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71 个结果
  • 简介:Thegreenlong-after-glowluminescencefromTb3+-dopedSr2SiO4phosphors,whicharesynthesizedbythehightemperaturesolidstatereactioninareductiveatmosphere,isobservedinthispaper.Theresultsshowthatunderultravioletexcitation,theobtainedphosphorsproduceanintensegreen-lighting-emissionfromtheTb3+,andthegreen-lightinglongafter-glowluminescencerelatedtoTb3+canlasthalfanhouraftertheirradiationsourcehasbeenremoved.Moreover,theeffectsofco-dopingLi+,Dy3+,Er3+,Gd3+,andYb3+withTb3+onthedecaypropertiesandthermoluminescencepropertiesareinvestigatedtoconfirmthelong-after-glowmechanism.

  • 标签: 长余辉发光 铽掺杂 固相反应合成 绿色照明 还原性气氛 衰变性质
  • 简介:沙粒病毒(Arenaviruses)遍布全球,其中的拉沙热病毒可引起致命的拉沙热.通过应用比较分子场分析(CoMFA)和比较相似性指数分析法(CoMSIA)对47个广谱沙粒病毒抑制剂进行了三维定量构效关系(3D-QSAR)分析.使用立体场、静电场、疏水场和氢键受体场组合获得最优模型CoMSIA的统计结果为Q2=0.518,R2ncv=0.972,R2pre=0.911,说明该模型的可靠性和较好预测能力.此外,模型等势线图直观地解释了分子结构与其活性的关系,为进一步设计新型高效的沙粒病毒抑制剂提供了理论依据.

  • 标签: 沙粒病毒 LASV 苯并咪唑衍生物 三维定量构效关系
  • 简介:Muscovitemicasheetswithathicknessof12mwereirradiatedbyswiftheavyionsKrandBifromHeavyIonResearchFacilityinLanzhou(HIRFL).Theuencesrangefrom11010to11012ions/cm2.Theelectronicenergyloss(dE/dx)eincreasesfrom5.9to31.5keV/nm.ThevibrationalmodicationsinirradiatedmicawereinvestigatedbyFourier-transforminfraredspectroscopyandthelatenttrackswereobservedbytransmissionelectronmicroscope(TEM).Theinfraredspectrumshowsthatmotionsfromallatomtypesinthemuscovitemicastructurecouldbefoundinmodesforallvibrations.AsshowninFig.1,theintensityofallvibrationalmodesinmica,includingtheOHstretchmotionat3621cm??1,decreasedwiththeincreasing(dE/dx)e.Thesimilartendencyisfoundinsamplesirradiatedbyswiftheavyionswithincreasingionuence.Itisindicatedthatdefectsandstructuralmodicationsgeneratedduringswiftheavyionirradiation,andmoredefectsareintroducedbyirradiationwithhigherionuence.

  • 标签: TRACK VIBRATIONAL MUSCOVITE
  • 简介:<正>近几年来,中考对作图的考查也变得多样化,作图题镶嵌于计算、推理、猜想或表述之中,让学生能真切感受到作图的用场.翻开2014以来年的海南中考试题,几乎每套试卷中都有视图与投影的考点.通常主要考查常见立体图形的三视图,由视图确定立方体的个数,及运用视图与投影知识解决生活中的实际问题等.为了帮助同学们更好地做好复习,下面以近年各地中考题为例进行分析,以期能提高大家的复习效率,帮助大家找到这类题型的解决策略.

  • 标签: 尺规作图 专题复习 复习效率 立体图形 展开图 相似三角形
  • 简介:Inthispaper,weareconcernedwiththeglobalexistenceandconvergenceratesofthesmoothsolutionsforthecompressiblemagnetohydrodynamicequationswithoutheatconductivity,whichisahyperbolic-parabolicsystem.TheglobalsolutionsareobtainedbycombiningthelocalexistenceandaprioriestimatesifH3-normoftheinitialperturbationaroundaconstantstatesissmallenoughanditsL1-normisbounded.Aprioridecay-intimeestimatesonthepressure,velocityandmagneticfieldareusedtogettheuniformboundofentropy.Moreover,theoptimalconvergenceratesarealsoobtained.

  • 标签: 磁流体方程组 整体存在性 三维可压缩 收敛速度 热导率 光滑解
  • 简介:采用HF/DFT的混合泛函PBE0和UPBE0优化了配合物[Os(PH3)2(CN)2(N^N)](其中N^N=2,2′-吡啶)的基态和激发态结构.在基态和激发态结构的基础上,利用含时密度泛函理论(TD-DFT)方法,结合极化连续介质(PCM)模型分别计算了它在二氯甲烷(1)、甲醇(2)、气态(3)和乙腈(4)溶液中的吸收和发射光谱.研究结果表明:优化得到的几何结构参数和相应的实验值符合得非常好.在极性较大的溶剂(2和4)中Os—P(1)和Os—C(1)键较长,Os—N(3)键较短,溶剂的极性会影响配合物的电子云分布.配合物在1-4溶剂中的最低能吸收和发射均来自分子轨道68→71的激发,该激发被指认为[d(Os)+π(CN)+π(N^N)→π*(N^N)]的跃迁具有混合的MLCT/LLCT特征.配合物在1-4溶剂中的最低能吸收和发射分别在471,410,488和445nm以及598,536,634和545nm,表明随着溶剂极性的逐渐增大(3〈1〈4〈2),最低能吸收和发射发生明显的蓝移.这显示出通过改变溶剂极性可以调节配合物的发光颜色.

  • 标签: Os配合物 PBE0泛函 电子结构 溶剂化显色效应
  • 简介:Two-dimensional(2D)materialshaveattractedgreatresearchinterestsduetotheiruniqueproperties.2DMoS2,unlikeitsbulkformwhichwidelyusedassolidlubricantandcatalyst,isofbrilliantapplicationprospectinnanoelectronicsandoptoelectrnics.Theelectronicdevicesworkinkindsofradiationenvironment.Toevaluatetheionradiationeffectsonmaterialpropertiesandstabilityofdevice,theswiftheavyionradiationeffectonsingle-layerMoS2wasstudiedinthiswork[1??2].

  • 标签: SWIFT HEAVY Ion
  • 简介:Underinvestigationinthispaperisa(3+1)-dimensionalvariable-coefficientKadomtsev–Petviashviliequation,whichdescribesthepropagationofsurfaceandinternalwaterwaves.ByvirtueofthebinaryBellpolynomials,symboliccomputationandauxiliaryindependentvariable,thebilinearforms,solitonsolutions,B¨acklundtransformationsandLaxpairareobtained.Variablecoefficientsoftheequationcanaffectthesolitonicstructure,whentheyarespeciallychosen,whilecurvedandlinearsolitonsareillustrated.Elasticcollisionsbetween/amongtwoandthreesolitonsarediscussed,throughwhichthesolitonskeeptheiroriginalshapesinvariantexceptforsomephaseshifts.

  • 标签: LAX对 变系数 孤立波解 方程 BACKLUND变换 双线性形式
  • 简介:Inthecurrentpaper,dry(CO2)-reformingofglycerol,anewreformingroute,wascarriedoutoveralumina(Al2O3)-supported,non-promotedandlanthanum-promotednickel(Ni)catalysts.Bothsetsofcatalystsweresynthesizedviaawetco-impregnationprocedure.Physicochemicalcharacterizationofthecatalystsshowedthatthepromotedcatalystpossessedsmallermetalcrystallitesize,hencehighermetaldispersioncomparedtothevirginNi/Al2O3catalyst.ThiswasalsocorroboratedbythesurfaceimagescapturedbytheFESEManalysis.Fromtemperature-programmedcalcinationanalysis,thederivativeweightprofilesrevealedtwopeaks,whichrepresentawatereliminationpeakatatemperaturerangeof373to473Kfollowedbynickelnitratedecompositionfrom473to573K.Inaddition,BETsurfaceareameasurementsgave85.0m2g-1forthenon-promotedNicatalyst,whilstthepromotedcatalystsshowedanaverageof1%to6%improvementdependingontheLaloadings.Significantly,reactionstudiesat873KshowedthatglyceroldryreformingsuccessfullyproducedH2.The2%La-Ni/Al2O3catalyst,whichpossessedthelargestBETsurfacearea,gaveanoptimumH2generation(9.70%)ataglycerolconversionof24.5%.

  • 标签: Ni CATALYSTS dry REFORMING LANTHANIDE promotion
  • 简介:Siliconcarbidefiber/siliconcarbidematrix(SiCf/SiC)compositesareofinterestasafuelcladdingandstructuralmaterialindesignsofadvancednuclearreactorduetotheirsuperiorthermo-mechanicalpropertiesandstabilitiesandlowcross-sectionforneutroncaptureunderthesevereserviceenvironmentincludinghightemperatureandhighenergyneutronbombardment.SiCf/SiCcompositionsconsistsofSiCfiberandSiCmatrixwhichexistinwellover100polymorphsdependentonthevariedstackingofSi-Cclose-packedatomicplanes,2H-SiC,4H-SiC,6H-SiC,3C-SiC,15R-SiC,etc.EnergeticHeatomscanbecreatedandaccumulatedvianuclearreactions.HeatomsagglomerateandcoarsenintoHebubblesandcandeterioratestructuralpropertiesbyinducingcrackandcreep.Inthisexperiment,thedamageofn-type4H-SiCwafers(researchstandard,suppliedbytheCreeResearchInc.)withathicknessof0.38mmimplantedwith100keVHe+toafluenceof31016He+/cm2andpost-implantation-annealedbehavioratdifferenttemperaturewerestudiedusingRamanscatteringspectroscopy.

  • 标签: INVESTIGATION Spectra RAMAN
  • 简介:Anefficientsynthesisoffunctionalized4H-chromenesbythetandemreactionofb,g-unsaturatedaketoesterswith2-naphthols,1-naphthols,and1,3-dihydroxynaphthaleneshasbeenaccomplishedwithhighselectivityandexcellentyieldsinthepresenceofacatalyticamountofbismuthtriflate[Bi(OTf)3,5mol%]undermildconditions.Thefunctionalized4H-chromenesynthesisandourprevious2Hchromenehemiacetalsynthesiscouldcomplementeachothertoenrichreactiondiversity.

  • 标签: 高效合成 串联反应 2-萘酚 磺酸酯 不饱和 催化
  • 简介:AnovelSr2CuInO3Soxysulfidep-typesemiconductorphotocatalysthasbeenpreparedbysolidstatereactionmethodanditexhibitsintriguingvisiblelightabsorptionpropertieswithabandgapof2.3eV.Thep-typesemiconductorcharacterofthesynthesizedSr2CuInO3SwasconfirmedbyHallefficientmeasurementandMott-Schottkyplotanalysis.First-principlesdensityfunctionaltheorycalculations(DFT)andelectrochemicalmeasurementswereperformedtoelucidatetheelectronicstructureandtheenergybandlocations.Itwasfoundthattheas-synthesizedSr2CuInO3Sphotocatalysthasappreciateconductionandvalencebandpositionsforhydrogenandoxygenevolution,respectively.Photocatalytichydrogenproductionexperimentsunderavisiblelightirradiation(λ>420nm)werecarriedoutbyloadingdifferentmetalandmetal-likecocatalystsonSr2CuInO3SandRhwasfoundtobethebestoneamongthetestedones.

  • 标签: 半导体光催化剂 可见光照射 Mott-Schottky图 P型 制氢 密度泛函理论
  • 简介:AnewSnO_2-Fe_2O_3/SWCNTs(single-walledcarbonnanotubes)ternarynanocompositewasfirstsynthesizedbyafacilehydrothermalapproach.SnO_2andFe_2O_3nanoparticles(NPs)werehomogeneouslylocatedonthesurfaceofSWCNTs,asconfirmedbyX-raydiffraction(XRD),transmissionelectronmicroscope(TEM)andenergydispersiveX-rayspectroscopy(EDX).Duetothesynergisticeffectofdifferentcomponents,theassynthesizedSnO_2-Fe_2O_3/SWCNTscompositeasananodematerialforlithium-ionbatteriesexhibitedexcellentelectrochemicalperformancewithahighcapacityof692mAh·g~(-1)whichcouldbemaintainedafter50cyclesat200mA·g~(-1).Evenatahighrateof2000mA·g~(-1),thecapacitywasstillremainedat656mAh·g~(-1).

  • 标签: 纳米Fe2O3 单壁碳纳米管 纳米复合材料 锂离子电池 电化学性能 SNO2
  • 简介:利用室温液相还原、晶种生长的方法,成功的制备了大小形貌均一、性能稳定且具有磁性的Fe3O4@Cu2O复合纳米粒子,并且对制备的Fe3O4@Cu2O纳米粒子进行了光催化性能的研究.在以紫外光为光源的照射下,合成的Fe3O4@Cu2O纳米粒子对有机染料甲基蓝溶液起到很好的降解作用.更重要的是,在外加磁场的作用下,Fe3O4@Cu2O纳米粒子容易回收,具有良好的可循环利用性能.

  • 标签: Fe3O4@Cu2O纳米粒子 晶种生长 催化剂 循环利用性
  • 简介:用分子对接和三维全息原子场作用矢量方法对36个来曲唑类衍生物和34个阿那曲唑类衍生物与芳香化酶的作用模式进行了研究,建立了三维定量构效关系模型,并在分子水平上阐述了其结合机制.运用多元线性回归(MLR)建模,同时采用内部及外部双重验证的办法对所得模型稳定性能进行深入分析和检验.MLR建模的复相关系数(Rcum)、留一法交互校验复相关系数(QCV)和外部样本校验复相关系数(Qext)分别为0.863,0.782,0.796和0.931,0.825和0.641.预测模型具有良好的稳定性和预测能力.采用AutoDock4.2软件对药物与受体之间的结合方式进行了研究.运用这些信息能为进一步设计合成强效芳香化酶抑制剂,或筛选潜在的具有更强抑制活性的天然化合物提供帮助.

  • 标签: 芳香化酶抑制剂 定量构效关系 三维全息原子场作用矢量 多元线性回归 分子对接
  • 简介:Weproposeageneralmethodologytodefinetheoptimumdopingionvolumedistributionrequiredforanefficientsolid-statelaseramplifier.ThisapproachisillustratedinthecontextoftwoexperimentaldiodepumpedYb:YAGamplifiersoperatingat300and160K.Processingofsuchtailoredgainmediaisnowpossiblethroughhorizontaldirectcrystallization.

  • 标签: diode SOLID-STATE LASER LASER GAIN medium