简介:Inthispaper,thedensityfunctionaltheoryhasbeenusedtoperformacomparativetheoreticalstudyofwatermonomer,dimer,trimer,andbilayeradsorptionsontheBe(0001)surface.Inourcalculations,theadsorbedwatermoleculesareenergeticallyfavouredadsorbedontheatopsites,andthedimeradsorptionisfoundtobethemoststablewithapeakadsorptionenergyof~437meV.Furtheranalyseshaverevealedthattheessentialbondinginteractionbetweenthewatermonomerandthemetalsubstrateisthehybridizationofthewater3a1-likemolecularorbitalwiththe(s,pz)orbitalsofthesurfaceberylliumatoms.Whileinthecaseofthewaterdimeradsorption,the1b1-likeorbitaloftheH2Omoleculeplaysadominantrole.
简介:Theadsorptionofproteinonnanoparticleswasstudiedbyusingdynamiclightscatteringtomeasurethehydrodynamicsizeofbothpureproteinandnanoparticlesadsorbedwithdifferentamountsofprotein.Thethicknessoftheadsorbedproteinlayerincreasesasproteinconcentration,butdecreasesastheinitialsizeofnanoparticles.Afterproperlyscalingthethicknesswiththeinitialdiameter,weareabletofitallexperimentaldatawithasinglemastercurve.Ourexperimentalresultssuggestthattheadsorbedproteinsformamonolayeronthenanoparticlesurfaceandtheadsorbedproteinmoleculesareattachedtotheparticlesurfaceatmanypointsthroughapossiblehydrogen-bonding.Ourresultsalsoindicatethatasproteinconcentrationincreases,theoverallshapeoftheadsorbedproteinmoleculecontinuouslychangesfromaflatlayerontheparticlesurfacetoastretchedcoilextendedintowater.Duringthechange,thehydrodynamicvolumeoftheadsorbedproteinincreaseslinearlywithproteinconcentration.
简介:Theadsorptionofxenonfromairhasaninterestinthemonitoringofnuclearexplosionoraccident,orinthetreatmentofnuclearwastegas.Inthispaper,theporestructureofseveralseriesofactivatedcarbonfibershasbeencharacterized.Theadsorptionpropertiesofxenonontheseactivatedcarbonfibersunderdifferenttemperatureshavebeenstudiedindetails.Theresultsshowthatthexenonadsorptionamountonactivatedcarbonfibersdonotincreasewithspecificsurfaceareaofadsorbents,butarecloselyrelatedtotheirporesizedistribution.Poreswhoseradiusequaltoornarrowthan0.4nmwouldbemoreadvantageoustotheadsorptionofxenon.
简介:Inthispaper,theselectiveadsorptionofLDLonchitosanmodifiedwithPEGandAsp.wasstudied.TheadsorptionrateofLDLandHDLonthedoublemodifiedchitosanwas57%and12%respoectively,TheresultsshownthatthedoublemodifiedchitosancanbeusedaadsorbentforselectivebindingtoLDL,thisworkmayhelptodevelopfunctionalcolumnsforhemoperfusion.
简介:StructuresofaseriesofactivatedcarbonfibersweremodifiedbyimpregnatingthemwithorganicandinorganicmaterialssuchasMethyleneblue(Mb)、p-nitrophenol(PNP)、NaClorbyoxidizingwithKMnO4orHNO3.Theinfluenceofporefillingorchemicaltreatmentontheirxenonadsorptionpropertieswasstudied.TheexperimentalresultsshowthatMbandPNPfillingofactivatedcarbonfibersresultinthedecreaseofxenonadsorptioncapacitiesofthesetreatedACFs,whichisduetothedecreaseoftheirsurfaceareaandmicro-porevolume.However,theadsorptioncapacityincreasesgreatlywithoxidizingtreatmentofactivatedcarbonfibersby7mol/LHNO3.
简介:Investigationoftheadsorptioncharacteristicsoftolueneontwohypercrosslinkedresins.Thestaticandthekineticadsorptionwerestudied.Theequilibriumadsorptiondatewasfittedtofreundlichadsorptionisothermmodelstoevaluatethemodelparameters.Theenthalpy,freeenergy,entropyareindicativeofanexothermic,aspontaneousanddisorterdecreasingprocess.ExperimentalresultsshowthatthetwoadsorbentsarebetterthantheAmberliteXAD-4forremovingthetolueneinaqueoussolutions.
简介:Bothinorganicandorganicpillaredmontmorilloniteswereusedtoadsorbphenol.BatchkineticsandisothermstudieswerecarriedouttoevaluatetheeffectofequilibriumtimeandpHonadsorptionofphenolbymontmorillouitesandre-adsorbingcharacteristicsofpillaredmontmorillonites.TheadsorptionofphenolincreasedwithincreasingsolutionpHvalues.Theeliminationratioofphenolfromthesolutionbytheabsorptionoforganicmodifiedpillaredmontmorillonite(OrPMt)reachedequilibriumquicklyaftervibratingfor5minutes.Meanwhilefororganicmontmorillonite(OrMt),pillaredmontmorillouite(PMt)andmontmorillonite(Mt),thetimetoreachphenol-absorptionequilibriumwere20,30and90minutes,respectively.Theadsorbingcapacityofthepillaredmontmorillonitemodifiedwithsurfactantimprovedgreatly.Thephenol-adsorbingcapacityofpillaredmontmorillonitesmainlydependedonmicroporousstructureandsurfacecomponentofthemodifiedclays.Aftercalcinationat500℃,thepillarstructureandthebasalspacing(1.83nm)werestillstable.Sothepillaredmontmorillonitecouldberecycled,anditwasapotentialmaterialforadsorbingenvironmentalpollutants.
简介:Theadsorptionbehaviorofdyesonavarietyofsisalbasedactivatedcarbonfibers(SACF)hasbeenstudiedinthispaper.TheresultsshowthatthiskindofACFhasexcellentadsorptioncapacitiesforsomeorganic(dye)molecules.SACFcanremovenearlyallmethyleneblue,crystalviolet,bromophenolblueandEriochromeblueblackRfromwaterafterstaticadsorptionfor24h.at30℃.Theadsorptionamountscanreachmorethan400mg/gwhenadding50mgSACFinto50mldyesolution.Underthesameconditions,theadsorptionamountsofxylenolorangefluoresceinandEriochromeblackTwreelower.Ontheotherhand,theadsorptionamountschangealongwiththecharacteristicsofadsorbents.TheSACFsactivatedabove840℃,whichhavehigherspecificsurfaceareasandwiderporeradii,havehigheradsorptionamountsforthedyes.TheresearchingresultsalsoshowthattheadsorptionratesofdyesontoSACFsdecreasebytheorderofmethyleneblue,EriochromeblueblackRandcrystalviolet.
简介:TheapplicationofXzeoliteintheareasforproducingpara-xylenebyadsorptiveseparation,N2/O2separation,etc.,wasreviewed,andtheframeworkSiO2/Al2O3molarratio,thecationsandthewatercontentofXzeolitesignificantlyaffecteditsselectivityandcapacity.Astheactivecomponentofpara-xyleneadsorbent,theXzeolitewithaframeworkSiO2/Al2O3molarratioof2.2-2.4coupledwithcationsofBa^2+andK^+,aswellasawatercontentof4.0%-5.0%exhibitedhigherpara-xyleneselectivity.ForN2/O2separation,higherN2capacityandN2/O2separationfactorwereachievedwhentheXzeolitehadaframeworkSiO2/Al2O3molarratioof2.0coupledwithLi^+cations.TheintroductionofanothercationinXzeolitecouldfurtherincreasetheN2/O2separationfactor,whiletheadsorptionofwater,however,couldleadtoaremarkabledecreaseofN2capacity.Besides,theXzeolitecouldbeusedinadsorptiveseparationofhighlypureHeandselectiveadsorptionofCO2,CO,CH4,N2,Ar,andH2.
简介:Severalmacroporouspolymericadsorbents(NDA-999,XAD-8,X-5andXAD-2)wereemployedinthestudytoadsorbphenylaceticacidfromaqueoussolution.EffectofsaltandambienttemperatureonadsorptionwasstudiedusingNDA-999adsorbentandtheadsorptionprocessconformstoFreundlich'smodelreasonably.Adsorptiondynamicswereconductedinbatchexperimentsinordertomakeclearthemechanismofadsorptionprocess.Itisprovedthatthesquareddrivingforcemasstransfermodelcanbeadoptedtoelucidatetheprocess.Thetreatmentprocessofindustrialwastewatercontaininghighstrengthofphenylaceticacidwasproposedforcleanerproductionofphenylaceticacid.
简介:Theadsorptionofphenolandnitrophenolsonhypercrosslinkedpolymericadsorbentwasstudiedasafunctionofthesolutionconcentrationandtemperature.Adsorptionisothermsofphenolandnitrophenolsonhypercrosslinkedresinweredetermined.TheseisothermsweremodeledaccordingtotheFreundlichadsorptionisotherm.TheisothermsforphenolandnitrophenolsonhypercrosslinkedresinwereassignedasLcurves.Thermodynamicparameterswerecalculatedforallphenolandnitrophenols.Thekineticsexperimentresultsshowedthattheadsorptionrateswereofthefirst-orderkinetics.Therateconstantsat303Kwerecalculated.
简介:Inthispaper,benzeneadsorptionisothermandtheirhysteresisontwoimportantlocaldiatomitesweredeterminedat25℃,andtheirsiliconhydroxylgroup(SiOH)numberwasdetermined,theirpropertieswerereported,andtherelationshipbetweensurfacestructure,surfaceSiOHnumberpernm2andadsorptionisothermwithhysteresiswasdiscussed.Thespecificsurfacewasalsocalculatedfromtheisotherms,andpore-sizedistributionwasdetermined.
简介:Theisothermaladsorptionofdyesonavarietyofsisalbasedactivatedcarbonfibers(SACFs),andtheinfluenceofpHandtemperatureonadsorptionarediscussedinthispaper.Theresultsindicatethattheadsorptionofmethyleneblue,crystalvioletandEriochromeblueblackRonSACFsshowstypeIisothermsandcanbedescribedbytheLangmuirequationortheFreudlichequation.Theacidityofsolutionhasgreatlyinfluenceovertheadsorptionamountsofmethyleneblue,crystalvioletandEriochromeblueblackR.AspHsofthesolutionswereadjustedtoincreaseordecreasefromtheoriginalacidityofthesolution(4.7,4.1and4.0formethyleneblue,crystalvioletandEriochromeblueblackR,respectively),theamountsofdyesadsorbedonSACFsincreased.Theadsorptiontemperature(intherangeof25-50℃)exertslittleinfluenceontheadsorptionamountofmethyleneblue,crystalvioletandfluorescein.Forazodyes(EriochromeblueblackRandEriochromeblackT),however,theadsorptionamountincreasesslightlywiththeelevationoftemperature.
简介:Theadsorptionkineticsandmechanismofanovelchelateresin,macroporousphosphonicacidresin(PAR)forIn(III)wereinvestigated.Thestaticallysaturatedadsorptioncapacityis216mg·g-1resinat298KinHAc-NaAcmedium.Theapparentadsorptionrateconstantisk298=4.84×10-5s-1.TheadsorptionbehaviorofPARforIn(III)obeystheFreundlichisotherm.Thethermodynamicadsorptionparameters,enthalpychange△H,freeenergychange△Gandentropychange△SofPARforIn(III)are11.5kJ/mol,-12.6kJ/moland80.8J/mol·K,respectively.TheapparentactivationenergyisEa=3.5kJ/mol.ThemolarcoordinationratioofthefunctionalgroupofPARtoIn(III)isabout3∶1.