简介：Wepresentnumericalcalculationoftheimpactofelectron-electroninteractiononthebehaviorofdensityofstatesandopticalpropertiesofBeO,SiCandBoron-Nitridenanotubesandsheets.Hubbardmodelhamiltonianisappliedtodescribethedynamicsofelectronsonthelatticestructureofthesescompounds.TheexcitationspectrumofthesysteminthepresenceoflocalelectronicinteractionshasbeenfoundusingmeanSeldapproach.WefindthebandgapwidthinbothopticalabsorptionanddensityofstatesreduceswithlocalHubbardelectronicinteractionparameter.Theabsorptionspectraexhibitstheremarkablepeaks,mainlyowingtothedivergencebehaviorofdensityofstatesandexcitoniceffects.AlsowecompareopticalabsorptionfrequencybehaviorofBeO,SiCandBoron-Nitridenanotubeswitheachother.FurthermoreweinvestigatetheopticalpropertiesofBeOandSiCsheets.Anovelfeatureofopticalconductivityofthesestructuresisthedecreaseoffrequencygapintheopticalspectrumduetoelectronicinteraction.

简介：在现在的纸，在有弹性的媒介嵌入的多围的碳nanotubes(MWCNT)的动态稳定性包括热环境效果被调查。到这个目的，一个非局部的Timoshenko横梁模型被开发它捕获小规模效果。碳nanotubes的动态管理方程包括轴的压缩力量的效果基于Timoshenko横梁理论被提出。然后，参量的研究被进行与简单地支持的结束支持在MWCNT的动态稳定性特征上调查静态的负担因素，温度变化，非局部的参数，苗条比率和有弹性的媒介的春天常数的影响。

简介：Athoroughunderstandingonthemechanicalpropertiesofcarbonnanotube(CNT)isessentialinextendingtheadvancedapplicationsofCNTbasedsystems.However,conductingexperimentstoestimatemechanicalpropertiesatthisscaleisextremelychallenging.Therefore,developmentofmechanisticmodelstoestimatethemechanicalpropertiesofCNTsalongwiththeintegrationofexistingcontinuummechanicsconceptsiscriticallyimportant.ThispaperpresentsacomprehensivemoleculardynamicssimulationstudyonthesizedependencyandpotentialfunctioninfluenceofmechanicalpropertiesofCNT.Commonlyusedreactivebondorder(REBO)andadaptiveintermolecularreactivebondorder(AIREBO)potentialfunctionswereconsideredinthisregard.Young'smodulusandshearmodulusofCNTsarederivedbyintegratingclassicalcontinuummechanicsconceptswithmoleculardynamicssimulations.TheresultsindicatethatthepotentialfunctionhasasignificantinfluenceontheestimatedmechanicalpropertiesofCNTs,andtheinfluenceofpotentialfieldismuchhigherwhenstudyingthetorsionalbehaviourofCNTsthanthetensilebehaviour.

简介：Inthisstudy,one-dimensionaltitaniananotubes(TNTs)weresynthesizedusingacombinedprocessofchemicalandhydrothermaltreatments,andtheiractivitiesforthephotocatalyticreactionsofselectedgaseouspollutantsatsub-ppmlevelsweredetermined.Additionally,thepropertiesoftheTNTswereexaminedusingselectedspectroscopicmethods.TheannealedTNTsshowedhigherphotocatalyticactivitiesforthefourtargetcompoundsthandidtheunannealedTNTs.Forallthetargetcompoundsexceptbenzene,theeffectoftheannealingtemperatureonthedegradationefficiencywasdifficulttodeterminebecausealldegradationefficiencieswereveryhigh.However,forbenzene,whichdecomposedwithalowefficiency,thedegradationactivitiesoftheTNTsincreasedasthetreatmenttemperaturewasincreasedfrom250to300℃,whiletheydecreasedslightlywhenthetemperaturewasincreasedfrom300to400℃.ThesefindingsconfirmthepresenceofanoptimalannealingtemperatureforthesynthesisofTNTs.Moreover,theaveragedegradationextentsforbenzene,toluene,ethylbenzene,ando-xylenedecreasedfrom92%,96%,99%,and98%to77%,86%,92%,and94%,respectively,astheairstreamflowrateincreasedwithintherangeof1-4L/min.Theaveragedegradationextentsdecreasedfrom12%,75%,87%,and88%to3%,29%,46%,and51%,respectively,astheinputconcentrationincreasedfrom0.4to1.9ppm.Overall,thesefindingssuggestthatone-dimensionalTNTscanbeeffectivelyutilizedforthedegradationofgaseouspollutantsunderoptimaloperationalconditions.

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简介：Li4Ti5O12（LTO）/carbonnanotubes（CNTs）compositematerialissynthesizedbasedonasolid-statemethodbysand-milling,spray-dryingandcalciningat8508CunderN2flow.TheLTO/CNTssampleswith1wt%and3wt%weightratioofCNTsadditionandthepristineLTOsampleareprepared.TherateperformanceandthethermalstabilityofthesesamplesareinvestigatedbasedonLiMn2O4（LMO）/LTOfull-cell.TheresultsshowthattheweightratioofCNTsadditionhasdistincteffectonLTOperformances.ThecompositematerialsofLTOcompositedCNTshavebetterperformanceathigh-rateduetotheintercalationenhancementbyconductivenetworkofCNTs.Atsecond,theoverchargingtemperatureresponseofthecell’ssurfacewith1wt%CNTsadditionisthelowest.Theparticlesizedistributionismeasuredandthemostuniformparticlesareobtainedwith1wt%CNTsaddition.ThistrendcouldexplainthatthemediumquantityofCNTsisoptimaltoimprovetheheatandmasstransferandpreventtheproblemsofcrystallitegrowinginterferenceandaggregationduringthecalcinationprocess.