简介:QuantumdynamicscalculationsforthetitlereactionH(2S)+S2(X3-Σg)→SH(X2Π)+S(3P)areperformedbyusingagloballyaccuratedoublemany-bodyexpansionpotentialenergysurface[J.Phys.Chem.A1155274(2011)].TheChebyshevrealwavepacketpropagationmethodisemployedtoobtainthedynamicalinformation,suchasreactionprobability,initialstate-specifiedintegralcrosssection,andthermalrateconstant.Itisfoundnotonlythatthereisareactionthresholdnear0.7eVinbothreactionprobabilitiesandintegralcrosssectioncurves,butalsothatboththeprobabilityandcrosssectionincreasefirstlyandthendecreaseasthecollisionenergyincreases.Theexistenceoftheresonancestructureinboththeprobabilityandcrosssectioncurvesisascribedtothedeeppotentialwell.Thecalculationoftherateconstantrevealsthatthereactionoccurringonthepotentialenergysurfaceoftheground-stateHS2isslowtotakeplace.
简介:利用水热方法制备了一个新的过渡金属镉配合物[Cd(1,3-BDC)(L)(H2O)2]·H2O(1,3-H2BDC=间苯二甲酸,L=2-(3-吡啶基)-1H-苯并咪唑),并通过元素分析、红外光谱和X-射线单晶衍射方法确定了该配合物的晶体结构.结构分析表明该配合物属于单斜晶系,P21/c空间群,晶胞参数a=1.01641(6)nm,b=2.08842(12)nm,C=1.00l38(6)nm,β=106.3360(10)°,V=2.0398(2)nm3,Z=4,R1=0.0207,wR2=0.494.配合物中CdⅡ“离子与L配体的1个吡啶N原子、1,3-BDC的4个氧原子和2个配位水的O原子配位,形成七配位的扭曲十面体结构.配体1,3-BDC的桥连相邻的CdⅡ离子形成一维聚合物链,相邻链间通过氢键和π…π作用形成三维超分子网络,并对该配合物的热稳定性和荧光性质进行了研究.
简介:HistoricaldataregardingZhangHeng'sseismoscopeisnotsingularproof.Actually,thefourearliesthistoricaldocuments,i.e.,ContinuationofHistoriographyofHanDynasty,HistoriographyoftheLaterHan,BookoftheLaterHanandDingRecordallhaverelevantrecordsofitsstructure,size,principle,responsetoearthquakeandactualapplications.Thesefiveaspectsaresupportedbyarchaeologicalresearch,unearthedculturalrelics,historicalearthquakesandmodernseismologicalstudy.Thesehistoricalmaterialscontainagreatdealofspecificinformationaboutthisancientseismoscope.Inconclusion,theauthenticityandreliabilityofZhangHeng'sseismoscopeareverified.
简介:ThreeseriesofCeO2/CuOsampleswerepreparedbyimpregnationmethodandcharacterizedbyXRD,N2adsorption-desorption,temperatureprogrammedreduction(TPR),XPSandTEMtechniques.IncomparisonwiththesamplespreparedwithCuOasinitialsupport,thesampleswithCu(OH)2asinitialsupporthavehigherreducibilitiesandsmallerrelativeTPRpeakareas,andalsolargerspecificsurfaceareasatcalcinationtemperaturesof400℃–600℃.Asaresult,Cu(OH)2isbetterthanCuOasinitialsupportforpreferentialoxidationofCOinexcessH2(CO-PROX).Thebestcatalyticperformancewasachievedonthesamplecalcinedat600℃andwithanatomicratioofCe/Cuat40%.XPSanalysesindicatethatmoreinterfacelinkagesCe-O-Cucouldbeformedwhenitwascalcinedat600℃.AndtheatomicratioofCe/Cuat40%ledtoaproperreducibilityforthesampleasillustratedbytheTPRmeasurements.
简介:采用扫描电镜、能谱仪以及X射线衍射仪对具有WC+β(β为钴基粘结相)两相结构的WC-11Co-0.71Cr3C2-0.06RE(RE为含La、Ce、Pr、Nd的混合稀土)硬质合金烧结体表面进行观察与分析。结果表明,在烧结过程中合金中的La、Ce、Pr、Nd通过定向迁移与烧结炉内气氛中的S、O等杂质元素结合,在合金烧结体表面形成RE2S3(主)和RE2O2S(少量)弥散相。从合金中Cr3C2的热力学稳定性、Cr在Co中的溶解度特性以及稀土原子激发等3个方面,对稀土迁移活性的激发机制和稀土原子的定向迁移机制进行分析与讨论。
简介:TheesterificationoflauricacidwithmethanolcouldbeefficientlycatalyzedbyZrOCl2·8H2O,andthisreactionwasstudiedtodevelopagreenmethodforbiodieselproduction.Theinfluencingfactors,suchasamountofcatalyst,reactiontimeandmolarratioofacidtomethanol,wereinvestigated.TheresultsindicatedthattheZrOCl2·8H2Ocatalystshowedhighcatalyticactivity,andgavea97.0%methyllaurateconversionrateunderthefollowingoptimizedconditions,viz.:alauricacid/methanolmolarratioof1:10,acatalystdosageof4%,andareactiondurationof2hatmethanolrefluxingtemperature.Thecatalystcouldbeeasilyrecoveredwhileitsactivitycouldbewellretainedafterthreecycles.TheZrOCl2·8H2Ocatalystalsoexhibitedexcellentcatalyticactivityfortheesterificationofdifferentfreelong-chainfattyacids(includingnonedibleoilswithhighacidvalue)withdifferentshortcarbonchainalcohols.Therefore,theZrOCl2·8H2Ocatalysthasgoodpotentialforthesynthesisofbiodieselfromlow-costfeedstockssuchaswastevegetableoilsandnon-edibleoils.
简介:<正>1IntroductionTheundergroundbrineresourcesdistributingwidelyinSichuanBasin,Chinahavedrawnworldwideattentionduetotheirunusualelementabundanceandexcellentquality.
简介:EstablishingpositiveandurgenttargetsforCO2reductionandemissionpeak,andpromotingenergyconservationandenergystructureadjustmentareamongthestrategiestoaddressglobalclimatechangeandCO2emissionsreduction.Theyarealsomeanstobreakthroughtheconstraintsofdomesticresourcesandenvironment,andinternalneeds,toachievesustainabledevelopment.Generallyspeaking,acountry’sCO2emissionpeakappearsafterachievingurbanizationandindustrialization.Bythen,connotativeeconomicgrowthwillappear,GDPwillgrowslowly,energyconsumptionelasticitywilldecrease,andenergyconsumptiongrowthwillslowdown-dependentmainlyonnewandrenewableenergies.Fossilfuelconsumptionwillnotincreasefurther.WhenCO2emissionreachesitspeak,theannualreductionrateofCO2intensityofGDPisgreaterthanGDPannualgrowthrate;andtheannualreductionrateofCO2intensityofenergyuseisgreaterthantheannualgrowthrateofenergyconsumption.Therefore,threeimportantapproachestopromotionofCO2emissionpeakcanbeconcluded:maintainingreasonablecontrolofGDPgrowth,strengtheningenergyconservationtosignificantlyreducetheGDPenergyintensity,andoptimizingtheenergymixtoreducetheCO2intensityofenergyuse.Byaround2030,Chinawillbasicallyhavecompleteditsrapiddevelopmentphaseofindustrializationandurbanization.ConnotativeeconomicgrowthwillappearwiththeaccelerationofindustrialstructureadjustmentThetargetofGDPenergyintensitywillstillbetomaintainanaverageannualreductionof3%orhigher.Theproportionofnon-fossilfuelswillreach20-25%,andtheaimwillbetomaintainanaverageannualgrowthrateof6-8%.Thetotalannualenergydemandgrowthof1.5%willbesatisfiedbythenewlyincreasedsupplyofnon-fossilfuels.TheannualdeclineinCO2intensityofGDPwillreach4.5%orhigher,whichiscompatiblewithanaverageannualGDPgrowth
简介:对于方程Φ(n)=S(n11),Φ2(n)=S(n11)进行了研究,并得到了这两个方程的所有正整数解,其中Φ(n)为Euler函数,Φ2(n)为广义Euler函数,S(n)为Smarandache函数。
简介:Ceriasphereswithdifferentsizesandsulfurizedproductswithcorrespondingmorphologywerepreparedbyhydrothermalandgas-solidreactionmethodat600–800°CunderCS2atmosphereforashorttime,respectively.Dimensionaleffectinpreparationofγ-Ce2S3wasfirstlyinvestigatedbymeansoftechniquessuchasscanningelectronmicroscopy(SEM),X-raydiffraction(XRD),thermalgravimetricanalysis(TGA)andspectrophotometer.Theresultsshowedthatwhenceriananoparticleswithsmallsizewereusedasprecursors,theγ-Ce2S3couldbepreparedatthelowertemperatureandthebadlysinteredproductswereobtained;whenceriananoparticleswithlargesizewereemployedasprecursors,pureγ-Ce2S3wasdifficultlyobtainedevenifthetemperaturewasupto800°Candtheproductstendedtokeeptheiroriginalsize.Theheat-resistancepropertyoftheγ-Ce2S3withlargesizewasbetterthanthesmallerone,andthepureγ-Ce2S3preparedfromprecursorwithsmallsizehadagoodpigmentaryperformance.
简介:TheemergenceofB2Belectronicmarketshasgreatlychangedtherelativebargainingpowerofbuyersandsellers.Westudytheequilibriummarketstructureinabuyer’smarket.Wefindthatbuyer-controlledB2BmarketsandneutralB2Bmarketshavedifferentequilibriumstructures,andtheemergenceofB2Bmarketswillincreasesocialwelfare,butitseffectonbuyersandsellerswillbedifferent:B2Bmarketsincreasetheconsumersurplusoftheendmarket,buttheireffectsonbuyerandsellerprofitsaremoderatedbytherelativebargainingpowerofbuyersandsellers.TheprofitsofthesidewithmuchweakerbargainingpowerwilldecreaseduetotheintroductionofB2Bmarkets.