简介:Thedynamicbehavioroftwo-dimensionalnanostructuresisimportanttothefutureapplicationofnanodevices.Thevibrationalbehaviorsofsingle-layeredhexagonalboronnitride(h-BN)arestudiedbymoleculardynamicssimulationandcontinuumplatemodel.ThebendingstiffnessandPoisson'sratiosofh-BNalongzigzagdirectionandarmchairdirectionarecalculated.H-BNissoftercomparedwithgraphene.Thecontinuumplatemodelcanpredictthevibrationofh-BNwithfouredge-clampedboundaryconditionswell.Theelectricfieldsindifferentdirectionshaveobviousinfluenceonthevibrationofh-BN.Thenaturalfrequencyofh-BNchangeslinearlywiththeelectricfieldintensityalongthepolarizationdirection.Thenaturalfrequencyofh-BNdecreaseswiththeincreaseofelectricfieldintensityalongbothpositiveandnegativenonpolarizationdirection.Whilethenaturalfrequencyofh-BNincreaseswiththeincreaseofelectricfieldintensityalongbothpositiveandnegativetransverseelectricfield.
简介:Theeffectoftemperatureonthepropertiesofboronadsorption-desorptioninbrown-redsoil,yellowbrownsoilandcalcareousalluvialsoilofHubeiProvincewasinvestigatedwiththemobiledisplacementtechnique.TheexperimentaldataofBadsorption-desorptionamountsandreactiontimeat25and40℃werefittedbythezero-order,first-orderandparabolicdiffusionkineticequations.Theadsorptionprocesswasinconformitywiththeparabolicdiffusionlawatboththetemperatures,andthevaluesofrateconstantoftheparabolicdiffusionequationinBadsorptionwere0.138,0.124and0.105mgkg^-1min^-1/2at25℃,and0.147,0.146and0.135mgkg^-1min^1/2at40℃forthebrown-redsoil,yellow-brownsoil,andcalcareousalluvialsoil,respectively,TherelationshipbetweenamountofBdesorptionandreactiontimecouldbewelldescribedbythefirst-orderkineticequation,andthecorrespondingvaluesofrateconstantwere0.0422,0.0563and0.0384min^-1at25℃,and0.0408,0.0423and0.0401min^-1at40℃forthebrown-redsoil,theyellow-brownsoilandthecalcareousalluvialsoil,respectively.Therefore,thedesorptionprocessofBmightberelatedtotheamountofBadsorbedinsoil,Thehigherthtemperature,thelowertheamountofBadsorptionofthesamesoilinthesamereactiontime,ThevaluesoftheapparentactivationenergyofBadsorptioninthethreesoilscalculatedwiththerateconstantsofparabolicdiffusionequationwere3.27,8.44and12.99kJmol^-1,respectively,basedontheexperimentaldataofBadsorptionamountsandreactiontimeatand40℃.
简介:Thehalogenatedboron-dopeddiamond(BDD)surfaceswerereactedwithsodiumazidethroughanucleophilicsubstitutionreaction.Theresultingazide-terminatedBDDsurfaceswereusedtotriggerthe'click'reaction.Becauseoftheattractiveelectrochemicalpropertiesofferrocene-containingmolecules,suchasfastelectrontransferrates,reversibleredoxactivities,andfavorableredoxpotentials,weshowthatferrocenederivativescanbegraftedontonon-oxidizeddiamondsurfacesbyclick'chemistry'.Theseredox-activeferrocene-containinglayersonaBDDsurface,becauseoftheirabilitytostoreandreleasechargesreversibly,havethepotentialtobeusedashybridmolecular/semiconductormemorydevices.
简介:为高周波的表面的硼氮化物(BN)电影声学的波浪(锯)设备被无线电在Ti/Al/Si(111)晶片上扔频率(RF)磁控管劈啪作响。BN电影的结构被Fourier变换调查红外线(FTIR)光谱学和X光检查衍射(XRD)系列,和表面形态学和BN电影的压电的性质被原子力量显微镜学(AFM)描绘。结果证明当氮和氩的流动比率是2:18时,立方的BN(c-BN)电影与高纯净和c轴取向被扔,并且当氮和氩的流动比率是4:20时,六角形的BN(h-BN)电影与高c轴取向被扔。粒子一致、紧缩,并且粗糙分别地是1.5nm和2.29nm。h-BN电影比c-BN电影有更好压电的反应和分发。
简介:Thispaperdescribesthealloydesignphilosophyfortheimprovementoflong-termcreepstrengthoftemperedmartensitic9Crsteel,includingweldedjoints.Thecreeplifetrisinverselyproportionaltotheminimumcreeprateεmintimestheincreaseincreepratebystraindlnε/dεintheaccelerationregionastr=1.5/[(εmin)(dlnε/dε)].Theparametersεminanddlnε/dεarecloselycorrelatedwiththetimetominimumcreepratetmandthestraintominimumcreeprateεm,whichcharacterizethecreepdeformationbehaviorinthetransientregion.Theboundaryandsub-boundaryhardeningisshowntobethemostimportantstrengtheningmechanismincreepof9Crsteelandisenhancedbyfinedispersionsofprecipitatesalongboundaries.TheadditionofboronreducesthecoarseningrateofM23C6carbidesalongboundariesnearprioraustenitegrainboundariesduringcreep.Theenhancementofboundaryandsub-boundaryhardeningincreasesthetmanddecreasestheεmin,whichimprovesthecreeplife.Theboundaryandsub-boundaryhardeningissignificantlyreducedinfine-grainedregionofheataffected-zone(HAZ)ofconventionalsteelP92weldedjoints,promotingTypeⅣfracture.InNIMS9Crboronsteelweldedjoints,thedistributionofcarbonitridesalongboundariesaresubstantiallythesamebetweentheHAZandbasemetal,suppressingtheTypeⅣfracture.
简介:AtBaoshanIron&SteelCo.,Ltd.,cornercracksofboroncontainingLCAKsteelslabshadcausedremarkablequalitylossandmassflowdisorder.Withthehelpoffractographyandthermodynamicsanalysis,theembrittlementmechanismofthissteelgradewasstudiedandtheresultsareasfollows:①Thetransformationfromγtoαstartsattheaustenitegrainboundariesandalayerofthinferritefilmgraduallyformsaroundtheaustenitegrains.Strainconcentrationwillpreferentiallystartinsidetheferritephasewhenthestressaccumulatestoacertainlevel.②ThecoarseBNparticlesacceleratedlyprecipitatedattheγ/αinterfacesfurtherdeterioratetheductilityoftheferritefilm,andbrittlenessresultsinstrainconcentrationandmicrovoidcoalescenceinsidetheferritefilm.Thereforetheaustenitegrainboundariesarepronetointergranularfailure.③ThestoichiometryamongAl,NandBisaveryimportantfactorinfluencingthehotductilityofthissteelgrade.BycontrolingtheB-to-Natomicratiotoabove1,allNcanbefixedbyBinsteadofAl.Thuscoarse-grainedsteelisavailableandfewergrainboundariesandhigherductilitycanreducetheriskofcornercracks.④ByadjustingtheB-to-Natomicratio,BaoshanIron&SteelCo.,Ltd.successfullyreducedthenumberofcrackstonearlyonetenthofthatinthepastandthehottensiletestsconfirmedremarkableimprovementinthehotductilityofthissteel.
简介:ThispapercarriesouttheFirstprinciplescalculationofthecrystalstructures(zincblende(B3)androcksalt(B1))andphasetransitionofboronarsenic(BAs)basedonthedensity-functionaltheory.Usingtherelationbetweenenthalpyandpressure,itfindsthatthetransitionphasefromtheB3structuraltotheB1structuraloccursatthepressureof113.42GPa.ThentheelasticconstantsC11,C12,C44,bulkmodulus,shearmodulus,Youngmodulus,anisotropyfactor,KleinmanparameterandPoissonratioarediscussedindetailfortwopolymorphsofBAs.TheresultsofthestructuralparametersandelasticpropertiesinB3structureareingoodagreementwiththeavailabletheoreticalandexperimentalvalues.
简介:Thetheoreticalexpressionoftherelationshipbetweenoptimumdopingcontentandcrystalstructureispresentedaswellasthepreparationmethods.Byusingthisexpression,theoptimumdopingcontentofsilicon-dopedboroncarbidethinfilmiscalculated.Thequantitativecalculationvalueisconsistentwiththeexperimentalresults.Thistheoreticalexpressionisalsoappropriatetoresolvetheoptimumdopingcontentforotherelectricmaterials.
简介:Thediffusionmechanismofboroninbcc-Fehasbeenstudiedbyfirst-principlescalculations.Thediffusioncoefficientsoftheinterstitialmechanism,theB–monovacancycomplexmechanism,andtheB–divacancycomplexmechanismhavebeencalculated.ThecalculateddiffusioncoefficientoftheinterstitialmechanismisD0=1.05×10-7exp(-0.75eV/kT)m2·s-1,whilethediffusioncoefficientsoftheB–monovacancyandtheB–divacancycomplexmechanismsareD1=1.22×10-6f1exp(-2.27eV/kT)m2·s-1andD2≈8.36×10-6exp(-4.81eV/kT)m2·s-1,respectively.Theresultsindicatethatthedominantdiffusionmechanisminbcc-Feistheinterstitialmechanismthroughanoctahedralinterstitialsiteinsteadofthecomplexmechanism.ThecalculateddiffusioncoefficientisinaccordancewiththereportedexperimentresultsmeasuredinFe–3%Si–Balloy(bccstructure).Sincethenon-equilibriumsegregationofboronisbasedonthediffusionofthecomplexesassuggestedbythetheory,ourcalculationreasonablyexplainswhythenon-equilibriumsegregationofboronisnotobservedinbcc-Feinexperiments.
简介:硼(B)的增加经常被采用增加bainitic钢的hardenability。尽管它是众所周知的,那B能延迟bainitic转变动力学,B怎么在ausforming以后影响bainitic转变动力学,仍然不是清楚的。由系统的高分辨率的dilatometry测试,现在的工作表明bainitic转变动力学包括孵化时间,转变速度和转变体积部分从所有方面在ausforming以后与B增加在低C钢被加速。为没有B增加的一样的钢,相反,转变速度和转变体积部分在ausforming以后被延迟。当某硼能与脱臼交往因此提高bainite成核率,ausforming能在优先的奥氏体谷物边界减少B分离,这被建议当某硼能与脱臼交往。而且,auforming能精制bainitic捆的平均体积。基于在成核率和bainitic捆的精炼的增加之间的竞争机制,bainitic转变动力学上的B和ausforming的效果被讨论。
简介:Hydrogenthermalplasmajetwasemployedtopreparenano-sizedboronpowderwithhydrogenreductionofBCl3.Themaximumyieldofnano-sizedboronpowderswasabout50%withtheoperationalconditionsofH2/BCl3of4.5:1,totalfeedof4.9m3/h,andplasmapowerof25kW.ThesampleswereanalyzedbyX-raydiffraction(XRD),fieldemissionscanningelectronmicroscopy(FE-SEM),andinductivelycoupledplasma-massspectrometry(ICP-MS),inductivelycoupledplasma-atomicemissionspectrometry(ICP-AES),inductivecombustioninfraredabsorption(ICIA)andinfraredthermalconductivityofoxygenandnitrogenanalyzer(ITCA).Theresultsshowthattheboronpowdershavedifferentcrystalstructureswithhigherdispersionandpurity.Theaveragediameterisabout50nm,andthepurityis90.29%orso.Thisnewtechnologycanusesimpleprocesstoproducehighqualityboronpowders,andisfeasibleforindustrialproduction.