简介：WeuseamodifiedBecke-JohnsonexchangeplusalocaldensityapproximationcorrelationpotentialwithinthedensityfunctionaltheorytoinvestigatetheelectronicstructuresofHg1-xCdxTeandIn1-xGaxAswithxbeing0,0.25,0.5,0.75,and1.Forbothofthetwoseries,ourcalculatedenergygapsanddielectricfunctions（realpartε1andimaginarypartε2）areinagreementwiththecorrespondingexperimentalresultswithxbeingbetween0and1.Thecalculatedzero-frequencyrefractiveindexvariesgreatlywithxforHg1-xCdxTe,butchangeslittlewithxforIn1-xGaxAs,whichisconsistentwiththerealpartsoftheirdielectricfunctions.Therefore,thisnewapproachissatisfactorytodescribetheelectronicstructuresandtheopticalpropertiesofthesemiconductors.

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简介：New[1+1]and62-membered[2+2]Schiffbasemacrocyclescontaininga2,6-diamidopyridinesubunithavebeensynthesizedbycondensationreactionoftheprecursorspyridine-2,6-dicarboxamideand1,10-bis(20-formylphenyloxy)decaneinthepresenceofphosphoricacidviaaone-potprocess.Thecyclocondensedproductswereeffectivelyisolatedbygelcolumnchromatographyandcharacterizedby~1HNMR,FTIR,massspectrometryandX-rayanalysis.Thetwomacrocycleshaveatwistedstructure,andnotanopen‘circular’conformationinthesolidstate.

简介：The1,1'-binaphtholbasedoligomers3and7with3,3'-acetylene-phenylene-acetylenespacerwerepreparedfromBINOL1.ThehighopticalrotationvalueandCDspectrademonstratedthemainchainchiralityoftheoligomermolecule.TheUV-VISandfluorescentspectraevidencethecharacteristicsofconjugatedstructure.Incomparisonwitholigomer2bearing3,3'-acetylenespacer,theoligomers3and7havelongerefficientconjugationsegment,andtheirfluorescentquantumyields(φ)increased(0.60-0.65versus0.14).Extendingtheeffectiveconjugationsegmentwouldimprovethephotophysicalpropertiesofchiralconjugatedpolymers.``

简介：数列{(1+1/n)~2}的极限是数学上最重要的极限之一,关于它的存在性的证明方法已有多种,参见文[1]、[2]、[3],本文提供这个极限存在性的两种证法,并且给出用常用对数的工具计算e的近似值及进行误差估计的初等方法。

简介：Thedipole-length,velocityandaecelerationabsorptionoscillatorstrengthsforthe1s^22p-ls^2nd(3_1s^22pstatetohighlyexcitedstates(n_>10)andtheoscillatorstrengthdensitiescorrespondingtothebound-freetransitionsareobtained.

简介：AnovelSr2CuInO3Soxysulfidep-typesemiconductorphotocatalysthasbeenpreparedbysolidstatereactionmethodanditexhibitsintriguingvisiblelightabsorptionpropertieswithabandgapof2.3eV.Thep-typesemiconductorcharacterofthesynthesizedSr2CuInO3SwasconfirmedbyHallefficientmeasurementandMott-Schottkyplotanalysis.First-principlesdensityfunctionaltheorycalculations(DFT)andelectrochemicalmeasurementswereperformedtoelucidatetheelectronicstructureandtheenergybandlocations.Itwasfoundthattheas-synthesizedSr2CuInO3Sphotocatalysthasappreciateconductionandvalencebandpositionsforhydrogenandoxygenevolution,respectively.Photocatalytichydrogenproductionexperimentsunderavisiblelightirradiation(λ>420nm)werecarriedoutbyloadingdifferentmetalandmetal-likecocatalystsonSr2CuInO3SandRhwasfoundtobethebestoneamongthetestedones.

简介：ＣｏｒｒｅｌａｔｉｖｅＭｅａｓｕｒｅｍｅｎｔｓｏｆＦｉｓｓｉｏｎＦｒａｇｍｅｎｔｓａｎｄＬｉｇｈｔＰａｒｔｉｃｌｅｓ（α，ｐ）ｉｎ　Ｒｅａｃｔｉｏｎｓｏｆ４０Ａｒ＋２０９Ｂｉ，ｎａｔＡｇａｔ２５ＭｅＶ／ｕ￥ＷｕＥ?..

简介：S^p（1≤p≤∞）空间为导数属于Hardy空间H^p的复平面单位圆盘D上所有解析函数组成的空间.令函数φ和φ是D上的解析函数且φ（D）D,则将算子W（φ,φ）：f→φfoφ称为加权复合算子.文章给出了当1≤q≤p≤∞,φ∈S^∞时,加权复合算子W（φ,φ）从空间S^p到S^q上的有界性的充要条件.然后通过推广经典的Fejer-Riesz不等式证明了当1〈p≤∞时，S^p到圆盘代数A上的嵌入映射是紧的．

简介：Inthispaper,wediscussnumeroussetsofglobalparametricsufficientefficiencyconditionsundervariousgeneralized(α,η,ρ)-V-invexityassumptionsforasemiinfinitemultiobjectivefractionalprogrammingproblem.

简介：研究p-致凸Banach空间中渐近半压缩映象的修正的Mann迭代过程和修正的Ishikawa迭代过程的强收敛性．本文始终假设X是P-致凸Banach空间．最近，r-渐近半压缩映象的概念被引入，并给出了X中该映象（此时，r=P）的修正的Mann迭代过程和修正的Ishikawa迭代过程的强收敛性定理，文章所得结果改进、推广和统一了近期相关结果．

简介：ThecompressionbehaviourofPd39Ni10Cu30P21bulkmetallicglassisivestigatedatroomtemperatureupto23.5GPausinginsituhighpressureenergydispersivex-raydiffractionwithasynchrotronradiationsource.Pressureinducedstrucuralrelaxationofthebulkmetallicglassisexhibitedwithinthepressurerange.Itisfoundthatbelowabout5GPa,theexistenceofexcessfreevolumecontributestorapidstructuralrelaxation,whichgivesrisetorapidvolumeticchange.Underhigherpressure,furtherrelaxationresultsinstructuralstiffness.

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：Newmodelcompound1H,1′H-Bis（benz-Δ^4-imidazoline)2,2′-spiro-titaniumdichloridewaspreparedandthestructureofthecompoundwasdeterminedby1R,MSandelementaryanalysis.

简介：ThenumberA（d1,…,dn）ofsolutionsoftheequation0（mod1）,0

简介：WeinvestigateindetailtheeffectsofR-parityleptonnumberviolationonthedecay~↑b1→b~↑x1^0intheR-parityviolatingminimalsupersymmetricstandardmodel(Rp-MSSM)underthepresentexperimentalconstraintsonRpparameters.Inournumericalcalculationsweconsidertwocasesofinputparametersofthesquarkandsleptonsectors,MsquarkMslepton,forcomparison.TheresultsshowthattherelativeR-parityviolatingcorrectionisnotverysensitivetothemassofthelightestneutralino-0↑x1andthedegenerateR-parityviolatingcouplingparameterλ2′,butstronglydependsonMsquark,Mslepton,tanβandthedegenerateR-parityviolatingcouplingparameterλ1′.Therelativecorrectionisabout-4～3%andcanexceed-6%insomeregionofparameterspace.Therefore,preciseexperimentanalysesonthedecay~↑b1→b~↑x1^0mayprovideaprobeoftheR-parityviolation.

简介：运用算子半群理论证明了M/M/1排队模型的l^1动态解的稳定性和正等距性。

简介：ＳＹＮＴＨＥＳＩＳＡＮＤＡＮＴＩ－ＨＵＭＡＮＩＭＭＵＮＯＤＥＦＩＣＩＥＮＣＹＶＩＲＵＳ－１（ＨＩＶ－１）ＡＣＴＩＶＩＴＹＯＦ９－（２－ＰＨＯＳＰＨＯＮＹＬＭＥＴＨＯＸＹＥＴＨＹＬ）ＡＤＥＮＩＮＥ（１）ＡＮＤＩＴＳＲＥＧＩＯＩＳＯＭＥＲ３－（２－ＰＨＯ...

简介：TwopossiblereactionmechanismsofVS~+(~3∑~-,~1Γ)withCOinthegasphasehavebeenstudiedbyusingB3LYP/TZVPandCCSD(T)/6-311+G(3dr,3pd)methods:theO/Sexchangereaction(VS~++CO→VO~++CS)andtheS-transferreaction(VS~++CO→V~++COS).Thetworeactionsproceedviatwo-stepandone-stepmechanism,respectively.ThebarriersofthetripletandsingletPESsare30.6and50.9kcal/mol,respectively,forO/Sexchangereactionand7.3and50.2kcal/mol,respectively,fortheS-transferreaction.Theresultsindicatethatthetripletgroundstatereactionismorefavorable,andtheS-transferreactionismorefavorablethantheO/Sexchangereaction,whichisingoodagreementwiththeexperimentalobservation.