Search results for "ALK"

showing 10 items of 4314 documents

High-Pressure Phase Diagram and Superionicity of Alkaline Earth Metal Difluorides

2018

We study the high-pressure–high-temperature phase diagram and superionicity of alkaline earth metal (AEM) difluorides (AF2, A = Ca, Sr, Ba) with first-principles simulation methods. We find that the superionic behavior of SrF2 and BaF2 at high pressures differ appreciably from that previously reported for CaF2 [Phys. Rev. Lett. 2014, 113, 235902]. Specifically, the critical superionic temperature of SrF2 and BaF2 in the low-pressure cubic fluorite phase is not reduced by effect of compression, and the corresponding high-pressure orthorhombic contunnite phases become superionic at elevated temperatures. We get valuable microscopic insights into the superionic features of AEM difluorides in b…

Alkaline earth metalMaterials scienceIonic radiusDifluorideThermodynamics02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnology01 natural sciencesFluorite0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsGeneral EnergyPhase (matter)High pressureOrthorhombic crystal systemPhysical and Theoretical Chemistry0210 nano-technologyPhase diagramThe Journal of Physical Chemistry C
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Observation of chemical reactions between alkaline-earth oxides and tungsten at high pressure and high temperature

2009

Abstract The potential chemical reactions of alkaline-earth oxides (AeO with Ae: Mg, Ca, Sr, and Ba) and tungsten are studied at high pressure and high temperature. At pressures ranging from 5 to 10 GPa and temperatures of 2000 K, a noticeable reaction between AeO and powder tungsten (W) was detected. As a product of the reaction, scheelite-structured orthotungstates (AeWO 4 ) were formed. The reactivity of alkaline-earth oxides with tungsten increases in the order Ca 2 →AeWO 4 .

Alkaline earth oxidesChemistryHigh pressureInorganic chemistrychemistry.chemical_elementGeneral Materials ScienceReactivity (chemistry)General ChemistryTungstenCondensed Matter PhysicsChemical reactionNuclear chemistryJournal of Physics and Chemistry of Solids
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An improved cathode for alkaline fuel cells

2010

Abstract The use of nickel foam as an electrode substrate in alkaline fuel cells (AFCs) has been investigated for bipolar cells incorporating an electrically conducting gas diffusion layer (GDL). Improved performance, compared to a previous design, was obtained by adding an extra active layer (AL) composed of manganese (IV) oxide (MnO2) deposited onto carbon black. This new cathode design performed significantly better (130 mA cm−2 at 0.8 V and 25 °C) than the previous design (35 mA cm−2 under the same condition), especially at higher potential. It has been shown that the GDL is a key component of the gas diffusion electrode for both performance and durability, especially with liquid electr…

Alkaline fuel cellMaterials scienceGas diffusion electrodeRenewable Energy Sustainability and the EnvironmentAnalytical chemistryOxideEnergy Engineering and Power TechnologyElectrolyteCondensed Matter PhysicsCathodelaw.inventionDielectric spectroscopychemistry.chemical_compoundFuel TechnologyChemical engineeringchemistrylawElectrodeLimiting oxygen concentrationInternational Journal of Hydrogen Energy
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Alkaline fuel cell technology - A review

2021

Abstract The realm of alkaline-based fuel cells has with the arrival of anionic exchange membrane fuel cells (AEMFCs) taken a great step to replace traditional liquid electrolyte alkaline fuel cells (AFCs). The following review summarises progress, bottleneck issues and highlights the most recent research trends within the field. The activity of alkaline catalyst materials has greatly advanced, however achieving long-term stability remains a challenge. Great AEMFC performances are reported, though these are generally obtained through the employment of platinum group metals (PGMs), thus emphasising the importance of R&D related to non-PGM materials. Thorough design strategies must be utilise…

Alkaline fuel cellMaterials scienceRenewable Energy Sustainability and the Environmentbusiness.industryEnergy Engineering and Power Technology02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnologyCondensed Matter Physics01 natural sciences0104 chemical sciencesVDP::Teknologi: 500Fuel TechnologyFuel cells0210 nano-technologyProcess engineeringbusinessAlkaline catalystInternational Journal of Hydrogen Energy
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Cytotoxic Activity and Composition of Petroleum Ether Extract from Magydaris tomentosa (Desf.) W. D. J. Koch (Apiaceae)

2015

The petroleum ether extract of Magydaris tomentosa flowers (Desf.) W. D. J. Koch has been analyzed by GC-MS. It is mainly constituted by furanocoumarins such as xanthotoxin, xanthotoxol, isopimpinellin, and bergaptene. Other coumarins such as 7-methoxy-8-(2-formyl-2-methylpropyl) coumarin and osthole also occurred. The antiproliferative activity of Magydaris tomentosa flower extract has been evaluated in vitro on murine monocye/macrophages (J774A.1), human melanoma (A375) and human breast cancer (MCF-7) tumor cell lines, showing a major activity against the latter.

AlkanePharmaceutical ScienceAnalytical ChemistryMicechemistry.chemical_compoundxanthotoxinDrug DiscoveryCytotoxic T cellPetroleum etherSettore BIO/15 - Biologia FarmaceuticaCell DeathbiologyTraditional medicineisopimpinellinxanthotoxolFlowerChemistry (miscellaneous)Molecular MedicineHumanIsopimpinellinFlowersCoumarinMagydaris tomentosaGas Chromatography-Mass SpectrometryArticlePlant Extractfuranocoumarinslcsh:QD241-441<i>Magydaris tomentosa</i>ostholelcsh:Organic chemistryCell Line TumorFuranocoumarinAlkanesBotanyAnimalsHumansPhysical and Theoretical Chemistryether extractMagydaris tomentosa; coumarins; furanocoumarins; xanthotoxin; xanthotoxol; isopimpinellin; osthole; bergaptene; MCF-7Cell ProliferationApiaceaecoumarinsAnimalPlant ExtractsOrganic ChemistrySettore CHIM/06 - Chimica Organicabiology.organism_classificationCoumarinIn vitrochemistryMCF-7XanthotoxolMCF-7ApiaceaebergapteneMolecules
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Isobaric Vapor−Liquid Equilibrium in the Systems 2,3-Dimethylpentane + Methyl 1,1-Dimethylethyl Ether, + Diisopropyl Ether and + Methyl 1,1-Dimethylp…

1999

New, consistent vapor−liquid equilibrium data for the binary systems 2,3-dimethylpentane + methyl 1,1-dimethylethyl ether, + diisopropyl ether, and + methyl 1,1-dimethylpropyl ether are reported at 101.3 kPa. The measured systems deviate slightly from ideal behavior, and only the system methyl 1,1-dimethylpropyl ether + 2,3-dimethylpentane presents an azeotrope. The activity coefficients for the solutions were correlated with their compositions by the Wilson, UNIQUAC, and NRTL models. Wisniak−Tamir equations were used to correlate the boiling points of the solutions with their compositions.

Alkanechemistry.chemical_classificationActivity coefficientUNIQUACVapor pressureGeneral Chemical EngineeringEtherGeneral Chemistrychemistry.chemical_compoundchemistryAzeotropeNon-random two-liquid modelOrganic chemistryDiisopropyl etherJournal of Chemical &amp; Engineering Data
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Adsorption and diffusion of linear and dibranched C6 paraffins in a ZSM-5 zeolite

2002

The adsorption of n-hexane and 2,2-dimethylbutane on a commercial ZSM-5 zeolite is studied under isothermal and isobaric conditions. ZSM-5 exhibits two different behaviours with linear and dibranched alkanes. A substep at 4 molec.uc−1 is observed on the adsorption isotherm of n-hexane at 348 K. A singular adsorption-desorption process is evidenced on the adsorption isobar at 5.5 kPa with 2,2-dimethylbutane at a temperature close to 343 K when the sample is activated at 298 K under vacuum. The diffusivities have been determined by fitting directly the uptake curves with a numerical resolution of second Fick's law based on finite difference method. Microporous diffusion seems to be rate limit…

Alkanechemistry.chemical_classificationAdsorptionchemistryDiffusionIsobarOrganic chemistryThermodynamicsIsobaric processMicroporous materialZeoliteIsothermal process
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Insights into the decomposition pathway of a lutetium alkylamido complex via intramolecular C–H bond activation

2017

Abstract Synthesis, characterization and reaction chemistry of lutetium alkylamido LLu(CH2SiMe3)(NHCPh3) (2), L = 2,5-[Ph2P=N(4-iPrC6H4)]2N(C4H2)–, is reported. Complex 2 undergoes cyclometalation of the NHCPh3 ligand at elevated temperatures to produce the orthometalated complex LLu(κ2−N,C-(NHCPh2(C6H4))) (3) which converts to 0.5 equivalents of bis(amido) LLu(NHCPh3)2 (4) upon heating at 80 °C for 24 h. Reaction of complex 2 with 4-dimethylaminopyridine (DMAP) does not promote alkane elimination nor imido formation. A kinetic analysis of the thermal decomposition of complex 2, supported by deuterium labelling studies and computational analysis (PBE0/def2-TZVP/SDD(Lu)), indicate direct Csp…

Alkanechemistry.chemical_classificationC h bond010405 organic chemistryLigandStereochemistryOrganic ChemistryThermal decompositionchemistry.chemical_element010402 general chemistry01 natural sciencesBiochemistryLutetium3. Good health0104 chemical scienceslutetiumInorganic ChemistryDecomposition pathwaychemistryDeuteriumIntramolecular forceMaterials Chemistrycoordination complexesPhysical and Theoretical Chemistryta116Journal of Organometallic Chemistry
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Measuring the Relative Reactivity of the Carbon-Hydrogen Bonds of Alkanes as Nucleophiles

2018

We report quantitative measurements of the relative reactivities of a series of C-H bonds of gaseous or liquid CnH2n+2 alkanes (n = 1-8, 29 different C-H bonds) towards insitu generated electrophiles (copper, silver, and rhodium carbenes), with methane as the reference. This strategy surpasses the drawback of previous model reactions of alkanes with strong electrophiles suffering from C-C cleavage processes, which precluded direct comparison of the relative reactivities of alkane C-H bonds.

Alkanechemistry.chemical_classificationC-H bond functionalization010405 organic chemistryHydrogen bondNucleophilicitychemistry.chemical_elementGeneral MedicineGeneral Chemistry010402 general chemistry01 natural sciencesMedicinal chemistryCatalysis0104 chemical scienceschemistryNucleophileAlkanes[CHIM.COOR]Chemical Sciences/Coordination chemistryReactivity (chemistry)ElectrophilicityCarbonMetal carbene complexes
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Mo–V–Nb mixed oxides as catalysts in the selective oxidation of ethane

2003

Abstract Mo–V–Nb–O mixed metal oxides, obtained by heat-treatment in N 2 at 425 °C, have been studied as catalysts in the oxidative dehydrogenation of ethane. They present higher catalytic activity, while maintaining the same selectivity to ethylene, than the corresponding metal oxides calcined under air. Both amorphous and crystalline phases are present on active and selective catalysts. The implications of the presence of these phases as well as their physicochemical characteristics on the nature of active and selective sites are discussed.

Alkanechemistry.chemical_classificationChemistryAlkeneInorganic chemistryGeneral ChemistryHeterogeneous catalysisCatalysislaw.inventionCatalysisMetallawvisual_artvisual_art.visual_art_mediumCalcinationDehydrogenationSelectivityCatalysis Today
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