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Luo 2015 a Mass Conserving Level Set Method for Detailed Numerical Simulation of Liquid Atomization

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Accepted Manuscript A mass conserving level set method for detailed numerical simulation of liquid atomization Kun Luo, Changxiao Shao, Yue Yang, Jianren Fan PII: S0021-9991(15)00395-2 DOI: http://dx.doi.org/10.1016/j.jcp.2015.06.009 Reference: YJCPH 5945 To appear in: Journal of Computational Physics Received date: 17 November 2014 Revised date: 2 June 2015 Accepted date: 5 June 2015 Please cite this article in press as: K. Luo et al., A mass conserving level set method for detailed numerical simulation of liquid atomization, J. Comput. Phys. (2015), http://dx.doi.org/10.1016/j.jcp.2015.06.009 This is a PDF file of an unedited manuscript that has been accepted for publication. As a service to our customers we are providing this early version of the manuscript. The manuscript will undergo copyediting, typesetting, and review of the resulting proof before it is published in its final form. Please note that during the production process errors may be discovered which could affect the content, and all legal disclaimers that apply to the journal pertain.
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Accepted ManuscriptAmassconservinglevelsetmethodfordetailednumericalsimulationofliquidatomizationKunLuo,ChangxiaoShao,YueYang,JianrenFanPII: S0021-9991(15)00395-2DOI: http://dx.doi.org/10.1016/j.jcp.2015.06.009Reference: YJCPH5945Toappearin: Journal of Computational PhysicsReceiveddate: 17November2014Reviseddate: 2June2015Accepteddate: 5June2015Pleasecitethisarticleinpressas:K.Luoetal.,Amassconservinglevelsetmethodfordetailednumericalsimulationofliquidatomization,J. Comput. Phys.(2015),http://dx.doi.org/10.1016/j.jcp.2015.06.009This is a PDFle of anuneditedmanuscript that has beenacceptedfor publication. As a service toour customers we are providingthisearlyversionof themanuscript. Themanuscript will undergocopyediting, typesetting, andreviewof theresultingproof beforeit ispublishedinitsnalform. Pleasenotethatduringtheproductionprocesserrorsmaybediscoveredwhichcouldaffectthecontent, andalllegaldisclaimersthatapplytothejournalpertain.1 A mass conserving level set method for detailed numerical simulation of liquid atomization By Kun Luo1, Changxiao Shao1, Yue Yang2, Jianren Fan1* 1State Key Laboratory of Clean Energy Utilization Zhejiang University, Hangzhou 310027, P. R. China 2State Key Laboratory of Turbulence and Complex Systems Peking University, Beijing 100871, P. R. China Submitted to Journal of Computational Physics *Corresponding author, E-mail: [email protected], Tel: 86-0571-87951764 2 Abstract:Animprovedmassconservinglevelsetmethodfordetailednumerical simulations of liquid atomization is developed to address the issue of mass loss in the existing level set method. This method introduces a mass remedy procedure based on thelocalcurvatureattheinterface,andinprinciple,canensuretheabsolutemass conservation of the liquid phase in the computational domain. Three benchmark cases, includingtheZalesaksdisk,adropdeforminginavortexfield,andthebinarydrop head-oncollision,aresimulatedtovalidatethepresentmethod,andtheexcellent agreementwithexactsolutionsorexperimentalresultsisachieved.Itisshownthat thepresentmethodisabletocapturethecomplexinterfacewithsecond-order accuracyandnegligibleadditionalcomputationalcost.Thepresentmethodisthen appliedtostudymorecomplexflows,suchasadropimpactingonaliquidfilmand theswirlingliquidsheetatomization,whichagain,demonstratestheadvantagesof mass conservation and the capability to represent the interface accurately. Keywords:Liquidatomization;Interfacecapturing;Levelsetmethod;Mass conservation; Swirl atomization 3 1 Introduction Problemsinvolvingmovingboundariesandinterfacesexistinawiderangeof applications, such as multiphase flow, image processing and premixed combustion. In multiphaseflow,theliquidatomizationoccursinmostofpropulsiondevices.The liquidfuelisinjectedintocombustionchamberandsubsequentlyundergoesthe processofatomization,evaporationandcombustion.Sincetheatomizationprocess governstheresultantliquiddropletfeatures,itstronglyaffectsboththecombustion efficiencyandpollutantemissions.Therefore,itiscrucialtoaccuratelypredictthe interface in the process of liquid atomization. Ingeneral,twoclassesofmethodsareusuallyusedtolocatetheinterface:the interfacetrackingmethodandtheinterfacecapturingmethod.Interfacetracking schemestypicallyuseeitherthearbitraryLagrangian-Eulerian(ALE)methodbased on a mesh that deforms with the interface or the marker and cell (MAC) method that advectsLagrangianparticlestodefineafluidflowfieldbytheirlocations[1][2][3]. The main drawback of the interface tracking method is that topology changes are not handledautomatically,whichpreventstheapplicationofthismethodfromdirect numerical simulation (DNS) of primary atomization [4]. Interface capturing methods include the volume of fluid (VOF) method, the level set method, and the phase field method. Comprehensive reviews of these methods can be found in literature [5][6][7]. The VOF method captures the liquid volume fraction ineachgridcellandhasexcellentmassconservationproperty.However,itsuffers fromthechallengeofaccuratelyreconstructinginterfacebasedonlyontheliquid volume fraction. Moreover, a specific advection scheme is required and the interface normalandcurvaturemaynotbeevaluatedaccurately,whichaddsmoreconstraints on the accuracy of the VOF method. The level set method represents the interface as aniso-surfaceofascalarfunctionthatisalsoreferredasthelevelsetfunction.The interfaceissharpanditsnormalandcurvaturecanbeeasilycalculated.Inaddition, thismethodisabletohandletopologychanges.However,mostoftheexistinglevel setmethodslackmassconservationproperty.Thephasefieldisdefinedtobeeither the difference between or the fraction of one of the concentrations of the two mixtures [8],andsharpfluidinterfacesarereplacedbythinbutnonzerothicknesstransition regions where the interfacial forces are smoothly distributed. The phase field method is similar to the level set method to some extent, but it suffers from more constraints 4 [9][10].Asaresult,thelevelsetmethodhasbecomemoreandmorepopularin simulationsofgas-liquidmultiphaseflowsowingtoitssimplicityandefficiencyin the recent years. Despite of the inherent advantages, the level set method suffers from unphysical loss of the fluid mass as time evolves. There are two main reasons for the mass loss in theexistinglevelsetmethod.Firstly,thediscretizationofthelevelsetequationmay lead to significant numerical dissipation that usually manifests itself as a loss of mass inareasofhighcurvatureorotherunder-resolvedregions[11].Secondly,inthe re-initialization process for keeping the level set function as a signed distance function, the zero level set can be altered owing to numerical artifacts, which leads to additional mass loss. Many attempts have been made to improve the mass conservation property ofthelevelsetmethod.Theimprovementscanbeclarifiedintofourcategoriesas follows. (1) High-order discretization of the level set equation As the numerical error comes from the discretization of the level set equation, it isstraightforwardtoimprovetheaccuracybyincreasingtheorderofdiscretization schemes. Nourgaliev et al. [12] used 5th-order linear WENO scheme to discretize the level set equation and pointed out mass losses were reduced compared to lower order scheme.Salihetal.[13]examinedthefirst-orderupwindscheme,theMacCormack method,thesecond-orderENOschemeandthefifth-orderWENOscheme,and demonstratedthatthelevelsetmethodperformedbetterwhenhigh-orderschemes wereusedforsolvingtheadvectionequation.Inaddition,Sheuetal.[14][15] proposed a dispersion relation preserving advection scheme that is able to sharpen the interfaceandthenumericalresultsshowedgoodagreementwiththeexperimental results. Discontinuous Galerkin method was first proposed by Reed and Hill [16] and hasbeenusedwildlyinthediscretizationofthelevelsetequationbecauseitisa compactschemewiththehigh-orderaccuracy[17][18][24].Moreover,the semi-Lagrangian approach is a discretization scheme that overcomes the problems of thesevereCFLconditionandthedistortedmesh.Ithasbeenappliedtothe discretizationofthelevelsetfunctionbyusinganefficient,first-orderaccurate semi-Lagrangianadvectionscheme[19][20]andahigh-orderschemein[21]. However, the mass conservation is still an issue for simulations of some shearing and vortical velocity fields even with the above-mentioned high-order schemes. 5 (2) Extension velocity level set methods Instead of the high-order discretization of the level set equation, Adalsteinsson et al. [22] believed that the level set equation can be transported by an extension velocity rather than the fluid velocity. This idea was based on the fact that the gradient of the level set function grows very rapidly with time in shearing velocity fields. In order to maintainasigneddistancefunction,twoapproacheshavebeenapplied.Oneis allowedtodeviatefromthesigneddistancefunctionandthencorrectedvia re-initialization.Theotheristhatthevelocityfieldisconstructedspeciallysothat 1 =is preserved, here is the signed distance function. The extension velocity that satisfies0extF = would maintain the signed distance function for all time, whereFextistheextensionvelocity.Withtheextensionvelocity,Ovsyannikovetal. [23]maintainedthesigneddistancefunctionbyintroducingthesourcetermdirectly intothelevelsetequation.However,theextensionvelocityisonlythefirst-order approximationtothevelocityfieldneartheinterface,anditmayleadtounexpected numericalartifactsduetothestrictrequirementofthelocalsolutionforthe characteristicsoftheflowneartheinterface[24].Recentlytheapproachof Ovsyannikov et al. [23] has been extended to higher-order accuracy and its numerical assessment has been conducted [25]. (3) Hyperbolic tangent level set methods Instead of the signed distance function, Olsson et al. [26][27] firstly proposed the hyperbolic tangent function as the level set function. It has the second-order accuracy andisofgoodmassconservationintheregionboundedbytheinterface.This approach has been used in many studies [28][29][30][31][32], but it can lead to small piecesoffluidcalledflotsamandjetsamnon-physicallybreakingofffromthe interfaceinunder-resolvedregionsandmovingaroundwitherroneousvelocity.In addition,Kohnoetal.[33]presentedanovelnumericalmethodforsolvingthe advection equation of the level set function using the hierarchical-gradient truncation and remapping technique. (4) Improvement of the re-initialization The re-initialization is necessary in general to maintain the level set function as a signeddistancefunction.Thepartialdifferentialequation(PDE)based re-initializationprocedurewasoriginallyproposedin[34].Theequation ( )( )1tsign = issolvedsothatitisadistancefunctionwithoutchangingits 6 zerolevelset.Theimprovementscanbefoundin[35][36][37][38][39].Changetal. [40]proposedare-initializationprocedureinvolvingsolvingaperturbed Hamilton-Jacobi equation to a steady state. With the development of the conservative levelsetmethodwithhyperbolictangentlevelsetfunction,thecorresponding reinitializationequationissolvedinvariouscases[26][27][30].McCaslinand Desjardins[41]furtherimprovedthere-initializationequationtoaccountfor significant amount of spatial variability in level set transport. To reduce computational cost in the re-initialization, the fast marching method (FMM) was developed to solve the re-initialization equation at the interface and marches outwards to create a signed distancefunctioninasinglesweepthroughthedata,insteadofsolvingthe re-initializationequationforanumberoftimesteps.Itisstraightforwardtoextend thismethodtoachievehigher-orderaccuracy[30][42][43].Somealternative re-initializationmethodshavealsobeenproposedrecently,suchasthegeometric mass-preservingredistancingscheme[44]andthevolume-reinitializationscheme including the effect of local curvature [45]. (5) Hybrid method Taking advantages ofmassconservation property ofthe VOFmethod, Sussman etal.[46][47]developedacoupledlevelset/volume-of-fluid(CLSVOF)method. AlthoughtheCLSVOFmethodanditsvariantshavebeenappliedinvarious applications [48][49][50][51][52][53], they suffer from unphysical flotsam and jetsam. In addition, procedures for the advection of both the level set function and the volume fraction, the piecewise linear interface construction, and the subsequent reconstruction oflevelsetscalarbasedonthispiecewiselinearinterfacearequitecomplicated. Recently, several improved coupled level set and VOF methods have been developed, suchastheVOSETmethod[54],theconservationcorrectionequationmethod[55], and the level set-volume constraint method [56]. Since the major issue for the hybrid methodsisthecomplexityinimplementation,itisnotedthatPijletal.[57][58] proposedamass-conservingmethod,inwhichlevelsetandvolumefractionwere usedwithoutthecomplicatedinterfaceconstructions.Additionally,theparticlelevel setmethodwasdevelopedasanumericalschemethatcombinestheaccuracyofthe Lagrangianfronttrackingwithsimplicityandtheefficiencyofthelevelsetmethod [11].Inthismethod,Lagrangianmarkerparticlesarepassivelyadvectedwithflow andareusedtorebuildthelevelsetfunctioninunder-resolvedregions 7 [59][60][61][62]. (6) Spatially adaptive level set method Ingeneral,sincethelevelsetfunctiononlyneedstoberesolvednearthe interface,thecomputationalcostcanbegreatlyreducedbyusingthenarrowband method.Butitstillsuffersthemasslossintheunder-resolvedregions.Several spatiallyadaptivemethodsweredevelopedtoefficientlyresolvetheinterfaceand greatlyincreasetheaccuracyofthelocationoftheinterface,includingtheadaptive levelsetapproach[64],theoctreebasedmethods[11][65],thestructuredadaptive meshrefinement[12],therefinedlevelsetgrid(RLSG)method[66],thespectrally refined interface approach [43], and the adaptive level set method [67]. Inthepresentstudy,anovelmassconservinglevelsetmethodisdeveloped basedonthespectrallyrefinedinterface(SRI)approach[43].Nevertheless,the notablemasslosswasstillreportedinprevioussimulationsofatomization[68]. Therefore, we propose an improved mass remedy procedure to eliminate the mass loss. DifferentfromtheVOFscalartransportation[58][59],theabsolutemasslosswithin the computational domain is redistributed to the interface cells according to the local curvatureofthegas-liquidinterface.Thistreatmentisabletoavoidthemassloss caused by the numerical diffusion. The rest of the paper is organized as follows. In section 2, the SRI approach for thelevelsetmethodisintroduced.Insection3,acurvature-basednovelmass conservinglevelsetmethodisproposedandthecorrespondingnumerical implementations are presented in detail. This is followed by section 4, in which three benchmarkcasesare numerically simulatedto validatethemassconservinglevel set method.Insection5,theproposedapproachisfurtherappliedtocomplexflows includingthedropimpactingonliquidfilmandtheswirlingatomization.Some conclusions are drawn in section 6. 2 Numerical methods 2.1 Governing equations for incompressible two phase flow The incompressible Navier-Stokes equations for gas and liquid phases read ( )1 1 tpt ( + = + + + uu u u u g,(1) 0t+ =u ,(2) whereuisthevelocity,isthedensity,pisthepressure,gisthegravitational 8 acceleration and is the dynamic viscosity. The material properties of gas and liquid areconstant,i.e.,=l,=linliquidphaseand=g,=gingasphase.The velocity at the interface is continuous. The material properties are subjected to jump at theinterface,thatis,[ ]l g = and[ ]l g = .Thepressureacrossthe interface can be expressed as [ ] [ ] 2tp = + n u n,(3) whereisthesurfacetension,istheinterfacecurvatureandnistheinterface normal. The code used can only handle structured meshes and staggered grid. The spatial discretizationoftheNavier-Stokesequationsisperformedusingthesecond-order finite difference schemes. The pressure p is stored at the cell centers, while velocity is stored at the face centers. The second-order semi-implicit iterative procedure [69] for time integration is utilized, which is economical, stable and accurate. The iteration can be expressed as ( ) ( )1 1 1 11 11 12 2n n n n n nk k k kfu u tf u u t u uu+ + + ++ +( (= + + + (( ,(4) where f is the right hand side of Navier-Stokes equations, and / f u is the Jacobian. Thelowandupperindexnotationsk and ndenotethekthNewton-Raphson sub-iterative step and the time step, respectively. ThePoissonequationissolvedbyusingafractionalstepprojectionmethodto enforcecontinuity.Firstly,thevelocityfieldisadvancedbysolvingEq.(1)without pressure gradient. Then the velocity is projected by solving the Poisson equation with the Ghost Fluid Method (GFM) described in section 2.7. Finally, the velocity field is corrected to ensure continuity using the pressure gradient. The time stept at time nt is determined by the CFL conditions 2 2 2CFL CFL CFL CFLCFL CFLmin , , , , ,4 4 4dy dy dx dzdx dztu v w | | < |\ .(5) whereCFListheCFLnumber.Thenewtime-stepisfinallydeterminedby ( ) min , t t dt = ,wheredtisgivenasaninputparametertoensuretheintegration stable. 2.2 Signed distance level set 9 The gas-liquid interface is represented as the zero iso-surface of a signed distance function in the level set approach, i.e., ( ) , G t= x x x ,(6) where t is time and xis the location on the interface that is closest to x. The level set function is defined to be positive for liquid and negative for gas. The motion of the interface is simulated by solving a simple advection equation for the level set function 0GGt+ =u,(7) where u is the fluid velocity. The state-of-the-art for level set transport typically relies on WENO-type schemes [43] to combine accurate transport and numerical robustness. However,theWENO-typeschemetendstobeoverlydiffusiveforthetransportof small-scale scalar structures which are essential to the physics of multiphase flows. Sincetheimprovementofinterfacerepresentationsinnumericalsimulations requiresanaccuratedescriptionofthesmallestscales,asub-celldescriptionofthe interfaceisusuallyneeded.Inthepresentstudy,weuseapseudo-spectralsub-cell reconstruction method with a semi-Lagrangian transport scheme [43]. 2.3 Sub-cell reconstruction A polynomialreconstruction of thelevel set function isappliedineachcell ina narrow band aroundtheinterface by introducing asetof quadrature pointstoenable sub-cell resolution. These points correspond to the locations where the nodal values of thelevelsetfunctionGarespecified[43].Inordertoimprovethecontinuityofthe levelsetfunctionacrosscells,theGauss-Lobattoquadratureisusedsuchthatsome quadrature points are located on the cell faces. LettheGvalueofthequadraturepoint(l,m,n)oftheflowsolvercell(i,j,k)be denoted , ,, ,l m ni j kGanditspositionvector , ,, ,l m ni j kx.Thenumberofquadraturepointsper directionismarkedtobepforthesakeofsimplicity.Thelevelsetfunction reconstruction within cell (i,j,k) is then written as ( ) ( ) ( ) ( ), ,, , , ,1 1 1p p pl m n l m ni j k i j kl m nG L x L y L z G= = ==x.(8) This reconstruction is of order p-1. The expression can be further simplified owing to the independence of the directions and the simple form of L. Consider a cell of unit sizeinonedirectionandletrlwith[ ] 1, l p representthepositionofthelth quadraturepointinthatdirection,forwhichthenr1=0andrp=1.Thebasis 10 polynomials are written as ( )( )( )1,1,ppr rL rr r = = =.(9) The reconstruction of the level set function for cell (i,j,k) is then expressed as ( ), ,, , , ,1 1 1 1 1 1, ,p p pj l m n l m n i ki j k i j ki i j j k k l m ny yx x z zG x y z L L L Gx x y y z z+ + + = = = | | | | | |= ||| \ . \ .\ . .(10) The computational cost of this sub-cell reconstruction is relatively low, because some ofthequantitiesrelatedtothepolynomialreconstructioncanbepre-computedand stored.Tofurtherreducethecomputationalcostassociatedwiththissub-cell polynomial reconstruction, the polynomials are created only in a narrow band around the interface. 2.4 Semi-Lagrangian transport and discretization Thesemi-Lagrangian(SL)transport,anefficientandaccuratescalartransport scheme, is adopted to avoid severe CFL restrictions due to rapidly decreasing distance betweenquadraturenodes.InsteadofdiscretizingEq.(6),thesemi-Lagrangian transport scheme is based on the fact that G should be constant along the trajectory of thematerialpointsevolvingatvelocityu.Thetrajectorythatpassesthroughxn+1at time tn+1 can be traced backward in time to 1 n nt =t t+ to obtain the old location xn. Therefore,thevalueofthelevelsetfunctionGn+1atxn+1canbeobtainedby ( ) ( )1 1 n n n nG G+ += x x .LargertimestepsizecanbeusedowingtotheLagrangian nature of this method. The only requirement is the computation of xn from xn+1, which involves solving an ordinary differential equation (ODE). In addition, this approach is efficient and easy to implement using the fourth-order Runge-Kutta method. 2.5 Re-initialization level set function Inthepresentstudy,there-initializationsimplyinvolvesinterpolatingthe velocityuandGvalueatthequadraturepointsbyusingthetri-linearinterpolation from the eight closest grid points of the flow solver. This re-initialization of the level set functionis found tobemostly superfluous, and itis only performed typically for every 100 time steps. 2.6 Curvature computation and density and viscosity computation Theinterfacecurvatureisessentialtothecomputationofthesurfacetension force, but it is challenging to obtain the curvature in the present sub-cell structures. In 11 thiswork,thecurvatureiscomputedbytwostepsasfollows[43].(1)The reconstructionofasigneddistancefunctionfortheinterfacebycombininga marching-cubes(MC)algorithmwithaparallelFMM.(2)Thethird-order least-squares computation of curvature from the reconstructed distance function. The density and viscosity fields are computed as ( )g l g = + (11) ( )g l g = + (12) where ( ) ( )1tanh 12 2G= + isthehyperbolictangentfunctionand isa parameter to set the thickness of the interface. 2.7 Ghost fluid method Thediscretizationofthepressuregradienttermisimportantinthelevelset method. In this work, the discontinuity in pressure that arises in the pressure gradient termofEq.(2)istreatedusingtheghostfluidmethod(GFM)[43].Thismethod providesasharpandrobustdiscretizationofthediscontinuityacrosstheinterface. Consideraninterfacelocatedat x betweenthetwogridlocationsxiandxi+1, wherexi+1iswithintheliquidphase.ThepressurejumpinthepressurePoisson equation is then written as ( ) ( )[ ], 1 , , , 1 *2 * 2,1 11l i g i g i g igg ip p p pppx xx x+ | |= | \ .,(13) where( )*1g l = + and( ) /ix x x = . The ghost fluid method is challenging in the presence of the viscous term in the Equation3,asdemonstratedinDesjardinsetal.[43].Thecontinuumsurfaceforce (CSF) approach by Brackbill et al. [44] is used to deal with the viscous term. 3 Curvature-based mass conserving level set method Althoughthesub-cellresolutionforthesmall-scalestructurescanbeobtained using the numerical approach mentioned above, the mass conservation still cannot be ensured owing to the unavoidable numerical dissipation in the level set method. Pai et al.[68]performeddetailednumericalsimulationsofprimaryatomizationofliquid jetsincrossflowandshowedthatthemasslosscanreachupto20-30%evenwith sufficient computationalcells, e.g., 36-110 million cells. Therefore, it is necessary to 12 develop a new method to overcome the mass loss problem. (a) (b) (c)Figure 1. Layout of the curvature-based mass conserving level set method. The grey color represents the liquid phase. The thick line and dash line represent the interface and updated interface, respectively. (a) The interface location before mass correction at a new time step; (b) Mass correction based on the local curvature at the interface; (c) Smooth the interface. Inthepresentstudy,inordertoconservemasswiththelevelsetmethod, corrections to the level set function based on the curvature of each cell at the interface areproposedbyconsideringthevolumefractionGvolofacertainfluidwithina computationalcell.Figure1showsthelayoutofthepresentmethod.Thecurvature and the level set scalar are stored in the center of each cell. The interface before mass correction at a new time step is shown in Figure 1(a), in which mass loss occurs. Once theoveralllostmassisevaluated,itisdistributedtothecellsattheinterfacebythe interfacelocalcurvature,asshowninFigure1(b).Afterthisstep,theupdated interfacemaybenotsmoothacrosstheconjointcells.TheFMMisthenappliedto obtain the smooth interface, as shown in Figure 1(c). The regular level set advection is performedusingthesemi-Lagrangianscheme.Sincetheobtainedlevelsetfunction Gn+1,*cannotconservemass,correctionstoGn+1,*areappliedtomaintainthemass conservation by three steps as follows. (1)Therelativevolumeofliquidphaseinacomputationalcell,i.e.,thevolume 13 fraction Gvoln+1,*, is computed from the level set function Gn+1,*; (2)ThevolumefractionGvoln+1,*iscorrectedformassconservationbasedonthe curvature of each cell at the interface within a time step towards Gvoln+1 ; (3) With the new volume fraction Gvoln+1, corrections to Gn+1,* are obtained by solving ( )1 1 1,n n nvolf G G G+ + + =. Thecomputationalcostofthemassremedyprocedureisnegligiblecomparedwith that of the original level set method. Next, this correction procedure will be described in detail. 3.1 Calculation of volume fraction from the level set function ArelationshipbetweenthelevelsetfunctionGandthevolumefractionGvolis found by considering the fractional volume of a certain fluid in a computational cell. ThevolumefractionGvoliscalculatedusingananalyticalformuladevelopedbyvan derPijletal.[58][59].Thisrelationisobtainedbyassumingpiecewiselinear interfaces within a computational cell, and can be written as ( ) ,volG f G G = .(14) After some algebraic manipulations, the volume fraction Gvol is obtained as , 01 , 0volvolvolG GGG G = >,(15) where 2 23 3 3 3 36212, , ,, , ,, , ,0, , , , 0, , , , 0volA B C D ED D DA CD DADD D DD D DD D DGD D D GD D D G +> + > + >> + > + > + + = + + + + + + =,(16) with ( )1( ) , 02A max D D D G = + + ,(17) ( )1( ) , 02B max D D D G = + ,(18) ( )1( ) , 02C max D D D G = + ,(19) 14 ( )1( ) , 02D max D D D G = + + ,(20) ( )1( ) , 02E max D D D G = ,(21) with ( ), ,x y zD max D D D =,( ), ,x y zD min D D D=, x y zD D D D D D = + + ,(22) and xGD xx= , yGD yy= , zGD zz= .(23) 3.2 Volume fraction remedy In general, the volume fraction can be transported at time step n to n + 1 by the method used in the VOF method. However, this method usually involves the interface reconstructionandincreasesthecomplexityofthelevelsetmethod.Moreover,it cannot ensure realizability of Gvol, i.e., unphysical values Gvol < 0 or Gvol > 1 could be obtained.Therefore,wedevelopanovelmassremedyproceduretoensurethemass conservationandrealizabilityinthenumericalschemewiththesimple implementation. ThevolumelossinacomputationaldomainisestimatedasdGvoltot =Gvoltot,init- Gvoltotn+1,*, where Gvoltot,init and Gvoltotn+1,* are the volume at the initial time and at time stepn+1,respectively.Inprinciple,Gvoltot,initisthetheoreticalvolumeinthe computationaldomain.Ifliquidphaseflowsinacrosstheinletboundary,Gvoltot,init = Gvoltot,init0+UAdt,whereGvoltot,init0isthevolumeattheinitialtime,Uistheliquid phasevelocityattheinletboundary,Aistheareaofinletboundary,dtisthetime duration up to n + 1 time step. This part of liquid volume loss is then distributed to the computationaldomain,typicallytotheinterface,andthecorrespondingvolume fraction is 0 < Gvoln+1,*< 1. A simple approach is to distribute the lost volume equally to the interface, i.e., ,voltotvol pdGdGN= ,(24) wheredGvol,pandNarethevolumeaddedtoeachcellpattheinterfaceandthe number of cells at the interface, respectively. However, this treatment does not take into account any local property of the level set function to maintain the mass conservation. Here, we propose another distribution methodbasedonthelocalcurvatureoftheinterface,becausethemasslosstendsto 15 happeninthevicinityoflargecurvatureregions[60]ratherthaninsmoothregions. Thus, the lost volume can be distributed depending on the local curvatures as ,1pmaxvol p voltotmpmax pdG dG== ,(25) wherepandmarethepthcellattheinterfaceandthetotalcellsattheinterface,p and max are the local curvature of the interface and the maximum value of curvature within a narrow band around the interface, respectively. For every cell at the interface, thefinalaccurateliquidvolumefractionGvol,pn+1=Gvol,pn+1,*+dGvol,p.Furthermore, this linear dependence on local curvature is chosen in view of motion involving mean curvature [83], which will be validated in Section 4.1. 3.3 Reverse calculation of the level set function Afterthevolumefractionremedy,thepredictedlevelsetfunctionGn+1*is corrected to ensure that the mass is conserved within the whole computational domain. In other words, level set function (G1,G2,) at the interface is obtained implicitly by ( )1 1 n 1l,, , 1, 2,...n nk k vo kf G G G k + + + =(26) where= 10-8 is theerror tolerance and Gn+1,* is used for the initial guess. It can be expectedthat correctionto Gn+1,*is minor, because themass error inGn+1,* from the truncationerrorofthediscretizationofthelevelsetfunctionissmall.Therefore,a simple Newton iteration is used to compute Gn+1 as ( )( )n 1 1, 1l1, 1 1,1, 1,,n m nvo k kn m n mk kn m nk kG f G GG GfG GG+ + ++ + ++ + = +,(27) where the derivative fGcan be computed analytically and m denotes the sub step in theiteration.ThesmoothnessofJacobian fGinEq.27toensuresystematic convergence is validated in Section 4.3. Insummary,aschematicdiagramofourproposedmassconservinglevelset method is shown in Figure 2. 16 level set advectionreinitializationstep1: ( )volG f G =nG1, nG+ step2: volume fraction remedy1, nvolG+ 1 nvolG+step3: ( )1volG f G=1 nG+ Figure 2: The schematic diagram of the proposed mass conserving method 4 Numerical validations Inthissection,thenumericalapproachpresentedinsections2and3willbe validated through three benchmark cases. 4.1 Zalesaks disk - rigid body rotation of a slotted disk First,wetestthemassconservinglevelsetmethodfortheproblemoftherigid body rotation of Zalesaks disk in a constant velocity field [56]. The advection test of Zalesak is often used to demonstrate the ability of interface-advection algorithms. The computationaldomainis11andthediskisaslottedcircleinitiallycenteredat(0, 0.25)withradiusof0.15,andslotlengthof0.25andwidthof0.05.Theconstant velocity field is given by 2 U y =(28) and 2 V x = ,(29) and the disk completes one revolution within every one time unit. Figure3showstheinterfacelocationafteronerevolutionfordifferentmeshes andthecomparisontovanderPijletal.[44].Withincreasingthemeshresolution, 17 bothmethodsleadtobetterresults.Withthesamemeshsize,itisobviousthatthe results from the present method considering mass remedy are qualitatively better than that of van der Pijl et al.[44]. XY-0.2 -0.15 -0.1 -0.05 0 0.05 0.1 0.15 0.20.050.10.150.20.250.30.350.40.45XY-0.2 -0.15 -0.1 -0.05 0 0.05 0.1 0.15 0.20.050.10.150.20.250.30.350.40.45 (a) 5050(b) 100100 XY-0.2 -0.15 -0.1 -0.05 0 0.05 0.1 0.15 0.20.050.10.150.20.250.30.350.40.45XY-0.2 -0.15 -0.1 -0.05 0 0.05 0.1 0.15 0.20.050.10.150.20.250.30.350.40.45 (c) 150150(d) 200200 Figure 3: Computed interface after one full revolution for Zalesaks disk of different mesh (Black line for initial interface; Red line for Pijl et al.[44]; Blue line for the present method) 18 timerelativevolumeloss0 0.2 0.4 0.6 0.8 110-710-610-510-410-310-2no mass remedy, 5050no mass remedy, 100100no mass remedy, 150150no mass remedy, 200200mass remedy, 5050mass remedy, 100100mass remedy, 150150mass remedy, 200200 Figure 4: Relative volume loss for Zalesaks disk test for different meshes. The calculations without mass remedy is compared with the present method considering mass remedy Table 1: Relative volume loss after one revolution for Zalesaks disk for different meshes MeshNo mass remedy error (%)Mass remedy error (%) 50501.69920.0583 1001000.53270.0715 1501500.04620.0240 200200-0.04870.0151 XY0.01 0.02 0.03 0.04 0.05 0.060.090.10.110.120.130.140.15exact interface locationwith mass remedy, 100100without mass remedy, 100100 Figure 5: The interface location for mass remedy and no mass remedy cases with the same mesh Figure4illustratestherelativevolumelossforZalesaksdiskfordifferent meshes.Itisapparentthatthepresentmethodconsideringmassremedyhasless volumelosscomparedwiththemethodwithoutmassremedy.Wecomparethe relativevolumelossafteronerevolutionofZalesaksdiskandtheresultislistedin 19 Table1.Withincreasingthemeshresolution,bothmethodsleadtosmallmassloss. With the same mesh size, the mass loss is greatly reduced using the method with mass remedy.Tobetterillustratetheaccordanceoftheinterfacelocationafterone revolution and the initial interface location, the corners of the notch for the cases with andwithoutmassremedyareshowninFigure5,bothofwhichhave100100grid points. It is obvious that the result with mass remedy is closer to the exact location. Furthermore,thenumericalerrorisquantitativelyestimatedwiththerelative added volume in the present method. Since G0 field is a distance function, |G-G0| is a measurefortheshiftoftheinterfaceafteronerevolution.Theone-normand two-norm for variable G are defined as 111x yN Nnumerical exactk kx y kL G GN N== (30) and ( )2211x yN Nnumerical exactk kx y kL G GN N== ,(31) where Nx and Ny are the total mesh points in x and y direction, respectively. The upper subscriptsnumericalandexactrepresenttheGvalueafteronerevolutionandthe initialGvalue,respectively.Therelativeaddedvolume,one-normerror,and two-normerrorareshowninFigure6.Therelativeaddedvolumeisreduced quadraticallyasdecreasingthemeshsize.Itisnotedthattheaddedvolumetoeach cell at the interface is almost one percent of the liquid volume or even smaller in each cellattheinterface.Theerrorsofone-normandtwo-normaredecreasedalmost quadraticallyaswell.Thisconfirmsthatthepresentmethodhasthesecond-order accuracy. 20 x/Lnormerror10-310-210-110-410-410-310-310-210-2relativeaddedvolumeVadded/VinitL1((L2((xx2xx2 Figure 6: Convergence of relative volume loss after one revolution As demonstrated in Section 3.2, the mass loss dependence on local curvature (Eq. 25) is illustrated. Noting that in Figure 3, the mass loss mainly occurs in the notch of thediskandtwohornsatthebottomoftheslot,wherethecurvatureislarge.The interfacemovesinthedirectionofconcavityoflargecurvature.Similarwiththe motionbymeancurvature,thevelocityinthenormaldirectioncanbeexpressedas V a n =

, wherea is a positive constant. Therefore, the mass loss can be written as volG V S a nS = = ,whereSisthelocalunitinterfacearea.Itcanbeshownthat the mass loss is proportional to the local curvature. XY0 0.2 0.4 0.6 0.8 100.20.40.60.81XY0.4 0.60.50.550.60.650.70.750.80.850.90.951 (a1) 6464, t = 4(a2) 6464, t = 8 21 XY0 0.2 0.4 0.6 0.8 100.20.40.60.81XY0.4 0.60.50.550.60.650.70.750.80.850.90.951 (b1) 128128, t = 4(b2)128128, t = 8 XY0 0.2 0.4 0.6 0.8 100.20.40.60.81XY0.4 0.60.50.550.60.650.70.750.80.850.90.951 (c1) 256256, t = 4(c2) 256256, t = 8 Figure 7: The interface location at t = 4 and t = 8 for different meshes (Blue line for no mass remedy; Red line for mass remedy) 4.2 Two-dimensional deformation Since the Zalesak's disk is not able to validate the accuracy of methods proposed intheconditionsoflargestrainrateduetoitslinearvelocityfield,weconsideran unsteadyvorticalfieldtovalidatetheabilityofthepresentmethodtocapturethin filaments during the circle's deformation. This case was proposed by Bell et al. [57] to test a second-order projection method for incompressible Navier-Stokes equations. In adomainof11,acircleofradius0.15isinitiallyat(0.5,0.75).Thevelocityis obtained by the stream function: ( ) ( ) ( )( )2 2 1,tx t sin x sin y cosT =,(32) where T = 8 is the period of a reversing vortical flow. The velocity field stretches the circle into an thinner filament that wraps around 22 the center of the domain and then slowly reverses and pulls the filament back into the initial circular shape at time t = 8. The results of the present method at t = 4 and t = 8 fordifferentmeshesareshowninFigure7.Resultsarecomparedwiththemethod withoutmassremedy.Withincreasingthemeshresolution,bothmethodsleadto betterresults.Withthesamemeshsize,itisobviousthatthepresentmethodwith mass remedy is capable of accurately capturing the interface of thin filament, and the results are better than those without mass remedy qualitatively. Figure 8 shows the relative volume loss in the two-dimensional deformation case for differentmeshes. It is apparent that the presentmethodconsideringmass remedy has less volume loss compared with themethod withoutmass remedy. We compared therelativevolumelossinthiscaseatt=8forthemethodswithmassremedyand withoutmassremedy,andtheresultislistedinTable2.Theresultshowsthatthe volumelossisreducedsignificantlybyusingthepresentmethodconsideringmass remedy and the error is reduced by two orders of magnitude. timerelativevolumeloss0 2 4 6 8-0.0200.020.040.06no mass remedy, 6464no mass remedy, 128128no mass remedy, 256256mass remedy, 6464mass remedy, 128128mass remedy, 256256 Figure 8: Relative volume loss for two dimensional deformation tests for different meshes. No mass remedy is compared with the present method considering mass remedy Table 2: Relative volume loss at T = 8 for two dimensional deformation for different meshes MeshNo mass remedy error (%)Mass remedy error (%) 64645.26600.6486 1281283.26300.0636 2562561.49410.0181 The one-norm and two-norm errors defined in Eqs. (30) and (31) for this case are showninFigure9.Theerrorsofone-normandtwo-normaredecreasedalmost 23 quadraticallywithdecreasingmeshsize.Thisdemonstratesthatthesecond-order accuracy is achieved in the present case as well. x/Lnormerror10-310-210-110-510-410-310-210-1L1((L2((xx2xx2 Figure 9: Convergence of the relative volume loss at t = 8 4.3 Three-dimensional deformation SimilarwiththeworksbyLeVeque[83]andEnrightetal.[60],the three-dimensional deformation test case is used. The velocity field is given by ( ) ( ) ( ) ( ) ( )2, , 2sin sin 2 sin 2 cos / u x y z x y z t T = (33) ( ) ( ) ( ) ( ) ( )2, , sin sin 2 sin 2 cos / v x y z y x z t T = (34) ( ) ( ) ( ) ( ) ( )2, , sin sin 2 sin 2 cos / w x y z z x y t T = (35) whereT=3.Asphereofradius0.15isplacedat(0.35,0.35,0.35)inaunit computationaldomain.The643and1283gridcellsareused.Snapshotsofthe interface at T = 0, 0.3, 0.6, 1.0, 1.5, 2.0, 2.5, 3.0 are shown in Figure 10. The sphere is entrained by two vortices and is then compressed to stretch out. Parts of the interface stretchestoformthinfilmatt=T/2.Afterfullperiodofdeformation,thesphere recovers from the thin film. This test cases on different grids and for different methods are investigated at t = T.Figure11showstheinterfacesatt=Twithoutmasscorrection,withmass correction based on the redistribution of volume on the local curvature and with mass correctionbasedontheuniformredistributionofvolume.For643grid,theresultof the original method [43] loses significant amount of volume and the results with mass correction can avoid the volume lost despite of the low resolution. For 1283 grid, the 24 results with mass corrections almost recover the original sphere shape in Figure 12 (b). Itisnotedthattheresultwiththemasscorrectionbasedonlocalcurvatureisbetter thanthatwiththemasscorrectionbasedontheuniformredistributionofvolume. Figure12showsthevolumelossforthree-dimensionaldeformationtestondifferent gridsandfordifferentmethods.Itisshownthatthevolumelossisgreatlyreduced with the mass correction. (a) 643 (b) 1283 Figure 10. Interface evolution with mass correction based on the redistribution of volume on the local curvature with different grids at T = 0, 0.3, 0.6, 1.0, 1.5, 2.0, 2.5, 3.0 (a) 643 (b) 1283 25 Figure 11. The interface comparisons at t = T on different grids without mass correction (left), with mass correction based on the redistribution of volume on the local curvature (middle) and with mass correction based on the uniform redistribution of volume (right) TV/Vo0 0.5 1 1.5 2 2.5 30.750.80.850.90.951643, (a)643, (b)643, (c)1283, (d)1283, (e)1283, (f) Figure 12. Volume loss for the three-dimensional deformation test on different grids and for different methods. (a) and (d) for the method without mass correction; (b) and (e) for the method with mass correction based on the redistribution of volume loss on the local curvature; (c) and (f) for the method with mass correction based on the uniform redistribution of volume loss 4.3 Three-dimensional interactions Inthethirdtestingcase,thesimulationofthebinarydropcollisionisusedto highlightthecapabilityofthemassconservinglevelsetmethod.Thissimulationis motivated by the experiments of Ashgriz and Poo [58] and by the level set simulations of Tanguy and Berlemont [59]. The dynamics of binary drop collision is dependent on the dimensionless number, namely, the Weber number 2l cU DWe=,(36) where D is the smaller drop diameter, Uc is the droplet relative velocity, l is the liquid density, andis the surface tension coefficient. Table 3: The physical properties of gas and liquid phases Density of liquid (kg/m3)1000 Density of gas (kg/m3)1.226 Dynamic viscosity of liquid (kg/m/s)1.13710-3 Dynamic viscosity of gas (kg/m/s)1.78010-5 Surface tension coefficient (N/m)0.0728 26 Initially,thedropletvelocityisimposedforagivenWebernumber.Thegas phaseisairandthe liquid phaseiswater. Thephysical properties of bothphasesare given in Table 3. 4.3.1 Coalescence followed by separation for head-on collision CollisionandseparationhavebeenobservedbyAshgrizandPoo[58]fortwo identicalwaterdropletswithaWebernumberof23.Simulationsarepresentedhere for water droplets with the same Weber number, and with a droplet radius of 400 m. Thecomputationaldomainis2mm4mm2mmandthegridsizeis6412864ina three-dimensional configuration. (a) (b)Figure 13: (a) Head-on collision, We = 23, from Ashgriz and Poo (1990) [58]; (b) Head-on collision, We = 23, from the present simulation (a) (b) 27 Figure 14: (a) Head-on collision, We = 40, from Ashgriz and Poo (1990) [58]; (b) Head-on collision, We = 40, the present simulation Comparisonsbetweensimulationandexperimentalvisualizationareshownin Figure 13. The qualitative agreement between our simulation and experimental results isexcellent.Atearlytimes,thetwodropletscandevelopintoaflyingsaucershape. Then it evolves into a shape of torus when the inertia force decreases. At later times, the bounce between two droplets appears and they separate from each other. Here, the separationoccurswhentheinertiaforceovercomesthesurfaceforceduetosurface tension. 4.3.2 Coalescence followed by separation with formation of one satellite droplet With the same computational configuration, we only change the droplets relative velocityfortheWebernumberof40intheexperimentofAshgrizandPoo[58]to study the coalescence followed by the separation of a satellite droplet in the head-on collision. Comparisons between simulation and experimental visualization are shown inFigure14.Astimeincreases,theligamentformsbetweenthetwodroplets.Then, theligamentisseparatedfromthetwodropletsandthenevolvesintoasatellite droplet.Itisobservedthatthenumericalresultsareingoodqualitativeagreement with the experimental results. Themasslossesofdropletcollisionforthemethodswithoutandwithmass correctionareshowninFigure15.Itshowsthatthepresentmethodwithmass correction can greatly reduce the mass loss. TV/Vo0 2 4 6 8 10 120.90.920.940.960.9811.02Without mass correctionWith mass correctionTV/Vo0 5 10 150.90.920.940.960.9811.02Without mass correctionWith mass correction (a)(b) Figure 15: Mass loss with and without mass correction for different Weber numbers. (a) We = 23 (b) We = 40 28 AsdemonstratedinSection3.3,tovalidatetheJacobian fGinEq.27is smoothenoughtoensuresystematicconvergence,therelationshipbetweenliquid volumeinacellGvolandlevelsetscalarGforthe3Ddropletcollisiondiscussed below is plotted in Figure 16. It is shown that the data are seated in a smooth line that can ensure the Jacobian has a valid value in the whole domain. Figure 16: The relationship between liquid volume in a cell Gvol and level set scalar G for the 3D droplet collision 4.4 CPU costs Typically,theCPUcostsofvariousnumericalproceduresareinvestigated throughconstantvelocityfield,2Dshearvelocityfieldand3Dactualcases, correspondingtoZalesaksdisk,2Ddeformationand3Ddropletcollision, respectively. Figure 17 shows the time spent per time step in the multiphase solver for thescalartransport,thevelocitysolver,thepressuresolverforthePoissonequation andthemasscorrectionsolver.Themasscorrectionsolverisembeddedinthe multiphase solver. It can be seen that multiphase solver accounts for the most of the cost of one time stepforthemethodwithmasscorrectioninthesethreecases.Thetimecostinthe multiphase solver of the method with mass correction is two times larger than that of the method without mass correction. This indicates that mass correction solver greatly increases the cost of themultiphasesolver. Thecosts of velocity solver and pressure solver are almost the same for Zalesaks disk and 2D deformation. However, the cost 29 of pressure solver is greatly larger than that of velocity solver in 3D droplet collision. Thisisattributedtothehighperformanceofparallelpolydiagonalsolversforthe implicit formulation in the velocity solver [30]. TimeCPUcost(s)0 0.2 0.4 0.6 0.8 100.10.20.3MultiphaseVelocityPressureMultiphaseVelocityPressureMass correction TimeCPUcost(s)0 2 4 6 800.511.522.53MultiphaseVelocityPressureMultiphaseVelocityPressureMass correction (a) CPU costs of Zalesaks disk(b) CPU costs of 2D deformation TCPUcost(s)0 2 4 6 8 10 1200.511.522.53MultiphaseVelocityPressureMultiphaseVelocityPressureMass correction (c) CPU costs of 3D droplet collision Figure 17: CPU costs of three cases (Solid line and dashed line represent the methods without and with mass correction, respectively) TheswirlingatomizationsimulationpresentedaboveisconductedonNational SupercomputerCenterinTianjin.Typically,the3Ddropletcollisionistakenfor example. This case uses eight CPUs and about three seconds per time step are needed. TheperformanceoftheparallelismhasbeeninvestigatedbyDesjardinsetal.[82], showing that the code will perform efficiently at least up to 109 cells on 104 cores. 30 5 Applications to complex flows Despite of the excellent results obtained by using simple flows in section 4, it is necessary to evaluate the accuracy of the present method for more complex flows. In this section, two typical cases, i.e., a drop impacting on a liquid film and the swirling liquid atomization, are simulated to demonstrate the capability of the present method. 5.1 Drop impacting on a liquid film A drops impact on a liquid film can be observed in many technical applications, suchasturbineblade,sprayinjectionininternalcombustion(IC)engine,painting, surface cooling. When a drop impacts on a liquid film, drop splashing and spreading occur and the lamella and crown form. To examine the accuracy of the present method with mass remedy, the case reported in the experiment conducted by Cossali et al. [60] issimulatednumerically.Thedimensionlessnumbersthataffectthebehaviorofthe drop impact are the Weber number and the Ohnesorge number 2lU DWe=, llOhD =,(37) where D is the drop diameter, U is the drop terminal velocity, l is the liquid density, l is the dynamic viscosity of liquid, andis the surface tension coefficient. Table 4: The physical properties of gas and liquid phases Density of liquid (kg/m3)1000 Density of gas (kg/m3)1.226 Dynamic viscosity of liquid (kg/m/s)1.13710-3 Dynamic viscosity of gas (kg/m/s)1.78010-5 Surface tension coefficient (N/m)0.0728 In the experiment of Cossali et al. [60], a water drop of diameter 3.82mm falls on a liquid film. The time is set to t = 0 when the drop reaches the film. The experimental conditionofWe=297, Oh=0.0019andthedimensionlessfilmthickness/ h D == 0.29 is applied. Therefore, the velocity at t = 0 is 2.389m/s and the film thickness is h=1.1078mm.Thecomputationaldomainof8D3.6D8Disusedtoavoidtothe effect of the domain size on the result. The grid size is 256128256. The no-slip wall boundaryconditionisappliedtothebottomwall,andtheperiodicconditionisused for the other boundaries. The y-coordinate is aligned with the direction of impact. The physical properties of liquid and gas are listed in Table 4. Thedynamicsoftheimpactingdropisillustratedinasequenceofsnapshotsin 31 Figure 18. The dimensionless time is= Ut/D. Since the drop impacts the liquid film, thekineticenergyofthedropistransferredtotheliquidfilmandacrown-like structure forms. Then the crown grows outward and upward due to inertia. In Figure 19(h),asthelamellarise,therimofthecrownbecomesunstableandthecrown exhibitsthree-dimensionalcharacteristics.Evolutionoftheinterfaceintheplane-cut at z = 0 is shown in Figure 20. The interface gradually evolves from a simple shape to a complex structure. (a)(b)(c) (d)(e)(f) (g)(h)(i) Figure 18: Evolution of the interface for drop impacting on liquid film ((a)-(i) for the dimensionless time= Ut/D = 0-8) Themasslossofdropimpactingonaliquidfilmisadded.Similarly,themass loss in Figure 19 is reduced with the mass correction. 32 TV/Vo0 5 10 150.920.940.960.981Without mass correctionWith mass correction Figure 19: Mass loss of drop impacting on a liquid film As shown in Figures 21 and 22, the time series of the crown height and diameter fromthepresentsimulationarecomparedwithexperimentalresultsofCossalietal. [60]andnumericalresultsofLeeetal.[61].Intheexperiment,thecrownheightis defined as the distance between the crown base and the rim base. It is obvious that the crown height in the present simulation agrees well with the experimental results. The two-dimensionalnumericalresultsofLeeetal.[61]showgoodagreementwith experimentalresultsintheearlystageofcrownformation,butsomediscrepancies appearinthelaterstageofthecrownspreading,whichindicatesthatthecrown displaysthree-dimensionalcharacteristicsinthelatertime.Thepresent three-dimensionalnumericalresultsshowexcellentagreementwiththeexperimental resultsinthelaterstageofthecrownspreading,whichisdisplayedasaveragein Figure21.Thethree-dimensionalnon-uniformcrownstructurescanbeobservedin Figure 19(h) and marked as low and high in Figure 21. Figure 20: Evolution of the interface in the plane-cut at z = 0 33 Non-dimensional time ()Non-dimensionalcrownheight(H/Do)0 2 4 6 8 10 12 14 16 18 2000.20.40.60.811.21.41.61.82 = 0.29, Cossali et al. (2004), experiment = 0.29, Lee et al. (2004), simulation = 0.29, low, the present simulation = 0.29, high, the present simulation = 0.29, average, the present simulation Figure 21: Comparison of crown height evolution between experiment and simulation (low stands for the mean crown height of z = 0 and x = 0 plane; high stands for the mean crown height of two diagonal planes of the computational domain; average stands for the average crown height of low and height) Non-dimensional time ()Non-dimensionalcrowndiameter(D/D0)0 2 4 6 8 10012345678=0.29, Cossali et al. (2004), experiment=0.29, Lee et al. (2011), simulation=0.29, the present simulation Figure 22: Comparison of the evolution of the crown diameter between experiment and simulations The crown diameter is defined as the external diameter at the base of the rim as in Cossali et al. [60]. We compare the present numerical result with the experimental andnumericalresultsofLeeetal.[61]inFigure22.Itisshownthatthetwo numerical results are very similar and both predicted diameters are slightly larger than the experimental result. 5.2 Swirling atomization Theprimaryatomizationexhibitsarichphysicalphenomenologythatisstill 34 poorlyunderstood.Withtheincreaseofthecomputationalcapability,thenumerical simulation of primary atomization has been developed rapidly in recent years, such as jet atomization (in Menard et al. [37], Desjardins et al. [23][62], Shinjo et al.[63], and Herrmann[64])andcrossflowatomization(inHerrmann[65],Paietal.[66],and Muppidi et al. [67]). However, the mass loss becomes an issue using the existing level setmethod,asshownbyPaietal.[66].Furthermore,thereislackofnumerical studiesonswirlingliquidatomizationpartiallybecauseofitsthinthicknessofsheet and long period of existence of dispersed droplets. Therefore, the mass losses maybe increase in the sheet atomization. Inthissection,theswirlingliquidsheetatomizationisinvestigatedusingthe presentmassconservinglevelsetmethod.Thesketchoftheswirlingliquidsheet atomization is shown in Figure 23. The gas is injected at the center with the nozzle of diameterDin.Theswirlingliquidflowscoaxiallywiththeannulargapthickness (Dout-Din)/2. The detailed parameters in this case are listed in Table 5. Figure 23: Sketch of the swirling sheet atomization Table 5: Summary of parameters for swirling liquid sheet atomization Outer diameter Dout (mm)0.4 Inner diameter Din (mm)0.2 Liquid swirlyes Density of liquid (kg m-3)800 Density of gas (kg m-3)40 Dynamic viscosity of liquid (kg m-1 s-1)1.610-3 Dynamic viscosity of gas (kg m-1 s-1)1.610-4 Axial velocity of liquid (m s-1)15 Swirl velocity of liquid (m s-1)15 Velocity of gas (m s-1)30 Surface tension (N m-1)0.036 Rel (based on Dout)3000 35 We (based on lip thickness 0.1 mm)500 Dynamic viscosity ratio10 Kinematic viscosity ratio0.5 Density ratio20 Ohnesorge number0.015 Domain5Dout5Dout5Dout Numbers of CPU666=256 Numbers of cells256256256= 16.78 million x (m) 7.8 Time step size (s)110-8 T = 0T = 1.125T = 1.875T = 2.25T = 2.625 T = 3.75T = 4.875T = 5.625 Figure 24: Interface evolution of swirling liquid sheet atomization Fig.24showstheinterfaceevolutionoftheswirlingliquidsheetatomization. The initial liquid film is set as a semi-sphere membrane with thickness 1/2(Dout-Din). Theliquidfilmejectingfromtheannulusisatthelaminarstate.Thedimensionless time is defined as T = tVl/Dout, where V1 is the axial velocity of liquid. At an early time ofT=1.125,thetipmushroomshapeisobserved.Arecirculationregionappears behind the jet front and instantaneous breakup occurs from the mushroom edge. With theevolutionofatomization,aliquidsheetisobserved.Withoutdisturbancesadded 36 upstream,theliquidsheetmaintainssmoothwithinacertaindistance.Itisobserved that transverse azimuthal perturbations occur at the tip of liquid sheet at T = 4.875. It is expected that transient acceleration in the direction normal to the liquid at the rims triggerstheRayleigh-Taylorinstability,whichproducestheazimuthalperturbation. Withthegrowingamplitudeoftransverseazimuthalperturbations,liquidligaments areobservednearthewavecrestsatT=5.625.Then,theliquidligamentsare stretched and droplets are produced at the tip of the ligaments. Todemonstratetheeffectofthemassremedyapproachinthepresentmass conservinglevelsetmethod,theresultsfromthemethodswithmassremedyand without mass remedy at T = 5.625 are compared in Figure 25. During the formation of theliquidsheet,anumberofdropletsspreadduetothecentrifugalforce.These dropletscanbecapturedusingthepresentmethodwithmassremedy.Ontheother hand,thesedisperseddropletscannotberesolvedusingthemethodwithoutmass remedy. It confirms that the new approach with the mass remedy" is able to resolve detachmentofligamentsanddropletscomparedtothestandardapproachwiththe same grid resolution. If the grid resolution is further increasing so that the mass loss is negligible, the advantage of the new approach will disappear. As shown in Figure 26, the mass loss is about 40% of the liquid mass present at T=5.625 in the computational domain, and this discrepancy can be corrected by using the mass remedy method. (a) (b) 37 (c)Figure 25: The interface at T = 5.625 from the results without the mass remedy method on 2563 grid (a) with the mass remedy method on 2563 grid (b) and without the mass remedy method on 5123 grid (c) TV/Vo0 0.5 1 1.5 2 2.5 3 3.5 4 4.5 5 5.5 600.20.40.60.81No mass remedyMass remedy Figure 26: The comparison of the mass loss between methods without and with mass remedy (V0 refers to the theoretical volume of the liquid until T=5.625, which can be computed from the initial semi-sphere membrane and the temporal integration of boundary fluxes) 6 Conclusions An improved mass conserving level set method for detailed numerical simulation of liquid atomization is developed to overcome the mass loss in the existing level set methods.Thismethodisbasedonthefactthatthemasslosstendstohappeninthe vicinity of large curvature regions rather than in smooth regions. The mass loss within every time step owing to the numerical dissipation and re-initialization is remedied to theinterfacebasedonthecurvatureattheinterface.Inprinciple,theabsolutemass 38 conservation can be obtained via this method. In the benchmark cases of Zalesaks disk and drop deformation in a vortex field, the excellent agreement between simulation results and theoretical results is obtained. Itisshownthatgridsizesignificantlyinfluencesthenumericalresultsandthemass losscanbegreatlyreducedbythepresentmethodwithsecond-orderaccuracyand negligible additional computational cost. Additionally, in the simulations of the binary dropcollision,qualitativegoodagreementswithexperimentalresultsareshownin visualizations of the droplet evolution. Formorecomplexcases,thepresentmethodisdemonstratedtosuccessfully reproducetheevolutionofthedropimpactingonliquidfilm,withbetteragreement comparedtoexperimentaldatathanthatofLeeetal.[61].Finally,thedetailed numerical simulation of a complicated swirling liquid sheet atomization is conducted usingthepresentmethod.Thecomplexatomizationinterfacescanbecaptured,and the mass loss is greatly reduced compared with the existing level set method. Acknowledgement ThisworkisfinanciallysupportedbytheZhejiangProvincialNaturalScience FoundationforDistinguishedYoungScholars(No.LR12E06001)andtheNational NaturalScienceFoundationofChina(Nos.51222602,51276163).YueYang acknowledges the support by the Young Thousand Talent Program of China. References [1]F.H.Harlow,J.E.Welch,Numericalcalculationoftime-dependentviscous incompressibleflowoffluidwithafreesurface, Physicsof Fluids 8(1965)21822189 [2]B.J.Daly,ANumericalstudyoftwo-fluidRayleigh-Taylorinstability, Phys. Fluids 10(1967)297-307 [3]B.J.Daly,W.E.Pracht,Numericalstudyofdensity-currentsurges,Physicsof Fluids 11(1968)15-30 [4]M. Gorokhovski, M. Herrmann, Modeling primary atomization, Annu. Rev. Fluid Mech., 40(2008)343-366 [5]J. A. Sethian, P. Smereka, Level set methods for fluid interfaces, Annu. Rev. Fluid Mech., 35(2003)341-372 [6]F. Denner, D. R. van der Heul, G. T. Oud, M. M. Villar, A. da S. Neto, B. G. M. 39 vanWachem,Comparativestudyofmass-conservinginterfacecapturing frameworksfortwo-phaseflowswithsurfacetension,Int.J.MultiphaseFlow, 61(2014)37-47 [7]H. A. A. Amiri, A. A. Hamouda, Evaluation of level set and phase field methods inmodelingtwophaseflowwithviscositycontrastthroughdual-permeability porous medium, Int.J.Multiphase Flow, 52(2013)22-34 [8]J.Kim,Phase-fieldmodelsformulti-componentfluidflows,Commun.Comput. Phys., 12(3)(2012)613-661 [9]Y. Sun, C. Beckermann, Sharp interface tracking using the phase-field equation, J. Comput. Phys.,200(2007)626-653 [10] P.H.Chiu,Y.T.Lin,Aconservativephasefieldmethodforsolving incompressible two-phase flows, J. Comput. Phys.,230(2011)185-204 [11] F.Losasso,R.Fedkiw,S.Osher,Spatiallyadaptivetechniquesforlevelset methods and incompressible flow, Computers & Fluids, 35(2006)995-1010 [12] R.R.Nourgaliev,S.Wiri,N.T.Dinh,T.G.Theofanous,Onimprovingmass conservationoflevelsetbyreducingspatialdiscretizationerrors,Int.J. Multiphase Flow,31(2005)1329-1336 [13] A. Salih, S. G. Moulic, Some numerical studies of interface advection properties of level set method, Sadhana, 34(2009)271-298 [14] T.W.H.Sheu,C.H.Yu,P.H.Chiu,Developmentofadispersivelyaccurate conservativelevelsetschemeforcapturinginterfaceintwo-phaseflows,J. Comput. Phys.,228(2009)661-686 [15] T. W. H. Sheu, C. H. Yu, P. H. Chiu, Development of level set method with good areapreservationtopredictinterfaceintwo-phaseflows,Int.J.Numer.Meth. Fluids, 67(2011) 109-134 [16] W.H.Reed,T.R.Hill,Triangularmeshmethodsfortheneutrontransport equation,Tech.ReportLA-UR-73-479,LosAlamosScientificLaboratory,Los Alamos, NM, 1973 [17] P.Rasetarinera,M.Y.Hussaini,Anefficientimplicitdiscontinuousspectral Galerkin method, J. Comput. Phys. 172(2001)718-738 [18] J.F.Remacle,N.Chevaugeon,A.Marchandise,C.Geuzaine,Efficient visualization of high-order finite elements, Int. J. Numer. Methods Eng. 69(2007) 750771 40 [19] D. Enright, F. Losasso, R. Fedkiw, A fast and accurate semi-Lagrangian particle level set method, Computers and Structures, 83(2005)479-490 [20] J.Strain,Semi-Lagrangianmethodsforlevelsetequations,J.Comput.Phys., 151(1999)498-533 [21] D.Xiu,G.E.Karniadakis,Asemi-Lagrangianhigh-ordermethodfor Navier-Stokes equations, J. Comput. Phys., 172(2001)658-684 [22] D.Adalsteinsson,J.A.Sethian,Thefastconstructionofextensionvelocitiesin level set methods, J. Comput. Phys.,148(1999)2-22 [23] A. Ovsyannikov, V. Sabelnikov, M. Gorokhovski, A new level set equation and its numerical assessments, CTR Proceedings of the Summer Program,2012 [24] D.L.Chopp,Anotherlookatvelocityextensionsinthelevelsetmethod,SIAM Journal on Scientific Computing, 31(2009)3255-3273 [25] V. Sabelnikov, A. Y. Ovsyannikov, M. Gorokhovski, Modified level set equation and its numerical assessment, J. Comput. Phys., 278(2014)1-30 [26] E.Olsson,G.Kreiss,Aconservativelevelsetmethodfortwophaseflow,J. Comput. Phys., 210(2005)225-246 [27] E.Olsson,G.Kreiss,S.Zahedi,Aconservativelevelsetmethodfortwophase flow II, J. Comput. Phys.,225(2007)785-807 [28] F. Xiao, Y. Honma, T. Kono, A simple algebraic interface capturing scheme using hyperbolic tangent function, Int. J. Numer. Meth. Fluids, 48(2005)1023-1040 [29] C.Walker,B.Muller,Aconservativelevelsetmethodforsharpinterface multiphase flow simulation, ECCOMAS CFD 2010 [30] O.Desjardins,V.Moureau,H.Pitsch,Anaccurateconservativelevelset/ghost fluidmethodforsimulatingturbulentatomization,J.Comput.Phys.,227(2008) 8395-8416 [31] M.Owkes,O.Desjardins,AdiscontinuousGalerkinconservativelevelset schemeforinterfacecapturinginmultiphaseflows,J.Comput.Phys., 249(2013)275-302 [32] T.Nonomura,K.Kitamura,K.Fujii,Asimpleinterfacesharpeningtechnique with a hyperbolic tangent function applied to compressible two-fluid modeling, J. Comput. Phys., 258(2014) 95-117 [33] H.Kohno,J.C.Nave,Anewmethodforthelevelsetequationusinga hierarchical-gradienttruncationandremappingtechnique,Comput.Phys. 41 Commun.,184(2013)1547-1554 [34] M. Sussman, P. Smereka, S. Osher, A level set approach for computing solutions to incompressible two-phase flow, J. Comput. Phys., 114(1994)146-159 [35] M. Sussman, E. Fatemi, P. Smereka, S. Osher, An improved level set method for incompressible two-phase flows, Computers and Fluids, 27(1998)663-680 [36] M.Sussman,E.Fatemi,Anefficient,interface-preservinglevelsetredistancing algorithm and its application to interfacial incompressible fluid flow, SIAM J. Sci. Comput. 20(1999)1165-1191 [37] G.Russo,P.Smereka,Aremarkoncomputingdistancefunctions,J.Comput. Phys., 163(2000)51-67 [38] D.Hartmann,M.Meinke,W.Schrder,Differentialequationbasedconstrained reinitialization for level set methods, J. Comput. Phys., 227(2008)6821-6845 [39] D. Hartmann, M. Meinke, W. Schrder, The constrained reinitialization equation for level set methods, J. Comput. Phys., 229(2010)1514-1535 [40] Y.C.Chang,T.Y.Hou,B.Merriman,S.Osher,Alevelsetformulationof Eulerianinterfacecapturingmethodsforincompressiblefluidflows,J.Comput. Phys., 124(1996)449-464 [41] L.O.McCaslin,O.Desjardins,Alocalizedre-initializationequationforthe conservative level set method, J. Comput. Phys.,262(2014)408-426 [42] J.A.Sethian,Levelsetmethodsandfastmarchingmethods,Cambridge University Press,1999 [43] O.Desjardins,H.Pitsch,Aspectrallyrefinedinterfaceapproachforsimulating multiphase flows, J. Comput. Phys.,228(2009)1658-1677 [44] J.U.Brackbill,D.B.Kothe,C.Zemach,Acontinuummethodformodeling surface tension. J. Comput. Phys., 100(1992)335-354 [45] R.F.Ausas,E.A.Dari,G.C.Buscaglia,Ageometricmass-preserving redistancingschemeforthelevelsetfunction,Int.J.Numer.Meth. Fluids,65(2011)989-1010 [46] A. Salih, G. Moulic, A mass conservation scheme for level set method applied to multiphaseincompressibleflows,InternationalJournalforComputional Methods in Engineering Science and Mechanics,14(2013)271-289 [47] M.Sussman,E.G.Puckett,Acoupledlevelsetandvolume-of-fluidmethodfor computing3Dandaxisymmetricincompressibletwo-phaseflows,J.Comput. 42 Phys., 162(2000)301-337 [48] M.Sussman,Asecondordercoupledlevelsetandvolume-of-fluidmethodfor computinggrowthandcollapseofvaporbubbles,J.Comput. Phys.,187(2003)110-136 [49] G.Son,Efficientimplementationofacoupledlevel-setandvolume-of-fluid methodforthreedimensionalincompressibletwo-phaseflows,NumericalHeat Transfer,PartB:Fundamentals:AnInternationalJournalofComputationand Methodology, 43(2003)549-565 [50] X. Yang, A. J. James, J. Lowengrub, X. Zheng, V. Cristini, An adaptive coupled level-set/volume-of-fluidinterfacecapturingmethodforunstructuredtriangular grids, J.Comput.Phys.,217(2006)364-394 [51] T. Menard, S. Tanguy, A. Berlemont, Coupling level set/VOF/ghost fluid methods: validation and application to 3D simulation of the primary break-up of a liquid jet, Int. J. Multiphase Flow, 33(2007)510-524 [52] X. Lv, Q. Zou, Y. Zhao, D. Reeve, A novel coupled level set and volume of fluid methodforsharpinterfacecapturingon3Dtetrahedralgrids,J.Comput.Phys., 229(2010)2573-2604 [53] Z.Wang,J.Yang,F.Stern,Anewvolume-of-fluidmethodwithaconstructed distancefunctionongeneralstructuredgrids,J.Comput.Phys.,231(2012) 3703-3722 [54] Z.Wang,A.Y.Tong,Asharpsurfacetensionmodelingmethodfortwo-phase incompressible interfacial flows, Int. J. Numer. Meth. Fluids, 64(2010)709-732 [55] D. L. Sun, W. Q. Tao, A coupled volume-of-fluid and level set (VOSET) method forcomputingincompressibletwo-phaseflows,Int.J.HeatMass Tran.,53(2010)645-655 [56] C.E.Kees,I.Akkerman,M.W.Farthing,Y.Bazilevs,Aconservativelevelset methodsuitableforvariable-orderapproximationsandunstructuredmeshes,J. Comput. Phys.,230(2011)4536-4558 [57] Y.Wang,S.Simakhina,M.Sussman,Ahybridlevelset-volumeconstraint methodforincompressibletwo-phaseflow,J.Comput.Phys., 231(2012)6438-6471 [58] S.P.vanderPijl,A.Segal,C.Vuik,P.Wesseling,Amass-conservinglevel-set methodformodelingofmulti-phaseflows,Int.J.Numer.Meth.Fluids, 43 47(2005)339-361 [59] S. P. van der Pijl, A. Segal, C. Vuik, P. Wesseling, Computing three-dimensional two-phaseflowswithamass-conservinglevelsetmethod,Comput.VisualSci, 11(2008)221-235 [60] D. Enright, R. Fedkiw, J. Ferziger, I. Mitchell, A hybrid particle level set method for improved interface capturing, J. Comput. Phys.,183(2002)83-116 [61] S. E. Hieber, P. Koumoutsakos, A Lagrangian particle level set method, J. Comput. Phys., 210(2005)342-367 [62] P. Trontin, S. Vincent, J. L. Estivalezes, J. P. Caltagirone, A subgrid computation ofthecurvaturebyaparticle/level-setmethod.Applicationtoa front-tracking/ghost-fluidmethodforincompressibleflows,J.Comput.Phys., 231(2012)6990-7010 [63] P.H.Chiu,Y.T.Lin,Aconservativephasefieldmethodforsolving incompressible two-phase flows, J. Comput. Phys.,230(2011)185-204 [64] M. Sussman, A. S. Almgren, J. B. Bell, P. Colella, L. H. Howell, M. L. Welcome, Anadaptivelevelsetapproachforincompressibletwo-phaseflows,J.Comput. Phys.,148(1999)81-124 [65] D. Fuster, A. Bague, T. Boeck, L. L. Moyne, A. Leboissetier, S. Popinet, P. Ray, R. Scardovelli,S.Zaleski,Simulationofprimaryatomizationwithanoctree adaptivemethrefinementandVOFmethod,Int.J.MultiphaseFlow, 35(2009)550-565 [66] M. Herrmann, A balanced force refined level set grid method for two-phase flows on unstructured flow solver grids, J. Comput. Phys.,227(2008)2674-2706 [67] H. Kim, M. S. Liou, Accurate adaptive level set method and sharpening technique forthreedimensionaldeforminginterfaces,Computers&Fluids, 44(2011)111-129 [68] M.G.Pai,H.Pitsch,O.Desjardins,Detailednumericalsimulationsofprimary atomizationofliquidjetsincrossflow,47thAIAAAerospaceSciencesMeeting IncludingtheNewHorizonsForumandAerospaceExposition,2009,Orlando, Florida [69] C.D.Pierce,P.Moin.Progress-variableapproachforlargeeddysimulationof turbulentcombustion.TechnicalReportTF80,FlowPhysicsandComputation Division, Dept. Mech. Eng., Standford University, 2001. 44 [70] S.T.Zalesak,Fullymultidimensionalflux-correctedtransportalgorithmsfor fluids, J. Comput. Phys., 31(1979)335-362 [71] J.B.Bell,P.Colella,H.M.Glaz,Asecondorderprojectionmethodforthe incompressible navier stokes equations, J. Comput. Phys.,85(1989)257-283 [72] N.Ashgriz,J.Y.Poo,Coalescenceandseparationinbinarycollisionsofliquid drops, J. Fluid Mech., 221(1990)183-204 [73] S.Tanguy,A.Berlemont,Applicationofalevelsetmethodforsimulationof droplet collisions, Int. J. Multiphase Flow, 31(2005) 1015-1035 [74] G. E. Cossali, M. Marengo, A. Coghe, S. Zhdanov, The role of time in single drop splash on thin film, Experiments in fluid, 36(2004)888-900 [75] S. H. Lee, N. Hur, S. Kang, A numerical analysis of drop impact on liquid film by usingalevelsetmethod,J.Mechanicalscienceandtechnology, 25(2011)2567-2572 [76] O.Desjardins,H.Pitsch,Detailednumericalinvestigationofturbulent atomization of liquid jets. Atomization and Sprays, 20(2010)311-336 [77] J.Shinjo,A.Umemura,Simulationofliquidjetprimarybreakup:dynamicsof ligament and droplet formation. Int. J. Multiphase Flow, 36(2010)513-532 [78] M. Herrmann, On simulating primary atomization using the refined level set grid method. 21st ILASS, Orlando,(2008) [79] M.Herrmann,Detailednumericalsimulationsoftheprimaryatomizationofa turbulentliquidjetincrossflow.ProceedingsofASMETurboExpo,Orlando, (2009) [80] M.G.Pai,H.Pitsch,O.Desjardins,Detailednumericalsimulationsofprimary atomizationof liquid jetsincrossflow. 47thAIAA Aerospace SciencesMeeting, Orlando, (2009) [81] S.Muppidi,K.Mahesh.Directnumericalsimulationofroundturbulentjetsin crossflow. J. Fluid Mech., 574(2007)59-84 [82] O.Desjardins,J.O.McCaslin,M.Owkes,P.Brady,Directnumericaland large-eddysimulationofprimaryatomizationincomplexgeometries, Atomization and Sprays, 23(2013)1001-1048 [83] S.Osher,R.Fedkiw,Levelsetmethodsanddynamicsimplicitsurfaces,Pages 41-46, Springer-Verlag. ISBN 0-387-95482-1, 2002 [84] R.J.LeVeque.High-resolutionconservativealgorithmsforadvectionin 45 incompressible flow. SIAM Journal on Numerical Analysis, 33(1996)627-665


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