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500 个结果
  • 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.

  • 标签: 水热合成 配合物 晶体结构 超分子网络 荧光性质
  • 简介:Thetitlecomplex[NH_3CH_2CH(NH_2)CH_3]_2[M(Ⅵ)O_2(OC_6H_4O)_2](M=Mo_(0.6)W_(0.4))wassynthesizedviaasimplesolution-phasechemicalroute.ThedeterminationofsinglecrystalX-raydiffractionrevealedthatthetitlecompoundiscrystallizedinamonoclinicsystemwithP2(1)/nspacegroup,a=1.0913(10)nm,b=1.0442(10)nm,c=1.8842(19)nm,α=90°,β=96.530(17)°,γ=90°,Z=4,andV=2.133(4)nm3.Themononuclearanionicunit[M(Ⅵ)O2(OC6H4O)2]2-displayschiralpseudo-octahedral[MO_6]coordinationgeometryandislinkedbychiralcationsviahydrogenbondandπ…πstackinginteraction.Thetransmissionelectronmicroscopyimagesshowthatthetitlecomplexiscomprisedofnano-particleswithdiametersrangingfrom20to50nm.TheNMRstudyshowsthe1Hdownfieldchemicalshiftsof[NH_3CHaHbCH(NH_2)CH_3]+cationsinthetitlecomplexwhenitismixedwithadenosine-triphosphate(ATP),andthechemicalshiftdifferencebetweenHaandHbisincreasedgreatly,andmostofthecatecholateligandsdissociatefromthecentralmetalatoms.TheDNAcleavageactivityexperimentrevealsthatDNAcleavagepromotedbythetitlecomplexislowerthanthatbyNa_2MoO_4whichpossessesantitumorpro-perty,buthigherthanthatbyNa_2WO_4.

  • 标签: 晶体结构 纳米颗粒 形态结构 DNA分解活性 三磷酸腺苷 复合物
  • 简介:WehavestudiedtheangularmagnetoresistanceofironpnictidesBaFe2-xNixAs2,whichshowsclear180degreeperiodicityasfittedbyacosinefunction.Inthex=0.065sample,thephaseofthetwo-foldsymmetrychanges90degreesabovethetetragonal-to-orthorhombicstructuraltransitiontemperatureTs.Sincethephaseatlowtemperatureisassociatedwiththerotationoforthorhombicdomainsbymagneticfield,weshowthatevenvacuumgreasecanpushthepresenceoforthorhombicdomainsattemperaturesmuchhigherthanTs.Ourresultssuggestthatresidualstressmayhavesignificanteffectsinstudyingthenematicordersanditsfluctuationsinironpnictides.

  • 标签: 残余应力 磁电阻 转变温度 函数拟合 斜方晶系 周期性
  • 简介:ReactionsofCuSCNwithtetramethylthiuramdisulfideinCH3CNinthepresenceofstyreneandN,N,N',N',N'-pentamethyldiethylenetriaminegaverisetoanewcopper(Ⅰ)complexofN,N'-dimethyldithio-cabamate{[Cu(S2CNMe2)]2}n.ThetitlecompoundcrystallizedinthetriclinicP-1spacegroupwithlatticeparametersα=0.7610(4)nm,b=0.8911(4)nm,c=0.9268(5)nm,α=68.66(1)°,β=83.88(2)°,γ=79.31(2)°,V=0.5748(5)nm^3,Z=2.Thecompoundhasaunique1DchainstructurecomposedofCuSCSCuSCSeight-memberedringsandapairofCu-Sbonds,thestructureofwhichhasbeendeterminedbysingle-crystalX-raycrystallography.Theisolationofthiscompoundmayprovidesomehelpfulinformationforthecauseoftheinductionperiodsofthereverseatomtransferradicalpolymerization.

  • 标签: 合成 晶体结构 N N'-二甲基二硫代铜 反向原子转移聚合 硫氰酸铜
  • 简介:Wereporteddiversesolitonoperationsinathulium/holmium-dopedfiberlaserbytakingadvantageofataperedfiber-basedtopologicalinsulator(TI)Bi2Te3saturableabsorber(SA).TheSAhadanonsaturablelossof53.5%andamodulationdepthof9.8%.Stablefundamentallymode-lockedsolitonsat1909.5nmwithdistinctKellysidebandsontheoutputspectrum,apulserepetitionrateof21.5MHz,andameasuredpulsewidthof1.26pswereobservedinthework.Byincreasingthepumppower,bothbunchedsolitonswithsolitonnumberupto15andharmonicallymode-lockedsolitonswithharmonicorderupto10wereobtained.Toourknowledge,thisisthefirstreportofbothbunchedsolitonsandharmonicallymode-lockedsolitonsinafiberlaserat2μmregionincorporatedwithTIs.

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  • 简介:Mode-andpolarization-divisionmultiplexingoffernewdimensionstoincreasethetransmissioncapacityofopticalcommunications.Selectiveswitchesarekeycomponentsinreconfigurableopticalnetworknodes.Anon-chipsilicon2×2mode-andpolarization-selectiveswitchthatcanroutefourdatachannelsontwomodesandtwopolarizationssimultaneouslyisproposedandexperimentallydemonstratedforthefirsttime,tothebestofourknowledge.Theoverallinsertionlossesarelowerthan8.6dB.Toreducetheinter-modalcrosstalk,polarizationbeamsplittersareaddedtofiltertheundesiredpolarizationsormodes.Themeasuredinter-modalandintra-modalcrosstalkvaluesarebelow-23.2and-22.8dBforallthechannels,respectively.

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  • 简介:TheAlkalineThermalTreatment(ATT)ofbiomassisoneofthefewbiomassconversionprocessesthathasapotentialforBECCS(bio-energywithcarboncaptureandstorage).Combiningin-situcarboncapturewithcreatesacarbon-neutralprocessthathasthepotentialtobecarbon-negative.Thisstudyhasshownthattheconversionofcellulosetosuppressedcanbeachievedthroughthereformingofgaseousintermediatesinafixedbedof10%Ni/ZrO2.Reformingoccursatlowtemperatures≤773K,whichcouldallowforimprovedsustainability.

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  • 简介:利用MP2和mPWPW91方法,在6-311G**和6-311++G**基组水平上研究了RDX分别与硝基、氨基和迭氮基取代的氮杂杯[2]-间-芳烃[2]三嗪和氮杂杯[2]-对-芳烃[2]三嗪形成的分子间氢键相互作用,并借助自然键轨道(NBO)和分子中的原子(AIM)理论揭示了氢键的本质.结果表明,氮杂杯[2]-间-芳烃[2]三嗪复合物中氢键主要发生在RDX与三嗪环及其取代基之间;氮杂杯[2]-对-芳烃[2]三嗪复合物中氢键主要发生在RDX与杯芳烃环及其取代基之间.分子间相互作用能在-18.82--40.62kJ/mol之间;经基组叠加误差(BSSE)校正后,相互作用能顺序为e〉f≈b〉a〉c〉d和e′〉b′〉f′〉a′〉d′〉c′.两类复合物中,氨基取代的复合物分子间氢键强于硝基或叠氮基复合物分子间氢键,氨基氮杂杯[2]-对-芳烃[2]三嗪与RDX形成的氢键最强,有望作为降低火炸药感度、进行火炸药废水处理的候选物.为获得稳定性较强的RDX-氨基氮杂杯芳烃超分子炸药,应该选取介电常数较大的溶剂.

  • 标签: 芳烃[2]三嗪 RDX 分子间氢键 MP2
  • 简介:Ahighlyeffcientandgeneralmethodforthesynthesisofpolyfunctionalized4H-pyransisestablishedthroughaone-potmulticomponentcyclocondensationofaromaticaldehydeswithCHacids,malononitrileandethylacetoacetateusingnanosilicasupportedtin(II)chlorideasacatalyst.InthismethodSnCl2/nanoSiO2wasusedasgreenandreusablecatalyst.Excellentyields,shortreactiontimes,simpleworkup,andinexpensivenessandcommerciallyavailabilityofthecatalystaretheadvantagesofthismethod.

  • 标签: 非均相催化剂 可重复使用 SiO2 合成方法 吡喃 纳米二氧化硅
  • 简介:Rare-earthcompoundsolidsuperacidSO42-/TiO2/La3+wasprepared.Itscatalyticactivitywasexaminedunderdifferentsyntheticconditionsfortheesterificationofpropanoicacidandn-butylalcoholasprobingreaction.Theoptimumconditionswerealsofound,whichwerethepH=8,thedepositingtimewas24h,themassfractionofLa(NO3)3usedinsolidsuperacidwas5%,theconcentrationofH2SO4was1.25mol/L,thesoakingtimeinH2SO4was16handthecalciningtemperaturewas500°C.TheethyloleatewassynthesizedfromoleicacidandethanolinthepresenceofSO42-/TiO2/La3+.Theoptimumreactionconditionswereobtainedwhichwerethereactiontimewas6h,molarratioofoleicacidtoethanolwas1:4andthemassfractionofcatalystwas4%.

  • 标签: 复合固体超强酸 油酸乙酯 催化合成 硫酸浓度 最佳反应条件 存放时间
  • 简介:MakinguseoftheZ2×Z2symmetry,wecouldstudythestructurenearmultipleS-treakingturningpoints.Inparticular,weshowthatthereexisttwokindsofsingularpointpaththroughdoubleSbreakingturningpointsandtripleSbieakingturningpoints,onetsquadraticturningporntpathandoneisquadraticpitchforkbifurcationpointpath.SomesimpleregularextendedsystemstocornputedoubleandtripleS-breakingturningpointsareproposed.Numericalexamplesarealsogreen

  • 标签: Z2×Z2 symmetry double S-breaking TURNING POINTS
  • 简介:AgraphGiscalledchromatic-choosableifitschoicenumberisequaltoitschromaticnumber,namelych(G)=χ(G).Ohba’sconjecturestatesthateverygraphGwith2χ(G)+1orfewerverticesischromaticchoosable.ItisclearthatOhba’sconjectureistrueifandonlyifitistrueforcompletemultipartitegraphs.Recently,Kostochka,StiebitzandWoodallshowedthatOhba’sconjectureholdsforcompletemultipartitegraphswithpartitesizeatmostfive.Butthecompletemultipartitegraphswithnorestrictionontheirpartitesize,forwhichOhba’sconjecturehasbeenverifiedarenothingmorethanthegraphsKt+3,2*(k-t-1),1*tbyEnotomoetal.,andKt+2,3,2*(k-t-2),1*tfort≤4byShenetal..Inthispaper,usingtheconceptoff-choosable(orL0-size-choosable)ofgraphs,weshowthatOhba’sconjectureisalsotrueforthegraphsKt+2,3,2*(k-t-2),1*twhent≥5.Thus,Ohba’sconjectureistrueforgraphsKt+2,3,2*(k-t-2),1*tforallintegerst≥1.

  • 标签: 猜想 完全多部图 可选择 时间 KT 色数
  • 简介:TheapplicationofLanthanumBromide(LaBr3)detectorsprovidesauniqueopportunitytomeasurelifetimeofexcitedstatesinpicosecond-nanosecondregion.Reducingthebackgroundisofcriticalimportancetogetpreciseresults.Forsomeexcitedstatesfeedingfromisomerswithlifetimelongerthan1μs,itcanbeachievedbytheSpectrometerforHeavyAtomandNuclearStructure(SHANS)[1].143Eunucleiwerepopulatedviathe123Sb(24Mg,4n)fusion-evaporationreaction.Mostoftheevaporationresiduesatgroundstateorlong-livedisomersweretransferredtodetectionterminalafteraflightofabout1.4μsinSHANS.Inthecaseof143Eu,threetransitionshavebeenobserved(Fig.1).

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