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Two-grid method for semiconductor device problem by mixed finite element method and characteristics finite element method

  • The mathematical model of a semiconductor device is described by a coupled system of three quasilinear partial differential equations. The mixed finite element method is presented for the approximation of the electrostatic potential equation, and the characteristics finite element method is used for the concentration equations. First, we estimate the mixed finite element and the characteristics finite element method solution in the sense of the Lq norm. To linearize the full discrete scheme of the problem, we present an efficient two-grid method based on the idea of Newton iteration. The two-grid algorithm is to solve the nonlinear coupled equations on the coarse grid and then solve the linear equations on the fine grid. Moreover, we obtain the Lq error estimates for this algorithm. It is shown that a mesh size satisfies H=O(h1/2) and the two-grid method still achieves asymptotically optimal approximations. Finally, the numerical experiment is given to illustrate the theoretical results.

    Citation: Ying Liu, Yanping Chen, Yunqing Huang, Yang Wang. Two-grid method for semiconductor device problem by mixed finite element method and characteristics finite element method[J]. Electronic Research Archive, 2021, 29(1): 1859-1880. doi: 10.3934/era.2020095

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  • The mathematical model of a semiconductor device is described by a coupled system of three quasilinear partial differential equations. The mixed finite element method is presented for the approximation of the electrostatic potential equation, and the characteristics finite element method is used for the concentration equations. First, we estimate the mixed finite element and the characteristics finite element method solution in the sense of the Lq norm. To linearize the full discrete scheme of the problem, we present an efficient two-grid method based on the idea of Newton iteration. The two-grid algorithm is to solve the nonlinear coupled equations on the coarse grid and then solve the linear equations on the fine grid. Moreover, we obtain the Lq error estimates for this algorithm. It is shown that a mesh size satisfies H=O(h1/2) and the two-grid method still achieves asymptotically optimal approximations. Finally, the numerical experiment is given to illustrate the theoretical results.



    In this study, we consider the following mathematical model of a semiconductor device, which consists of three quasilinear partial differential equations [1,15]:

    Δψ=α(pe+N(x)),(x,t)Ω×J,J=(0,T], (1)
    et=[De(x)eμe(x)eψ]R(e,p),(x,t)Ω×J, (2)
    pt=[Dp(x)p+μp(x)pψ]R(e,p),(x,t)Ω×J, (3)

    where (1) is an elliptic-type partial differential equation for the electric potential, and (2) and (3) are parabolic-type partial differential equations for the electron and hole concentrations. The unknown functions are the electrostatic potential ψ, the electron concentration e, and the hole concentration p. Ω is a polygonal domain in Rd(d=2,3). The value of α is q/ϵ, q is the electron charge, and ϵ is the dielectric permittivity. These are all positive constants. N(x)=ND(x)NA(x) is a given function of ND(x) and NA(x) that represents the donor and acceptor impurity concentrations. The diffusion coefficients Ds(x)(s=e,p) and the mobilities μs(x)(s=e,p) obey the Einstein relation Ds(x)=UTμs(x), where UT is the thermal voltage. R(e,p) is a recombination term.

    It is assumed that the boundary and initial conditions are as follows:

    ψ(x,t)=e(x,t)=p(x,t)=0,(x,t)Ω×J, (4)
    e(x,0)=e0(x),p(x,0)=p0(x),xΩ. (5)

    In addition, we need the compatibility condition

    Ω(p0e0+N)dx=0. (6)

    The study of the transient behaviors of semiconductor devices plays an important role in modern computational mathematics. Since Gummel [14] first presented sequence iterative computation methods for this kind of problem in 1964, a variety of numerical approaches have been introduced to obtain better approximations for (1)–(3). The main techniques include the difference method [13], finite element method [27], mixed finite element method [25], characteristics finite element method [26], characteristics finite difference method [24], upwind finite volume method [21], and characteristics mixed finite element method [22].

    The semiconductor device problem becomes a large system of non-linear equations when using the finite element method to solve (1)–(5). Thus, we will consider a highly efficient and accurate algorithm for this large system. It is well known that the two-grid algorithm is a simple but effective algorithm. This method was first proposed by Xu for non-linear elliptic equations [18,19] and has been widely used in many kinds of problems. Dawson [10] applied a two-grid finite difference scheme for non-linear parabolic equations. Chen [6,5] presented an efficient two-grid scheme for semi-linear reaction–diffusion equations and miscible displacement problems. Dai [9] used a two-grid method based on Newton iteration for the Navier–Stokes equations. Chen and Yang [4] introduced this method for finite volume element approximations of nonlinear parabolic equations. Yu [23] presented a two-grid algorithm for mixed Stokes–Darcy problem. Wang investigated this method for semilinear elliptic interface problem [16]. Xu and Hou recently used this method for semilinear parabolic integro–differential equations [20]. Thus, it would be natural to use the two-grid method for the equations of a semiconductor device.

    The electric field intensity u=ψ is very important in production, and the numerical behavior of (2) and (3) strongly depends on the accuracy of the approximation of u. To improve the accuracy of e and p, we apply the mixed finite element method, which gives direct approximations of ψ and u simultaneously for the electric potential equation (1). The direct approximation of the electric field intensity, rather than one that requires differentiation of ψ, can provide improved accuracy for the same computational effort.

    We use the characteristics finite element method for the electron and hole concentration equations, (2) and (3), respectively. In reality, the values of Ds(s=e,p) are quite small in the concentration equations, and thus, (2) and (3) are strongly convection dominated. The standard finite element method produces unacceptable numerical diffusion or nonphysical oscillations in the concentration approximation. The characteristics finite element method was introduced and analyzed by Douglas and Russell [12] in 1982. Using this method to treat the hyperbolic parts of the concentration equation, the procedure is simple, the time-truncation errors are smaller, and lastly and most importantly, nonphysical oscillations are avoided.

    We determine the Lq error estimates for the mixed finite element solutions and the characteristics finite element solutions. We then present an efficient two-grid method based on the idea of Newton iteration. To the best of our knowledge, few results about the application of the two-grid algorithm to semiconductor device problems have been reported. The main idea of this algorithm is to solve the nonlinear coupled equations on a coarse grid, and then to solve the linear equations on a fine grid rather than solving the coupled nonlinear equations on the fine grid. Finally, we obtain the Lq error estimates for this algorithm and give the numerical experiment to illustrate the theoretical results. The two-grid algorithm achieves asymptotically optimal approximations but requires less time.

    An outline of this paper is as follows. In Section 2, we present the weak formulation and full discrete scheme of this model. In Section 3, we present the Lq error estimates of the finite element solutions. In Section 4, we introduce a two-grid algorithm and analyze its convergence. Finally, the numerical experiment is presented in Section 5.

    In this paper, we denote Lq(Ω)={f:fLq(Ω)<}, where

    fLq(Ω)={(Ω|f(x)|qdx)1/q,1q<,esssupxΩ|f(x)|,q=.

    (L2(Ω))2 is the space of vectors that contains each component in L2(Ω). We define the Sobolev spaces as Wm,q(Ω)={fL1loc(Ω):fWm,q(Ω)<}, whose norms are

    fWm,q(Ω)=fm,q={(|α|mαfqLq(Ω))1/q,1q<,max|α|mαfL(Ω),q=.

    To simplify the notation, we write Hm(Ω)=Wm,2(Ω), m=m,2 and =0,2. Let X be any of the spaces just defined. If f(x,t) represents functions on Ω×J, we set

    Hm(J;X)={f:Jαftα(,t)2Xdt<,αm},fHm(J;X)=[mα=0Jαftα(,t)2Xdt]12,m0,
    Wm,(J;X)={f:esssuptJαftα(,t)X<,αm},fWm,(J;X)=max0αmesssuptJαftα(,t)X,m0,L2(J;X)=H0(J;X),L(J;X)=W0,(J;X).

    For convenience, we drop Ω from the notations. Thus, we write L(J;Hk+3) for L(J;Hk+3(Ω)).

    We let (,) be the L2(Ω) inner product. Furthermore, H10(Ω)={fH1(Ω):f|Ω=0}, and H(div;Ω) is the set of vector functions in (L2(Ω))2 that have vL2(Ω). We also define

    W={wL2(Ω),(w,1)=0},V=H(div;Ω),vV=vH(div;Ω)=(v2+v2)1/2.

    We provide some rational assumptions about the coefficients and the solutions of (1)–(3). These assumptions are reasonable in physics [15,14].

    (1) For integers l,k0, the solution functions have the following regularity (A)

    ψL(J;Hk+3);u(L(J;Hk+2))2;e,pW1,(J;Hl+1)H2(J;W1,).

    (2) The problem is positive definite, such that

    0<DDs(x)D,0<μμs(x)μ,s=e,p,

    where D, D, μ, and μ are positive constants.

    (3) |μs(x)|C,s=e,p.

    (4) R(e,p) is Lipschitz continuous in an ε-neighborhood of the solutions.

    For the electron and hole concentration equations, (2) and (3), respectively, convection is dominant over diffusion, so we use the characteristics finite element method to solve them.

    We rewrite (2) and (3) in the form

    et=(Dee)+euμe+μeeu+αμee(pe+N)R(e,p), (7)
    pt=(Dpp)puμpμppuαμpp(pe+N)R(e,p), (8)

    where u=ψ.

    We let u=(u1,u2)T, τe be the unit vector in the direction (μeu1,μeu2,1), τp be the unit vector in the direction (μpu1,μpu2,1), and ϕs=1+μ2s(u21+u22) (s=e,p). The characteristic derivatives in the t direction are given by

    ϕeeτe=etμeeu,ϕppτp=pt+μppu.

    Associated with the equations above, (7) and (8) can be rewritten as follows:

    ϕeeτe(Dee)euμeαμee(pe+N)=R(e,p), (9)
    ϕppτp(Dpp)+puμp+αμpp(pe+N)=R(e,p). (10)

    We partition J into t=T/N and tn=nt. Furthermore, we denote fn(x) as f(x,tn) and (en/τe)(x) as (e/τe)(x,tn). The backward difference quotient in the τe-direction is as follows:

    enτe(x)en(x)en1(x+μeun(x)t)t1+μ2e|un(x)|2.

    Defining ˆxn1e=x+μeun(x)t and ˆen1(x)=en1(ˆxn1e), then

    ϕneenτeenˆen1t. (11)

    Similarly,

    pnτp(x)pn(x)pn1(xμpun(x)t)t1+μ2p|un(x)|2.

    Defining ˆxn1p=xμpun(x)t and ˆpn1(x)=pn1(ˆxn1p), then

    ϕnppnτppnˆpn1t. (12)

    The weak forms of (1), (9) and (10) are equivalent to the following problem: for tJ, find a map {ψ,u,e,p}:JW×V×H10(Ω)×H10(Ω) such that e(x,0)=e0(x), p(x,0)=p0(x):

    (u,v)(v,ψ)=0,vV, (13)
    (u,w)=α(pe+N,w),wW, (14)
    (ϕeeτe,z)+(Dee,z)(euμe,z)α(μee(pe+N),z)=(R(e,p),z),zH10(Ω), (15)
    (ϕppτp,z)+(Dpp,z)+(puμp,z)+α(μpp(pe+N),z)=(R(e,p),z),zH10(Ω). (16)

    We let Thψ and Thc be a quasi-uniform mesh of Ω comprising triangles or rectangles such that the elements have diameters bounded by hψ and hc. We denote Wh×VhW×V as the Raviart–Thomas mixed finite element spaces with order k. The approximation properties are given as follows:

    infvhVhvvhL2(Ω)2Cvk+1hk+1ψ,infvhVhvvhVC{vk+1+vk+1}hk+1ψ,infwhWhwwhWCwk+1hk+1ψ.

    We denote MhH10(Ω) as a piecewise polynomial space of degree l, and

    infzhMhzzh1,qCzl+1,qhlc,zHl+10(Ω).

    Using (11) and (12), the full discrete scheme of the weak form, (13)–(16), consists of {ψnh,unh,enh,pnh}Wh×Vh×Mh×Mh, given by

    (unh,v)(v,ψnh)=0,vVh, (17)
    (unh,w)=α(pnhenh+N,w),wWh, (18)
    (τeenh,z)+(Deenh,z)(enhunhμe,z)α(μeenh(pnhenh+N),z)=(R(enh,pnh),z),zMh, (19)
    (τppnh,z)+(Dppnh,z)+(pnhunhμp,z)+α(μppnh(pnhenh+N),z)=(R(enh,pnh),z),zMh, (20)

    where τeenh=enhˆen1ht and τppnh=pnhˆpn1ht. In addition, the initial approximations e0h and p0h must be determined by the elliptic projections of e0 and p0.

    In this section, we present the Lq error estimate of the mixed finite element method for the electrostatic potential and electric field intensity and the characteristics finite element method for the concentrations.

    First, it is useful to introduce an elliptic mixed method projection (Rhψ,Rhu):JWh×Vh, which satisfies

    (Rhu,v)(v,Rhψ)=0,vVh, (21)
    (Rhu,w)=α(pe+N,w),wWh. (22)

    Following Brezzi [3], we have

    uRhuV+ψRhψWCψL(J;Hk+3)hk+1ψ. (23)

    The estimations of ψnhRhψn and unhRhun are derived as follows. By subtracting (21) and (22) from (17) and (18), respectively, at time t=tn, we determine that

    (unhRhun,v)(v,ψnhRhψn)=0,vVh, (24)
    ((unhRhun),w)=α(pnhpnenh+en,w),wWh. (25)

    Following Brezzi [3], we have

    unhRhunV+ψnhRhψnWC(enenh+pnpnh). (26)

    We introduce an elliptic method projection (Rhe,Rhp):JMh×Mh such that

    (De(Rhee),z)+λe(Rhee,z)=0,zMh, (27)
    (Dp(Rhpp),z)+λp(Rhpp,z)=0,zMh, (28)

    where the positive constants λs(s=e,p) will be chosen to ensure the coercivity of the forms. Based on the theory of the Galerkin method for elliptic problems [8,17], we have

    sRhs0,2+hcsRhs1,2Csl+1,2hl+1c,s=e,p. (29)

    To obtain the convergence estimations of snsnh0,q(s=e,p), we divide them as follows:

    snsnh0,qsnRhsn0,q+Rhsnsnh0,q,s=e,p. (30)

    For the concentration, we only discuss the electron concentration equation, as the results were similar for the hole concentration equation. First, we obtain the convergence results of snRhsn0,q(s=e,p) with help of an elliptic problem.

    Lemma 3.1. If (en,pn) is the solution of (15)–(16) at t=tn, and (Rhen,Rhpn) is the elliptic projection solution of (27)–(28) at t=tn, then for 1nN, 2q< and l1, we have the following:

    enRhen0,qCenl+1,qhl+1c, (31)
    pnRhpn0,qCpnl+1,qhl+1c. (32)

    Proof. We let L denote an elliptic operator such that

    Len=(Deen)+λen,

    and it has a bilinear form

    a(en,z)=(Deen,z)+(λen,z),

    where λ will be chosen to ensure the coercivity of a(en,z). From (27), it is clear that Rhen is the finite element solution of this elliptic problem. We consider the auxiliary problem

    Lω=sgn(enRhen)|enRhen|q1,in Ω,ω=0, on Ω.

    This problem is uniquely solvable for ωLp(Ω), and

    ω2,pCLω0,p=CenRhenq10,q, (33)

    where 1p+1q=1. We use a duality argument. Based on (27), Hölder's inequality, and (33), we denote Ih as an interpolation operator and obtain

    enRhenq0,q=a(enRhen,ω)=a(enRhen,ωIhω)CenRhen1,qωIhω1,pChcenRhen1,qω2,pChcenRhen1,qenRhenq10,q. (34)

    From [2,Theorem 8.5.3] and the approximation property, we have

    enRhen1,qCinfehMheneh1,qChlcenl+1,q. (35)

    Using (34) and (35), we have

    enRhen0,qChcenRhen1,qChl+1cenl+1,q.

    Lastly, we obtain similar results for the hole concentration equation.

    Next, we obtain the convergence property for Rhsnsnh0,q(s=e,p).

    Lemma 3.2. Let (Rhen,Rhpn) be the elliptic projection solution of (27)–(28) at t=tn, and (enh,pnh) be the finite element solution of (19)–(20). If the regularity assumptions (A) hold, and the initial functions e0h=Rhe0 and p0h=Rhp0, then for 1nN, 2q< and l,k1, we have

    enhRhen0,qC(hl+1c+hk+1ψ+t), (36)
    pnhRhpn0,qC(hl+1c+hk+1ψ+t). (37)

    Proof. The proof process is similar to the analysis presented by [25] and [26], but with some changes. First, we subtract (15) and (27) from (19) at t=tn to have

    (τeenh,z)(ϕneenτe,z)+(De(enhRhen),z)=((enhunhenun)μe,z)+α(μe[enh(pnhenh+N)en(pnen+N)],z)+(R(en,pn)R(enh,pnh),z)+λe(Rhenen,z),zMh. (38)

    We let ξne=enRhen, ζne=enhRhen, ξnp=pnRhpn, ζnp=pnhRhpn, and select z=ζneζn1e=tζneΔt. Summing over 1nm, from (38), we have the following:

    mn=1(tζne,tζne)Δt+12(Deζme,ζme)12(Deζ0e,ζ0e)8i=1Fi, (39)

    where

    F1=mn=1(R(en,pn)R(enh,pnh),tζne)Δt,F2=mn=1(ξneξn1eΔt,tζne)Δt,F3=mn=1(ξn1eˆξn1eΔt,tζne)Δt,F4=mn=1(ˆζn1eζn1eΔt,tζne)Δt,F5=mn=1(ϕneenτeenˆen1Δt,tζne)Δt,F6=mn=1λe(ξne,tζne)Δt,F7=mn=1((enhunhenun)μe,tζne)Δt,F8=mn=1α(μe[enh(pnhenh+N)en(pnen+N)],tζne)Δt.

    Now we estimate each term on the right hand of (39). First, using a second-order Taylor expansion at point (enh,pnh) for R(en,pn), Young's inequality, and (29), we have

    |F1|mn=1(Re0,enenh+Rp0,pnpnh)tζneΔtCmn=1(ξne+ζne)tζneΔt+Cmn=1(ξnp+ζnp)tζneΔtC(ε)(mn=1(ζne2+ζnp2)Δt+h2l+2c)+εmn=1tζne2Δt, (40)

    where Re and Rp are the partial derivatives for each variable.

    For F2, we have

    |F2|mn=1CΔttntn1||ξet||dttζneΔtC(ε)mn=1ξet2L2(tn1,tn;L2)+εmn=1tζne2Δt
    C(ε)h2l+2ce2H1(tn1,tn;Hl+1)+εmn=1tζne2Δt. (41)

    For the estimation of F3, using (29), we get

    |F3|C(ε)mn=1ξn1e2Δt+εmn=1tζne2ΔtC(ε)h2lc+εmn=1tζne2Δt. (42)

    As to F4, we obtain similar estimate:

    |F4|C(ε)mn=1ζn1e2Δt+εmn=1tζne2Δt. (43)

    For F5, we obtain

    |F5|C(ε)mn=1ϕneenτeenˆen1Δt2Δt+εmn=1tζne2ΔtC(ε)(t)22eτ2e2L2(J;L2(Ω))+εmn=1tζne2Δt, (44)

    where the calculations of (41), (42), and (44) are presented in detail elsewhere [25,26].

    For F6, from (29) we have

    |F6|C(ε)mn=1enRhentζneΔtC(ε)h2l+2c+εmn=1tζne2Δt. (45)

    Next, we obtain an error estimate for F7. Using (26), (29), and (23), we have

    enhunhenun(enhRhen)unh+Rhen(unhRhun)+Rhun(Rhenen)+en(Rhunun)unh0,enhRhen+Rhen0,unhRhun+Rhun0,Rhenen+en0,RhununC(ζne+ζnp+hl+1c+hk+1ψ).

    Hence, we conclude that

    |F7|Cmn=1enhunhenuntζneΔtC(ε)(mn=1(ζne2+ζnp2)Δt+h2l+2c+h2k+2ψ)+εmn=1tζne2Δt. (46)

    Finally, for F8, we have

    enh(pnhenh+N)en(pnen+N)enhpnhenpn+enenenhenh+enhNenN=W1+W2+W3.

    From (29), we can determine the following:

    W1enh(pnhRhpn)+(enhRhen)Rhpn+Rhen(Rhpnpn)+(Rhenen)pnenh0,pnhRhpn+Rhpn0,enhRhen+Rhen0,Rhpnpn+pn0,RhenenC(ζnp+ζne+hl+1c),W2(enRhen)en+Rhen(enenh)+(Rhenenh)enhC(ζne+hl+1c),W3C(enhRhen+Rhenen)C(ζne+hl+1c).

    Thus, we have

    |F8|Cmn=1enh(pnhenh+N)en(pnen+N)tζneΔtC(ε)(mn=1(ζne2+ζnp2)Δt+h2l+2c)+εmn=1tζne2Δt. (47)

    Combining (39) with (40)–(47) and noting that e0h=Rhe0 and p0h=Rhp0, we have

    mn=1tζne2Δt+ζme2C(ε)(h2lc+h2k+2ψ+(Δt)2+mn=1(ζne21+ζnp2)Δt)+εmn=1tζne2Δt. (48)

    To obtain the H1 norm of ζme, we add ζme2 to the above equation. Note that

    ζne2ζn1e2=(ζne+ζn1e,ζneζn1e)=(ζneζn1e,ζneζn1e)+2(ζn1e,ζneζn1e)=ζneζn1eΔt2(Δt)2+2(ζn1e,ζneζn1eΔt)ΔtC(ε)ζn1e2Δt+(Δt+ε)ζneζn1eΔt2Δt.

    The both sides of the above inequality are sum from n=1 to m, then we have

    ζme2C(ε)mn=1ζne2Δt+(Δt+ε)mn=1tζne2Δt. (49)

    Similarly, for the L2 estimates of ζp and ζp, we find that

    mn=1tζnp2Δt+ζmp2C(ε)(h2lc+h2k+2ψ+(Δt)2+mn=1(ζnp21+ζne2)Δt)+εmn=1tζnp2Δt, (50)
    ζmp2C(ε)mn=1ζnp2Δt+(Δt+ε)mn=1tζnp2Δt. (51)

    Combining (48)–(51) and selecting sufficiently small values of Δt and ε, we obtain

    mn=1(tζne2+tζnp2)Δt+ζme21+ζmp21C(h2lc+h2k+2ψ+(Δt)2+mn=1(ζne21+ζnp21)Δt),

    where C=C(ε) is a constant that depends on ε. An application of the discrete Gronwall Lemma yields the following:

    ζme21+ζmp21C(h2lc+h2k+2ψ+(Δt)2).

    Then, for 1mN, we determine that

    ζme1C(hlc+hk+1ψ+Δt).

    Similar to the proof process of Theorem 3.4 in [19], we determine that

    ζne1,qC(hlc+hk+1ψ+Δt),2<q. (52)

    We apply a duality argument to estimate enhRhen0,q by considering an auxiliary problem: find ωH10(Ω) such that

    a(v,ω)=(φ,v),vH10(Ω).

    This problem is uniquely solvable for ωLq(Ω), and

    ω2,pCφ0,p,φLp(Ω),

    where p=q/(q1)[1,2] for 2q. If s=2q/(q+2), applying the Sobolev embedding theorem, we have

    Rhω1,s/(s1)Cω1,s/(s1)Cω2,pCφ0,p. (53)

    By Lemma 3.1 of [19] and (53), we have

    (enhRhen,φ)=a(enhRhen,ω)=a(enhRhen,ωRhω)+a(enhen,Rhω)C(enhRhen1,qωRhω1,p+enhen21,2sRhω1,s/(s1))C(hcenhRhen1,q+enhen21,2s)φ0,p.

    For q=2, since s=1, from (52), we have the following:

    enhRhen0,qC(hcenhRhen1,q+enhen21,2s)C(hcenhRhen1,q+enhRhen21,2+ε+Rhenen21,2+ε)C(hl+1c+hk+1ψ+Δt).

    For 2<q<, since 2s<q, we have

    enhRhen0,qC(hcenhRhen1,q+enhRhen21,q+Rhenen21,q)C(hl+1c+hk+1ψ+Δt),

    which yields (36). Similarly, we can obtain (37).

    From Lemmas 3.1 and 3.2, we obtain the following important theorem:

    Theorem 3.3. Let (en,pn) be the solution of (15)–(16) at tn, and (enh,pnh) be the finite element solution of (19)–(20). If the regularity assumptions (A) hold, and the initial functions e0h=Rhe0 and p0h=Rhp0, then for 1nN, 2q< and l,k1, we have

    enhen0,qC(hl+1c+hk+1ψ+Δt), (54)
    pnhpn0,qC(hl+1c+hk+1ψ+Δt). (55)

    First, it is useful to denote the L2 projection Qh as follows. For ρ(L2(Ω))2,

    (ρ,vh)=(Qhρ,vh),vhVh. (56)

    For ρ(Wk+1,q(Ω))2, the L2 projection operator has approximation property [11]:

    ρQhρ0,qCρr,qhr,0rk+1. (57)

    Next, the Lq error estimate of the electrostatic potential will be obtained. We obtain the following error equations by subtracting (13) and (14) from (21) and (22), respectively:

    (Rhuu,v)(v,Rhψψ)=0,vVh, (58)
    ((Rhuu),w)=0,wWh. (59)

    Let Dh be the L2-projection onto the space

    ˉVh={vVh|v=0}. (60)

    Dh has the following stability property [7]:

    Dhv0,qCv0,q,2q<. (61)

    Lemma 3.4. If un and Rhun are the solutions of (13)–(14) and (21)–(22), respectively, at t=tn. For 1nN, 2q< and k1, we have

    unRhun0,qCunk+1,qhk+1ψ. (62)

    Proof. This Lemma can be easily derived from (58) and (60). More details of the proof can be found in [6,Lemma 3.2] and [5,Lemma 4.1].

    For (25), if 1/p+1/q=1, we have

    (unhRhun)0,q=supwWh|((unhRhun),w)|w0,p=supwWh|α(pnhpnenh+en,w)|w0,pC(enenh0,q+pnpnh0,q)C(hl+1c+hk+1ψ+Δt). (63)

    Lastly, we obtain the Lq error estimate of the electric field intensity:

    ununh0,qunRhun0,q+Rhununh0,qC(hl+1c+hk+1ψ+Δt). (64)

    The two-grid algorithm and its convergence analysis are presented in this section. The fundamental ingredient of the scheme is a new finite element space VH×WH×MH×MHVh×Wh×Mh×Mh(h<H<1) defined on a coarser quasi-uniform triangulation or rectangulation of Ω. The non-linear equations can be solved by applying the Newton iteration procedure on the fine grid to linearize the non-linear system. The solutions of the original non-linear system will be reduced to the solutions of a small-scale non-linear system on the coarse space and a linear system on the fine space. First, we provide the two-grid algorithm.

    Step 1. Solve the non-linear coupled system for (unH,ψnH,enH,pnH)VH×WH×MH×MH on the coarse grid TH:

    (unH,v)(v,ψnH)=0,vVH, (65)
    (unH,w)=α(pnHenH+N,w),wWH, (66)
    (τeenH,z)+(DeenH,z)(enHunHμe,z)α(μeenH(pnHenH+N),z)=(R(enH,pnH),z),zMH, (67)
    (τppnH,z)+(DppnH,z)+(pnHunHμp,z)+α(μppnH(pnHenH+N),z)=(R(enH,pnH),z),zMH. (68)

    Step 2. Solve the linear coupled system for (Unh,Ψnh,Enh,Pnh)Vh×Wh×Mh×Mh on the fine grid Th:

    (Unh,v)(v,Ψnh)=0,vVh, (69)
    (Unh,w)=α(PnhEnh+N,w),wWh, (70)
    (τeEnh,z)+(DeEnh,z)([enHUnh+(EnhenH)unH]μe,z)α(μe[enH(PnhEnh+N)+(EnhenH)(pnHenH+N)],z)=(R(Enh,Pnh),z),zMh, (71)
    (τpPnh,z)+(DpPnh,z)+([pnHUnh+(PnhpnH)unH]μp,z)+α(μp[pnH(PnhEnh+N)+(PnhpnH)(pnHenH+N)],z)=(R(Enh,Pnh),z),zMh, (72)

    where R(Enh,Pnh)=R(enH,pnH)+Re(enH,pnH)(EnhenH)+Rp(enH,pnH)(PnhpnH).

    Next, we present an error estimation analysis of the exact solutions (un,ψn,en,pn) and two-grid solutions (Unh,Ψnh,Enh,Pnh). We note that (Unh,Ψnh) are the two-grid solutions defined in (69) and (70). Using (23), (26), and triangle inequality, we can analyze the electrostatic potential and electric field intensity:

    unUnhV+ψnΨnhWC(hk+1ψ+enEnh+pnPnh). (73)

    Next, we prove enEnh0,q and pnPnh0,q. The elliptic projection will be used as an intermediate variable to assist this proof, and the main results are as follows:

    Lemma 4.1. Let (Rhen,Rhpn) be the elliptic projection solution of (27)–(28) at t=tn, (Enh,Pnh) be the two-grid solution of (71)–(72). If we choose E0h=Rhe0 and P0h=Rhp0, the regularity assumptions (A) hold, then for 1nN, 2q< and l,k1, we have

    RhenEnh0,qC(hl+1c+hk+1ψ+H2l+2c+H2k+2ψ+Δt), (74)
    RhpnPnh0,qC(hl+1c+hk+1ψ+H2l+2c+H2k+2ψ+Δt). (75)

    Proof. We subtract (15) and (27) from (71) at t=tn to obtain the following error equation:

    (τeEnh,z)(ϕneenτe,z)+(De(EnhRhen),z)=([enHUnh+(EnhenH)unHenun]μe,z)+α(μe[enH(PnhEnh+N)+(EnhenH)(pnHenH+N)en(pnen+N)],z)+(R(en,pn)R(Enh,Pnh),z)+λe(Rhenen,z),zMh. (76)

    We let ηne=EnhRhen and ηnp=PnhRhpn and select z=ηneηn1e=tηneΔt. Summing over 1nm, from (76), we have

    mn=1(tηne,tηne)Δt+12(Deηme,ηme)12(Deη0e,η0e)8i=1Ki, (77)

    where

    K1=mn=1(R(en,pn)R(Enh,Pnh),tηne)Δt,K2=mn=1(ξneξn1eΔt,tηne)Δt,K3=mn=1(ξn1eˆξn1eΔt,tηne)Δt,K4=mn=1(ˆηn1eηn1eΔt,tηne)Δt,K5=mn=1(ϕneenτeenˆen1Δt,tηne)Δt,K6=mn=1λe(ξne,tηne)Δt,K7=mn=1([enHUnh+(EnhenH)unHenun]μe,tηne)Δt,K8=mn=1α(μe[enH(PnhEnh+N)+(EnhenH)(pnHenH+N)en(pnen+N)],tηne)Δt.

    Now we estimate each term on the right hand of (77) as follows. First, using a second-order Taylor expansion at point (enH,pnH) for R(en,pn), (29), (54) and (55), we have

    |K1|mn=1(Re(enH,pnH)(enEnh)+Rp(enH,pnH)(pnPnh)+12Ree(e,p)(enenH)2+Rep(e,p)(enenH)(pnpnH)+12Rpp(e,p)(pnpnH)2tηneΔtCmn=1(enEnh+pnPnh+enenH20,4+enenH0,4pnpnH0,4
    +pnpnH20,4)tηneΔtC(h2l+2c+H4l+4c+H4k+4ψ+(Δt)4+mn=1(ηne2+ηnp2)Δt)+εmn=1tηne2Δt, (78)

    where e is a point between en and enH, p is a point between pn and pnH.

    Similar to the proof process of Lemma 3.2, we give the following error estimations directly,

    |K2|Ch2l+2c+εmn=1tηne2Δt, (79)
    |K3|Ch2lc+εmn=1tηne2Δt, (80)
    |K4|Cmn=1ηn1e2Δt+εmn=1tηne2Δt, (81)
    |K5|C(t)22eτ2e2L2(J;L2(Ω))+εmn=1tηne2Δt, (82)
    |K6|Ch2l+2c+εmn=1tηne2Δt. (83)

    For K7, we have

    enHUnh+(EnhenH)unHenun=enH(Unhun)+(enHEnh)(ununH)+(Enhen)un=I1+I2+I3.

    Using (73) and (29), we have

    |mn=1(I1,tηne)Δt|Cmn=1unUnhtηneΔtC(mn=1(ηne2+ηnp2)Δt+h2l+2c+h2k+2ψ)+εmn=1tηne2Δt. (84)

    Using (64), (54), and (31), we have

    |mn=1(I2,tηne)Δt|=|mn=1((enHen)(ununH)+(enRhen)(ununH)+(RhenEnh)(ununH),tηne)Δt|mn=1(enHen0,4ununH0,4+enRhen0,4ununH0,4+ununH0,RhenEnh)tηneΔt
    C(H4l+4c+H4k+4ψ+h4l+4c+(Δt)4+mn=1ηne2Δt)+εmn=1tηne2Δt, (85)
    |mn=1(I3,tηne)Δt|Cmn=1(EnhRhen+Rhenen)tηneΔtC(mn=1ηne2Δt+h2l+2c)+εmn=1tηne2Δt. (86)

    From (84)–(86), we obtain

    |K7|C(mn=1(ηne2+ηnp2)Δt+h2l+2c+h2k+2ψ+H4l+4c+H4k+4ψ+(Δt)4)+εmn=1tηne2Δt. (87)

    For K8, we have

    enH(PnhEnh+N)+(EnhenH)(pnHenH+N)en(pnen+N)=(Enhen)(pnen+N)+(enHEnh)(pnpnH+enHen)enH(pnPnh+Enhen)=J1+J2+J3.

    Related to J1, we have

    |mn=1(J1,tηne)Δt|Cmn=1EnhentηneΔtC(mn=1ηne2Δt+h2l+2c)+εmn=1tηne2Δt. (88)

    Related to J2, we have

    |mn=1(J2,tηne)Δt|=|mn=1((enHEnh)(pnpnH)+(enHEnh)(enHen),tηne)Δt|=|mn=1(J21+J22,tηne)Δt|.

    Using (54), (55), and (31), we have

    |mn=1(J21,tηne)Δt|=|mn=1((enHen)(pnpnH)+(enRhen)(pnpnH)+(RhenEnh)(pnpnH),tηne)Δt|mn=1(enHen0,4pnpnH0,4+enRhen0,4pnpnH0,4+pnpnH0,RhenEnh)tηneΔt
    C(H4l+4c+H4k+4ψ+h4l+4c+(Δt)4+mn=1ηne2Δt)+εmn=1tηne2Δt. (89)

    Similar to J21, we have the same estimation of J22. Finally, for J3 we have

    |mn=1(J3,tηne)Δt|Cmn=1(pnPnh+Enhen)tηneΔtC(mn=1(ηne2+ηnp2)Δt+h2l+2c)+εmn=1tηne2Δt. (90)

    From (88)–(90), we obtain

    |K8|C(mn=1(ηne2+ηnp2)Δt+h2l+2c+H4l+4c+H4k+4ψ+(Δt)4)+εmn=1tηne2Δt. (91)

    Combining (77) with estimates (78)–(83), (87) and (91), and noting that E0h=Rhe0 and P0h=Rhp0, we have

    mn=1tηne2Δt+ηme2C(h2lc+h2k+2ψ+H4l+4c+H4k+4ψ+(Δt)2+mn=1(ηne21+ηnp2)Δt)+εmn=1tηne2Δt. (92)

    Similar to the proof process of Lemma 3.2, we determine that

    ηme0,qC(hl+1c+hk+1ψ+H2l+2c+H2k+2ψ+Δt), (93)

    which yields (74). Similarly, we can obtain (75).

    Using the triangle inequality, (31), (32), and Lemma 4.1, we have the following results:

    Theorem 4.2. Let (en,pn) be the solution of (15)–(16) at t=tn, and (Enh,Pnh) be the two-grid solution of (71)–(72). If the regularity assumptions (A) hold, and the initial functions E0h=Rhe0 and P0h=Rhp0, then for 1nN, 2q< and l,k1, we have

    enEnh0,qC(hl+1c+hk+1ψ+H2l+2c+H2k+2ψ+Δt), (94)
    pnPnh0,qC(hl+1c+hk+1ψ+H2l+2c+H2k+2ψ+Δt). (95)

    Lastly, from Theorem 4.2 and (73), we obtain

    Theorem 4.3. Let (ψn,un) be the solution of (13)–(14) at t=tn, and (Ψnh,Unh) be the two-grid solution of (69)–(70). If the regularity assumptions (A) hold, and the initial functions E0h=Rhe0 and P0h=Rhp0, then for 1nN and l,k1, we have

    unUnhV+ψnΨnhWC(hl+1c+hk+1ψ+H2l+2c+H2k+2ψ+Δt). (96)

    In this section, the numerical experiment is presented to illustrate the efficiency of the two-grid method for solving the semiconductor device problem in Section 4.

    We consider the following equations with Dirichlet boundary condition:

    Δψ=pe, (97)
    etΔe+(eψ)=f1, (98)
    ptΔp(pψ)=f2, (99)

    where Ω=(0,1)2, t[0,T]. We take the exact solutions of (97)–(99) are

    ψ=exp(t)sin(πx1)sin(πx2)t3sin(2πx1)sin(2πx2),e=8π2t3sin(2πx1)sin(2πx2),p=2π2exp(t)sin(πx1)sin(πx2).

    The right hand sides f1 and f2 are determined by the above exact solutions.

    We use piecewise constant for ψ, the lowest Raviart–Thomas element for u and piecewise linear continuous function for e, p. We select the time step τ=1.0e2 and T=1. For the sake of simplicity, we assume hψ=hc=h, Hψ=Hc=H. The exact solutions en, pn, ψn, the characteristics finite element and the mixed finite element method solutions enh, pnh, ψnh and the two-grid method solutions Enh, Pnh, Ψnh are shown in Figs. 1-9. To compare these pictures, we can see that the solutions of finite element method and two-grid method are identical with the exact solutions. From Figs. 10-13, we can observe that the convergence rate of the error for enenh, pnpnh, ψnψnh, and ununh, respectively. In Tables 13, we present the numerical results for error estimates and CPU time cost of the finite element method and the two-grid method. As shown in Tables 13, we can know that when the coarse grid and the fine grid satisfy H=h12, the two-grid method achieves the same accuracy as the finite element method but requires less time.

    Figure 1.  The exact solution en, h=1/64, n=100.
    Figure 2.  The exact solution pn, h=1/64, n=100.
    Figure 3.  The exact solution ψn, h=1/64, n=100.
    Figure 4.  Finite element solution enh, h=1/64, n=100.
    Figure 5.  Finite element solution pnh, h=1/64, n=100.
    Figure 6.  Finite element solution ψnh, h=1/64, n=100.
    Figure 7.  Two-grid solution Enh, H=1/8, h=1/64, n=100.
    Figure 8.  Two-grid solution Pnh, H=1/8, h=1/64, n=100.
    Figure 9.  Two-grid solution Ψnh, H=1/8, h=1/64, n=100.
    Figure 10.  Order of finite element solution enh, n=100.
    Figure 11.  Order of finite element solution pnh, n=100.
    Figure 12.  Order of finite element solution unh, n=100.
    Figure 13.  Order of finite element solution ψnh, n=100.
    Table 1.  Error and CPU time of the finite element method for n=100.
    h enenh pnpnh ψnψnh ununh CPU time
    14 2.0125e-2 4.1448e-3 4.6324e-4 2.4411e-3 0.4850s
    18 6.3665e-3 1.1304e-3 2.3741e-4 1.2207e-3 1.0107s
    116 1.6748e-3 3.1703e-4 1.1935e-4 6.0937e-4 3.4394s
    132 4.0476e-4 1.1037e-4 5.9754e-5 3.0453e-4 15.1790s
    164 9.3634e-5 5.9437e-5 2.9886e-5 1.5224e-4 74.9759s

     | Show Table
    DownLoad: CSV
    Table 2.  Error and CPU time of the two-grid method for n=100, H=18 with different h=116,132,164.
    H h enEnh pnPnh ψnΨnh unUnh CPU time
    18 116 1.6698e-3 3.3035e-4 1.1935e-4 6.0937e-4 1.0793s
    18 132 4.0302e-4 1.1523e-4 5.9754e-5 3.0453e-4 4.1308s
    18 164 9.7872e-5 6.4727e-5 2.9886e-5 1.5224e-4 20.4816s

     | Show Table
    DownLoad: CSV
    Table 3.  Error and CPU time of the two-grid method for n=100, and h=H2=14,116,164.
    H h enEnh pnPnh ψnΨnh unUnh CPU time
    12 14 2.0132e-2 4.1526e-3 4.6324e-4 2.4411e-3 0.1774s
    14 116 1.6698e-3 3.3035e-4 1.1935e-4 6.0937e-4 1.0310s
    18 164 9.7872e-5 6.4727e-5 2.9886e-5 1.5224e-4 20.4816s

     | Show Table
    DownLoad: CSV

    This paper has presented a two-grid algorithm for coupled semiconductor device equations discretized by the mixed finite element method and the characteristics finite element method. The fundamental idea of the two-grid method is that we can solve non-linear equations by applying the Newton iteration procedure on the fine grid to linearize the non-linear system. It was shown that the two-grid method still achieves asymptotically optimal approximations as long as a mesh size between those of coarse and fine grids satisfies H=O(h1/2). From the numerical experiment, we can find that less time will be required for the two-grid algorithm since only a small-scale non-linear problem must be solved. Hence, the two-grid method is an effective method for solving the semiconductor device problem. In our future work, we will consider more complicated two-grid algorithms for the semiconductor device problem by the mixed finite element method of characteristics.

    We would like to express our gratitude to the anonymous referees for their helpful suggestions.



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