Search results for " surface"

showing 10 items of 2838 documents

A Novel Na(I) Coordination Complex with s-Triazine Pincer Ligand: Synthesis, X-ray Structure, Hirshfeld Analysis, and Antimicrobial Activity

2023

The pincer ligand 2,4-bis(3,5-dimethyl-1H-pyrazol-1-yl)-6-methoxy-1,3,5-triazine (bpmt) was used to synthesize the novel [Na(bpmt)2][AuCl4] complex through the self-assembly method. In this complex, the Na(I) ion is hexa-coordinated with two tridentate N-pincer ligands (bpmt). The two bpmt ligand units are meridionally coordinated to Na(I) via one short Na-N(s-triazine) and two slightly longer Na-N(pyrazole) bonds, resulting in a distorted octahedral geometry around the Na(I) ion. In the coordinated bpmt ligand, the s-triazine core is not found to be coplanar with the two pyrazole moieties. Additionally, the two bpmt units are strongly twisted from one another by 64.94°. Based on Hirshf…

X-rayInorganic ChemistryNa(I) coordination complex; <i>s</i>-triazine pincer ligand; X-ray; Hirshfeld surface; antimicrobial activityantimicrobial activityHirshfeld surfaceGeneral Chemical EngineeringGeneral Materials ScienceNa(I) coordination complexs-triazine pincer ligandCondensed Matter PhysicsCrystals; Volume 13; Issue 6; Pages: 890
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Encapsulation of Xenon by a Self-Assembled Fe4L6 Metallosupramolecular Cage

2015

We report (129)Xe NMR experiments showing that a Fe4L6 metallosupramolecular cage can encapsulate xenon in water with a binding constant of 16 M(-1). The observations pave the way for exploiting metallosupramolecular cages as economical means to extract rare gases as well as (129)Xe NMR-based bio-, pH, and temperature sensors. Xe in the Fe4L6 cage has an unusual chemical shift downfield from free Xe in water. The exchange rate between the encapsulated and free Xe was determined to be about 10 Hz, potentially allowing signal amplification via chemical exchange saturation transfer. Computational treatment showed that dynamical effects of Xe motion as well as relativistic effects have signific…

Xenon010405 organic chemistryChemistryChemical exchangechemistry.chemical_elementGeneral Chemistry010402 general chemistry01 natural sciencesBiochemistryBinding constantCatalysis0104 chemical sciencesSelf assembledColloid and Surface ChemistryXenon13. Climate actionComputational chemistrySaturation transferChemical physicsmetallosupramolecular cagesmolecular encapsulationCageRelativistic quantum chemistrySignal amplificationta116Journal of the American Chemical Society
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Physicochemical Investigation of the Solubilization of Ytterbium Nitrate in AOT Reverse Micelles and Liquid Crystals

2006

A wide investigation of the solubilization of the water-soluble salt Yb(NO3)(3) in sodium bis(2-ethylhexyl)sulfosuccinate (AOT) reverse micelles and AOT liquid crystals has been carried out. After saturation of water/AOT/organic solvent w/o microemulsions with pure Yb(NO3)(3), the Yb(NO3)(3)/AOT composites were prepared by complete evaporation under vacuum of the volatile components (water and organic solvent) of the salt-containing microemulsions. It was observed that these composites can be totally dissolved in pure n-heptane or CCl4, allowing the solubilization of a noticeable amount of Yb(NO3)(3) in quite dry apolar media. By UV-vis-NIR, FT-IR, and H-1 NMR spectroscopies, some informati…

YtterbiumPolymers and PlasticsSmall-angle X-ray scatteringytterbium nitrateAOT reverse micelleInorganic chemistryAnalytical chemistrychemistry.chemical_elementMicelleColloid and Surface ChemistrychemistryPulmonary surfactantLiquid crystalMaterials ChemistryProton NMRionic clustersconfinement effectMicroemulsionPhysical and Theoretical ChemistrySaturation (chemistry)solubilization
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Solvent-free synthesis of ZIFs: a route toward the elusive Fe(II) analogue of ZIF-8

2019

Herein we report the synthesis of an elusive metal-organic framework, the iron(II) analogue of ZIF-8 with the formula Fe(2-methylimidazolate) , here denoted as MUV-3. The preparation of this highly interesting porous material, inaccessible by common synthetic procedures, occurs in a solvent-free reaction upon addition of an easily detachable template molecule, yielding single crystals of MUV-3. This methodology can be extended to other metals and imidazolate derivatives, allowing the preparation of ZIF-8, ZIF-67, and the unprecedented iron(II) ZIFs Fe(2-ethylimidazolate) and Fe(2-methylbenzimidazolate) . The different performance of MUV-3 toward NO sorption, in comparison to ZIF-8, results …

Zeolitic imidazolate frameworksStorage02 engineering and technologyOverpotential010402 general chemistryMetal-Organic frameworks01 natural sciencesBiochemistryCatalysischemistry.chemical_compoundColloid and Surface ChemistryImidazolateMaterialsThermal-StabilityTafel equationNanocompositeChemistryOxygen evolutionElectrocatalystsGeneral Chemistry021001 nanoscience & nanotechnology0104 chemical sciencesChemisorptionPhysical chemistryMetal-organic frameworkAdsorptionCristalls0210 nano-technologyOxygen evolutionZeolitic imidazolate framework
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Camera-based measurement of relative image contrast in projection displays

2013

International audience; This research investigated the measured contrast of projection displays based on pictures taken by un-calibrated digital cameras under typical viewing conditions. A high-end radiometer was employed as a reference to the physical response of projection luminance. Checkerboard, gray scale and color complex test images with a range of the projector's brightness and contrast settings were projected. Two local and two global contrast metrics were evaluated on the acquired pictures. We used contrast surface plots and Pearson correlation to investigate the measured contrast versus the projector's brightness and contrast settings. The results suggested, as expected, the proj…

[ INFO.INFO-TS ] Computer Science [cs]/Signal and Image Processingoptical projectors[INFO.INFO-TS] Computer Science [cs]/Signal and Image Processingprojection luminanceComputingMethodologies_IMAGEPROCESSINGANDCOMPUTERVISION[ SPI.SIGNAL ] Engineering Sciences [physics]/Signal and Image processingmeasured contrastradiometersImage color analysismetrics[INFO.INFO-TS]Computer Science [cs]/Signal and Image Processingstatistical analysispicture acquisitioncamerasgray scaleBrightnessoptical variables measurementdigital cameracamera-based measurementRadiometry[SPI.SIGNAL] Engineering Sciences [physics]/Signal and Image processingdisplay devicesDigital camerasuncalibrated digital cameraglobal contrast metricsprojector brightness settingscheckerboardcolor complex test imagesrelative image contrastviewing conditionsradiometerimage processingCorrelationPearson correlationhigh-end radiometerprojection displayprojector contrast settings[SPI.SIGNAL]Engineering Sciences [physics]/Signal and Image processingprojection displayscontrast surface plotsstatistic based metrics
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Computational approach to compact Riemann surfaces

2017

International audience; A purely numerical approach to compact Riemann surfaces starting from plane algebraic curves is presented. The critical points of the algebraic curve are computed via a two-dimensional Newton iteration. The starting values for this iteration are obtained from the resultants with respect to both coordinates of the algebraic curve and a suitable pairing of their zeros. A set of generators of the fundamental group for the complement of these critical points in the complex plane is constructed from circles around these points and connecting lines obtained from a minimal spanning tree. The monodromies are computed by solving the defining equation of the algebraic curve on…

[ MATH ] Mathematics [math]Fundamental groupEquations[PHYS.MPHY]Physics [physics]/Mathematical Physics [math-ph]Holomorphic functionGeneral Physics and AstronomyFOS: Physical sciences010103 numerical & computational mathematics01 natural sciencessymbols.namesakeMathematics - Algebraic Geometrynumerical methodsFOS: MathematicsSpectral Methods0101 mathematics[MATH]Mathematics [math]Algebraic Geometry (math.AG)Mathematical PhysicsMathematicsCurvesKadomtsev-Petviashvili equationCollocationNonlinear Sciences - Exactly Solvable and Integrable SystemsPlane (geometry)Applied MathematicsRiemann surface010102 general mathematicsMathematical analysisStatistical and Nonlinear PhysicsMathematical Physics (math-ph)Methods of contour integrationHyperelliptic Theta-FunctionsRiemann surfacessymbolsDispersion Limit[ PHYS.MPHY ] Physics [physics]/Mathematical Physics [math-ph]Algebraic curveExactly Solvable and Integrable Systems (nlin.SI)Complex plane
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Arrangements de cercles sur une sphère: Algorithmes et Applications aux modèles moléculaires representés par une union de boules

2008

Since the early work of Richard et al., geometric constructions havebeen paramount for the description of macromolecules and macro-molecularassemblies. In particular, Voronoï and related constructions have beenused to describe the packing properties of atoms, to compute molecularsurfaces, to find cavities. This thesis falls in this realm, andafter a brief introduction to protein structure, makes fourcontributions.First, using the sweep line paradigm of Bentley and Ottmann, wepresent the first effective algorithm able to construct the exactarrangement of circles on a sphere. Moreover, assuming the circlesstem from the intersection between spheres, we present a strategy to reportthe covering …

[ MATH ] Mathematics [math][SDV.OT]Life Sciences [q-bio]/Other [q-bio.OT]modèles de Van der Waals models[ INFO.INFO-MO ] Computer Science [cs]/Modeling and Simulation[MATH] Mathematics [math]robustnessArrangement of circlesconformer selectionnoyaux géométriquesVan der Waals modelsamarrage flexible[MATH]Mathematics [math][ SDV.OT ] Life Sciences [q-bio]/Other [q-bio.OT]sélection de conformers[SDV.OT] Life Sciences [q-bio]/Other [q-bio.OT]Arrangement de circles[INFO.INFO-MO]Computer Science [cs]/Modeling and Simulationprogrammation génériqueobjects courbes[INFO.INFO-MO] Computer Science [cs]/Modeling and Simulationgeometric kernelflexible dockingsurface moléculaire<br />robustessegeneric programmingcurved objectsmolecular surface area
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The non-degenerate Dupin cyclides in the space of spheres using Geometric Algebra

2012

International audience; Dupin cyclides are algebraic surfaces of degree 4 discovered by the French mathematician Pierre-Charles Dupin early in the 19th century and \textcolor{black}{were} introduced in CAD by R. Martin in 1982. A Dupin cyclide can be defined, in two different ways, as the envelope of a one-parameter family of oriented spheres. So, it is very interesting to model the Dupin cyclides in the space of spheres, space wherein each family of spheres can be seen as a conic curve. In this paper, we model the non-degenerate Dupin cyclides and the space of spheres using Conformal Geometric Algebra. This new approach permits us to benefit from the advantages of the use of Geometric Alge…

[ MATH.MATH-GM ] Mathematics [math]/General Mathematics [math.GM]Dupin cyclideDupin cyclide[INFO.INFO-GR] Computer Science [cs]/Graphics [cs.GR]010103 numerical & computational mathematics02 engineering and technologySpace (mathematics)[INFO.INFO-CG]Computer Science [cs]/Computational Geometry [cs.CG]01 natural sciencesGeometric algebra[MATH.MATH-GM]Mathematics [math]/General Mathematics [math.GM]space of spheresAlgebraic surface0202 electrical engineering electronic engineering information engineering0101 mathematicsComputingMilieux_MISCELLANEOUSMathematicsconformal geometric algebraApplied MathematicsDegenerate energy levelsConformal geometric algebra020207 software engineering[ INFO.INFO-GR ] Computer Science [cs]/Graphics [cs.GR][INFO.INFO-GR]Computer Science [cs]/Graphics [cs.GR]AlgebraConic section[ INFO.INFO-CG ] Computer Science [cs]/Computational Geometry [cs.CG]SPHERES
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Hyperbolic isometries versus symmetries of links

2009

We prove that every finite group is the orientation-preserving isometry group of the complement of a hyperbolic link in the 3-sphere.

[ MATH.MATH-GT ] Mathematics [math]/Geometric Topology [math.GT]Pure mathematicsHyperbolic groupHyperbolic linkTotally geodesic surfaces01 natural sciencesRelatively hyperbolic group57M60Mathematics - Geometric Topology[MATH.MATH-GT]Mathematics [math]/Geometric Topology [math.GT]0103 physical sciencesFOS: Mathematics0101 mathematicsMathematics[MATH.MATH-GT] Mathematics [math]/Geometric Topology [math.GT]Hyperbolic linksHyperbolic space010102 general mathematicsHyperbolic 3-manifoldHyperbolic manifoldGeometric Topology (math.GT)Algebra010307 mathematical physicsGeometry and TopologyIsometry groupHyperbolic Dehn surgeryHyperbolic Dehn surgeryTopology and its Applications
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Finite index subgroups of mapping class groups

2011

Let g ≥ 3 and n ≥ 0, and let Mg,n be the mapping class group of a surface of genus g with n boundary components. We prove that Mg,n contains a unique subgroup of index 2g−1(2g − 1) up to conjugation, a unique subgroup of index 2g−1(2g + 1) up to conjugation, and the other proper subgroups ofMg,n are of index greater than 2g−1(2g+1). In particular, the minimum index for a proper subgroup of Mg,n is 2g−1(2g − 1). AMS Subject Classification. Primary: 57M99. Secondary: 20G40, 20E28. 0 Introduction and statement of results The interaction between mapping class groups and finite groups has long been a topic of interest. The famous Hurwitz bound of 1893 showed that the mapping class group of a clo…

[ MATH.MATH-GT ] Mathematics [math]/Geometric Topology [math.GT][ MATH.MATH-GR ] Mathematics [math]/Group Theory [math.GR]General MathematicsGroup Theory (math.GR)01 natural sciencesUpper and lower bounds[MATH.MATH-GR]Mathematics [math]/Group Theory [math.GR]CombinatoricsMathematics - Geometric Topologysymbols.namesake57M99SubgroupGenus (mathematics)[MATH.MATH-GT]Mathematics [math]/Geometric Topology [math.GT]0103 physical sciencesFOS: MathematicsOrder (group theory)0101 mathematicsQuotientMathematicsRiemann surface010102 general mathematicsGeometric Topology (math.GT)Mapping class groupOrientation (vector space)symbols010307 mathematical physicsMathematics - Group Theory
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