简介:Themonomericcobalt-phosphite-thiolatocomplex[Co(mpt)2{P(OCH3)3}2]BF4(Hmpt=2-mercaptothiazoline)hasbeenpreparedandcharacterizedbyX-raycrystallography.ThecomplexcrystallizesinthemonoclinicspacegroupC2/cwitha=0.8078(5),b=2.6020(18),c=1.2191(7)nm,β=99.38(1)°,V=2.528(3)nm3,andZ=4.Thestructurecomprisesdiscretecations[Co(mpt)2{P(OCH3)3}2.]+andanionsBF4-,inwhichthecobalt(Ⅲ)atomiscoordinatedtotwochelatempt-andtwoas-orientedmonodentateP(OCH3)3ligandsinahighlydistortedoctahedralgeometry.ThemostdistortedanglesareS(2)-Co(1)-S(2a)of162.23(10)°andN(1)-Co(1)-S(2)of71.47(13)°,thelatteriscausedbythegeometricconstraintofthebidentateligandmpt-.CyclicvoltammetryhasbeenusedtostudytheelectrochemicalbehaviorofthetitlecomplexontheRelectrodeinMeCNsolutionwith0.1mol·L-1ofBun4NBF4aselectrolyte.TheresultsindicatethatthetitlecomplexisunstableinMeCN.
简介:ThespinelLiMn2O4-x(SO4)xcompoundcathodematerialsweresynthesizedbysolid-statereactionofthecalculatedamountsofLiOH·H2O,MnO2andMnSO4.Theresultsoftheelectrochemicaltestdemonstratedthatthesematerialsexhbitedexcellentelectrochemicalproperties.Thehighestreversiblecapacityoftheseseriesofcathodematerialswas-120mAh/g,andafter50cycles,thisreversiblecapacitywasstillaround116mAh/gwithnearly100%reversibleefficiency,whichrevealedthatdopedsulfateioncouldimprovethestructuralstabilityofspinel.
简介:PolycrystallinesBi0.5Ca0.5–xLaxFe0.3Mn0.7O3(x=0,0.05,0.10,0.15,0.20,0.25)werepreparedbymoltensaltmethodandshowedperovskiteorthorhombicstructurewithspacegroupPnma.Themagneticmeasurementsindicatethatthecompoundsexhibitantiferromagneticbehaviorinatemperaturerangeof4―300K.ThemeasurementsoftransportpropertiessuggestthatthesubstitutionofLaforCaenhancedtheconductivity,andakinkappearedonthecurveoftemperaturedependenceofresistivityat275K,whichisrelatedtothespin-reorientationinthesamples.
简介:目前,国内没有关于半钢发热剂的国家标准检测方法,只能根据组分范围分别检测各个组分,不仅耗时而且使用的大量化学试剂对环境造成污染。故研究了X-射线荧光光谱法快速测定半钢发热剂中Si,P,S的方法。采用粉末压片制样,研究其制样条件,包括磨样时间、压样时间和压力对测定结果的影响。采用其它方法定值提供的检测样品,作为x-射线荧光光谱法内控标准样品,采用经验系数法进行基体校正,通过解谱拟合建立校准曲线,校准曲线建立后仪器建立漂移校正程序。实验结果精密度好,各元素的相对标准偏差在0.15%-1.3%。准确度满足生产需求,实验方法可用于快速检测半钢发热剂化学组分。
简介:基于密度泛函理论(DFT)的第一性原理平面波超软赝势方法,计算了纯MgF2晶体、Co掺杂MgF2晶体、P掺杂MgF2晶体和(Co,P)双掺杂MgF2晶体的电子结构和光学特性.结果表明,掺杂后的MgF2晶体发生了畸变,原子之间的键长也有所变化.(Co,P)双掺杂后,由于非金属原子P态和金属原子d态之间的轨道杂化,在MgF:的导带与价带之间形成了新的杂质能级,这些杂质能级一方面减小了MgF2的带隙宽度,使光吸收曲线红移到可见光区,另一方面有利于光生电子一空穴对的分离,提高了MgF2光催化效率.(Co,P)双掺杂使位于禁带中的杂质能级的态密度明显增加,导致电子从价带跃迁到杂质能级和从杂质能级跃迁到导带的概率增加,从而使其对太阳能的利用率提高.并揭示了(Co,P)双掺杂MgF2在光学元器件方面的潜在应用.
简介:SYNTHESIS AND 183W NMR CHARACTERIZATION OF P4W30Al4(H2O)2O11220- HETEROPOLYANIONSYNTHESISAND183WNMRCHARACTERIZ?..
简介:Theoptimalconditionsforthecomplexationreactionofmeso-tetra(3-methoxy-4-hy-droxyphenyl)porphineT(3-M-4HP)Pwithplatinumandrhodiumarepresented.Beer’sLawisobeyedwhentheconcentrationofrhodiumisintherangeof0.45-1.15μg/25mL.Themolarabsorptivityofrhodiumwasfoundtobe1.99×106L·mol-1·cm-1at460nm.ThevalueofεPtwasfoundtobe6.28×105L·mol-1·cm-1bylinearregressionmethod.TheKcoefficientmethodandcompensatingcoefficientwereusedtodetermineplatinumandrhodiumsimultaneoulywithoutremovalormaskingoftheinterferentsinthesample.Theresultsforthedeterminationofplatinumandrhodiuminthemixedsolutionofplatinumandrhodiumaresatisfactory.
简介:用分子动力学方法,采用Lennard-Jones势函数对空气的物理性质进行了模拟计算.在模拟过程中,针对气体的特点,应用了对系统动能和动量的控制,以及双原子分子的旋转计算.模拟了不同高度下空气压强的变化,并计算了在标准大气压下空气温度和密度不同时黏度的变化.结果表明,用分子动力学方法模拟得到的空气物理参数与实测数据吻合较好.
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.