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500 个结果
  • 简介:在有ArSSAr的THF的SmI2反应生产了二binuclear钐thiolate建筑群[(THF)3I2-Sm(-SAr)]2[Ar=Ph(1),4-Me2NC6H4(2)]在高收益。2的结构被单个水晶X光检查晶体学描绘。2的水晶与空格组和a=0.95705(13)一起属于三斜晶系的系统nm,b=1.22287(14)nm,c=1.26450(14)nm,=64.194(11)??匭吗??v??

  • 标签: 硫醇盐 合成方法 晶体结构 结构化学
  • 简介:有N-(2-propionic酸)的新奇金轧(III)建筑群-salicyloylhydrazone(C10H10N2O4,H3L)并且1,10-phenanthroline(C12H8N2,phen)被准备并且描绘。水晶结构[Gd(H2L)(HL)-(H2O)3]2潲楰湯捩???慳楬祣潬汹?票牤穡湯??ㄠ??桰湥湡桴潲楬敮???????楢慯瑣癩瑩?

  • 标签: 邻二氮杂菲 晶体结构 X射线衍射 三斜晶系
  • 简介:利用量子化学从头计算法RHF/431G基组对氢氰酸硼氢化反应中的电子行为和轨道对称性进行了讨论.结果表明:在氢氰酸硼氢化反应中,从表面上看是对称性禁阻的“类四中心”过渡态,实质上是对称性允许的两组四中心三轨道相互作用.

  • 标签: 氢氰酸 硼氢化反应 过渡态 内禀反应坐标法
  • 简介:In[1],ShenGuangyuconstructedseveralclassesofnewsimpleLiealgebrasofcharacteristic2,whicharecalledthevariationsofG2.Inthispaper,theauthorsinvestigatetheirderivationalgebras.ItisshownthatG2anditsvariationsallpossessuniquenondegenerateassociativeforms.TheauthorsalsofindsomenonsingularderivationsofViGfori=3,4,5,6,andtherebyconstructsomeleft-symmetricstructuresonViGfori=3,4,5,6.Someerrorsaboutthevariationsofsi(3,F)in[1]arecorrected.

  • 标签: 变分 导子代数 结合型 左对称结构 LIE代数 特征
  • 简介:Theobjectinthispaperistoconsidertheproblemofexistence,uniqueness,explicilrepresentationof(0,2)-interpolationonthezerosof(1-x2)Pn-1(x)/xwhennisodd,wherePn-1denotesLegendrepolynomialofdegreen-1,andtheproblemofconvergenceofinterpolatorypolynomials.

  • 标签: INTERPOLATION CONST UNIQUENESS details polynomial arbitrary
  • 简介:1.日常生活中有关产品的工艺处理,具有增大摩擦力功效的是()A.旱冰鞋上装有滚轮B.鞋底做出凹凸不平的花纹C.自行车的轴加润滑油

  • 标签: 摩擦力 工艺处理 旱冰鞋 润滑油 自行车
  • 简介:ThispaperstudiestheelectronicstructureandnativedefectsintransparentconductingoxidesCuScO2andCuYO2usingthefirst-principlecalculations.Sometypicalnativecopper-relatedandoxygen-relateddefects,suchasvacancy,interstitials,andantisitesintheirrelevantchargestateareconsidered.Theresultsofcalculationshowthat,CuMO2(M=Sc,Y)isimpossibletoshown-typeconductivityability.ItfindsthatcoppervacancyandoxygeninterstitialhaverelativelylowformationenergyandtheyaretherelevantdefectsinCuScO2andCuYO2.Coppervacancyisthemostefficientacceptor,andunderO-richconditionoxygenantisitealsobecomesimportantacceptorandplaysanimportantroleinp-typeconductivity.

  • 标签: 多金属氧化物 电子结构 缺陷
  • 简介:ConsideringthatKBe2BO3F2(KBBF)isanoutstandingdeepultravioletcrystalwhichcangeneratetheshortestwavelengthsinsecondharmonicgenerationandsum-frequencygeneration,wereportthedeterminationofthenonlinearopticalcoefficientsoftheKBBFcrystal.Thed11coefficientwasdeterminedtobe0.49pm/VbytheMakerfringesmethodatthewavelength1064nm,whichisinagreementwellwiththetheoreticalvalue.

  • 标签: 非线性光学 KBe2BO3F2晶体 测量
  • 简介:Ru(bpy)_(3~(2+))electrochemiluminescence(ECL)wasappliedtodeterminationofrutin.ECLintensityofRu(bpy)_(3~(2+))couldbeenhancedinthepresenceofrutininbasicsolutiononplatinumelectrode.AtpH9.9,lightemissionintensitywasfoundtobelinearwithrutinintherangeof1-50mmol/L.

  • 标签: 联吡啶钌 电致化学发光 芸香苷 铂电极
  • 简介:Theeffectofbismuth(Bi)forbothVO2+/VO2+andV3+/V2+redoxcouplesinvanadiumflowbatteries(VFBs)hasbeeninvestigatedbydirectlyintroducingBionthesurfaceofcarbonfelt(CF).TheresultsshowthatBihasnocatalyticeffectforVO2+/VO2+redoxcouple.Duringthefirstchargeprocess,BiisoxidizedtoBi3+(neverreturnbacktoBimetalinthesubsequentcycles)duetothelowstandardredoxpotentialof0.308V(vs.SHE)forBi3+/BiredoxcouplecomparedwithVO2+/VO2+redoxcoupleandBi3+exhibitno(orneglectable)electro-catalyticactivity.Additionally,therelationshipbetweenBiloadingandelectrochemicalactivityforV3+/V2+redoxcouplewasstudiedindetail.2wt%Bi-modifiedcarbonfelt(2%-BiCF)exhibitsthehighestelectrochemicalactivity.Usingitasnegativeelectrode,ahighenergyefficiency(EE)of79.0%canbeachievedatahighcurrentdensityof160mA/cm2,whichis5.5%higherthanthepristineone.Moreover,theelectrolyteutilizationratioisalsoincreasedbymorethan30%.Eventhecelloperatedat140mA/cm2forover300cycles,theEEcanreach80.9%withoutobviousfluctuationandattenuation,suggestingexcellentcatalyticactivityandelectrochemicalstabilityinVFBs.

  • 标签:
  • 简介:运用水热法合成了1个新的配合物[Ni(Phtpy)2](CH3COO)2(化合物1),(Phtpy=4′-苯基-2,2′∶6′,2″-三联吡啶),并通过X-射线单晶衍射方法确定了该化合物的晶体结构.结构分析表明化合物1属于三斜晶系,P-1空间群,晶胞参数a=0.90560(8)nm,b=1.10307(9)nm,c=2.02014(15)nm,α=94.3830(10)°,β=100.9830(10)°,γ=106.3120(10)°,V=1.8831(3)nm3,Z=2,R1=0.0872,wR2=0.1831.配合物中存在3种氢键和多种π-π相互作用,使其成为一个3D配合物.

  • 标签: Ni(Ⅱ)配合物 4′-苯基-2 2′∶6′ 2″-三联吡啶 晶体结构
  • 简介:Inthiswork,theinfluenceofCO2onthestructuralvariationandcatalyticperformanceofNa2WO4/Mn/SiO2foroxidativecouplingofmethanetoethylenewasinvestigated.ThecatalystwaspreparedbyimpregnationmethodandcharacterizedbyXRD,RamanandXPStechniques.AppropriateamountofCO2inthereactantgasesenhancedtheformationofsurfacetetrahedralNa2WO4speciesandpromotedthemigrationofOinMOx,Na,Wfromthecatalystbulktosurface,whichwerefavorableforoxidativecouplingofmethane.WhenthemolarratioofCH4/O2/CO2was3/1/2,enrichedsurfacetetrahedralNa2WO4speciesandhighsurfaceconcentrationofOinMOx,Na,Wweredetected,andthenhighCH4conversionof33.1%andhighC2H4selectivityof56.2%wereobtained.WithfurtherincreaseofCO2inthereagentgases,thecontentofactivesurfacetetrahedralNa2WO4speciesandsurfaceconcentrationofOinMOx,Na,Wdecreased,whilethatofinactivespecies(MnWO4andMn2O3)increaseddramatically,leadingtolowCH4conversionandlowC2H4selectivity.ItcouldbespeculatedthatNa2WO4crystalwastransformedintoMnWO4crystalwithexcessiveCO2addedunderthereactionconditions.PretreatmentofNa2WO4/Mn/SiO2catalystbymoderateamountofCO2beforeOCMalsopromotedtheformationofNa2WO4species.

  • 标签: 结构变化 催化剂 甲烷氧化偶联 Na2WO4 MN2O3
  • 简介:合成了一维绳梯链状双金属化合物[Ni(en)2]3[Fe(CN)6]2·2H2O,并对其变温穆斯堡尔谱进行了研究,结果表明该分子磁体中铁的电子态为自旋Fe3+,而大的四极分裂值(QS)表明此化合物的[Fe(CN)6]3-单元对称结构发生了形变,低温时出现的磁弛豫谱,给出了在该温度点附近出现铁磁耦合相互作用的信息。

  • 标签: 穆斯堡尔谱 磁弛豫 形变
  • 简介:Thetitlecomplex,[La(baec)1/2(H2btec)1/2(H2O)]n(H4btec=1,2,4,5-benzenetetracarboxylicacid)(1)wassynthesizedbythehydrothermalreactionof1,2,4,5-benzenetetracarboxylicdianhydridewithLa(NO3)3·6H2OinH2O,andcrystallizesinthetriclinicsystem,spacegroupP-1withα=0.64403(3)nm,b=0.94500(4)nm,c=0.96380(5)nm,α=88.535(2)°,β=100.314(2)°,γ=76.6470(10)°,V=1.69968(10)nm^3,Z=2,andfinalR=0.0274,Rw=0.0735.In1,eachLa(Ⅲ)ioniscoordinatedbyeightoxygenatomsfromsixcarboxylategroupsandonecoordinatedwatermolecule.TwodifferentcoordinstionmodesofH4btecwerePresentinthestructure,oneofwhichcontainstwoprotonatedcarboxylategrougpstobalancethecharge.

  • 标签: 水热合成 镧配合物 结构 1 2 4 5-苯四羧酸
  • 简介:Halfsandwichirondicarbonylcomplex[η5-C5H3(t-Bu)2]Fe(CO)2Cl(1)reactswith1,2-dilithiumdiselenocarboraneLi2Se2C2B10H10(2)togiveabinuclearironcarboranecomplex[η5-C5H3(t-Bu)2]2Fe2(CO)3*Se2C2B10H10(3).TheX-raydiffractionanalysisofcomplex3revealsthatoneoftheironatomsischiral.

  • 标签: Carborane Halfsandwich IRON complex Chirality Molecular
  • 简介:我们试图做一个类似于文字接龙的游戏,从“狂热”开始,一路引申到“疯狂”、“癫狂”、“狂躁”甚至“狂躁”。这才是真正让人感兴趣的字眼,谁能否认自己的生存状态里没有狂躁的症状?(不得不说,我们绝对不是在探讨心理疾病哦!)这里有请歌手曹方和“飘乐队”来坦白交代自己的狂躁崇拜,纤弱的曹方是D.I.Y和LOMO的忠实拥趸、而“飘乐队”除了用摇滚来宣泄狂躁之外别无选择。

  • 标签: 清洗 心理疾病 游戏 引申