibrium (Proposition 1). Second, we define the conditions under which a conjectural equilibrium is a locally consistent equilibrium (i.e. such that conjectures are fulfilled). The conceptof (local) consistency is restricted to firms making conjectures. Two conditions on consistency are featured: consistency within a cohort and consistency among cohorts. The Stackelberg equilibrium fu…
Exceptionally long-lived light-emitting electrochemical cells: multiple intra-cation π-stacking interactions in [Ir(C^N)2(N^N)][PF6] emitters
2015
A series of cyclometalated iridium(iii) complexes [Ir(C^N)2(N^N)][PF6] (N^N = 2,2′-bipyridine (1), 6-phenyl-2,2′-bipyridine (2), 4,4′-di-tert-butyl-2,2′-bipyridine (3), 4,4′-di-tert-butyl-6-phenyl-2,2′-bipyridine (4); HC^N = 2-(3-phenyl)phenylpyridine (HPhppy) or 2-(3,5-diphenyl)phenylpyridine (HPh2ppy)) are reported. They have been synthesized using solvento precursors so as to avoid the use of chlorido-dimer intermediates, chloride ion contaminant being detrimental to the performance of [Ir(C^N)2(N^N)][PF6] emitters in light-electrochemical cell (LEC) devices. Single crystal structure determinations and variable temperature solution 1H NMR spectroscopic data confirm that the pendant pheny…
The first silver(I) nitrate π-complexes with unsaturated organosilicons: Synthesis and structural characterization of [Ag(DADPS)xNO3] (DADPS=diallyld…
2011
Abstract Tetraethylene glycol dimethyl ether (tetraglyme) was used for the first time to induce the activation of silver nitrate resulting in the step-by-step formation of complexes with diallyldiphenylsilane (DADPS). Two crystal compounds of this series were examined by FTIR spectroscopy and X-ray diffraction. The analysis of the obtained data showed that the Ag (C C) η 2 -interaction is involved in the synergistic effect of intra and intermolecular forces. In particular the interlayer π–π stacking interactions promoted by asymmetric weak Ag C(phenyl) bond have a significant influence on the thermal behavior and stability of the synthesized products. It was also found that a decrease of si…
Different regimes of electronic coupling and their influence on exciton recombination in vertically stacked InAs/InP quantum wires
2006
8 páginas, 8 figuras.
The polar method as a tool for solving inverse problems of the classical laminated plate theory
2000
Publisher Summary Fiber reinforced laminates are widely used in modem applications. For these kinds of structures, the Classical Laminated Plate Theory and its various extensions provide efficient methods for theoretical analysis, that is, when the stacking sequence, the orientations, and the properties of the individual laminas are known. For design of laminates, a very limited number of rules are available. For stiffriess design, two are currently known and used in practical applications: the Werren and Norris rule to get membrane isotropy, and the symmetrical sequence rule to suppress stretching/bending coupling. This chapter deals with the resolution of inverse problems of the Classical…
Cathodic reduction of hexavalent chromium coupled with electricity generation achieved by reverse-electrodialysis processes using salinity gradients
2014
Abstract A new approach for the simultaneous generation of electric energy and the treatment of waters contaminated by recalcitrant pollutants using salinity gradients was proposed. Reverse electrodialysis allows for the generation of electric energy from salinity gradients. Indeed, the utilization of different salt concentrations gives a potential difference between the electrodes which allows the generation of electric energy by using suitable electrolytes and an external circuit. The simultaneous generation of electric energy and the treatment of waters contaminated by Cr(VI) was successfully achieved for the first time by reverse electrodialysis processes using salinity gradients and pr…
3-(4-Fluorophenyl)-1-methyl-4-(4-pyridyl)quinolin-2(1H)-one
2007
The title compound, C21H15FN2O, was synthesized in the course of our studies of p38 mitogen-activated protein kinase inhibitors. It has been investigated by 1H and 13C NMR spectroscopy and was proven by X-ray crystallographic analysis to be the N-methyl rather than the O-methyl isomer. In the crystal structure, a three-dimensional network is formed consisting of quinolinone aromatic stacking interactions and weak C—H⋯O and C—H⋯N hydrogen bonds.