1316643e7SJed Brown /* 2316643e7SJed Brown Code for timestepping with implicit Theta method 3316643e7SJed Brown */ 4af0996ceSBarry Smith #include <petsc/private/tsimpl.h> /*I "petscts.h" I*/ 5a055c8caSBarry Smith #include <petscsnes.h> 61e25c274SJed Brown #include <petscdm.h> 73c54f92cSHong Zhang #include <petscmat.h> 8316643e7SJed Brown 9316643e7SJed Brown typedef struct { 10715f1b00SHong Zhang /* context for time stepping */ 111566a47fSLisandro Dalcin PetscReal stage_time; 121566a47fSLisandro Dalcin Vec X0,X,Xdot; /* Storage for stages and time derivative */ 131566a47fSLisandro Dalcin Vec affine; /* Affine vector needed for residual at beginning of step in endpoint formulation */ 141566a47fSLisandro Dalcin PetscReal Theta; 15715f1b00SHong Zhang PetscReal ptime; 16715f1b00SHong Zhang PetscReal time_step; 173e05ceb1SHong Zhang PetscReal shift; 181566a47fSLisandro Dalcin PetscInt order; 191566a47fSLisandro Dalcin PetscBool endpoint; 201566a47fSLisandro Dalcin PetscBool extrapolate; 21715f1b00SHong Zhang TSStepStatus status; 22715f1b00SHong Zhang Vec VecCostIntegral0; /* Backup for roll-backs due to events */ 231566a47fSLisandro Dalcin 24715f1b00SHong Zhang /* context for sensitivity analysis */ 25022c081aSHong Zhang PetscInt num_tlm; /* Total number of tangent linear equations */ 26b5e0532dSHong Zhang Vec *VecsDeltaLam; /* Increment of the adjoint sensitivity w.r.t IC at stage */ 27b5e0532dSHong Zhang Vec *VecsDeltaMu; /* Increment of the adjoint sensitivity w.r.t P at stage */ 2813b1b0ffSHong Zhang Vec *VecsSensiTemp; /* Vector to be multiplied with Jacobian transpose */ 2913b1b0ffSHong Zhang Mat MatDeltaFwdSensip; /* Increment of the forward sensitivity at stage */ 30b5b4017aSHong Zhang Vec VecDeltaFwdSensipCol; /* Working vector for holding one column of the sensitivity matrix */ 3113b1b0ffSHong Zhang Mat MatFwdSensip0; /* backup for roll-backs due to events */ 327207e0fdSHong Zhang Mat MatIntegralSensipTemp; /* Working vector for forward integral sensitivity */ 337207e0fdSHong Zhang Mat MatIntegralSensip0; /* backup for roll-backs due to events */ 34b5b4017aSHong Zhang Vec *VecsDeltaLam2; /* Increment of the 2nd-order adjoint sensitivity w.r.t IC at stage */ 35b5b4017aSHong Zhang Vec *VecsDeltaMu2; /* Increment of the 2nd-order adjoint sensitivity w.r.t P at stage */ 36b5b4017aSHong Zhang Vec *VecsSensi2Temp; /* Working vectors that holds the residual for the second-order adjoint */ 37b5b4017aSHong Zhang Vec *VecsAffine; /* Working vectors to store residuals */ 38715f1b00SHong Zhang /* context for error estimation */ 391566a47fSLisandro Dalcin Vec vec_sol_prev; 401566a47fSLisandro Dalcin Vec vec_lte_work; 41316643e7SJed Brown } TS_Theta; 42316643e7SJed Brown 437445fe48SJed Brown static PetscErrorCode TSThetaGetX0AndXdot(TS ts,DM dm,Vec *X0,Vec *Xdot) 447445fe48SJed Brown { 457445fe48SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 467445fe48SJed Brown PetscErrorCode ierr; 477445fe48SJed Brown 487445fe48SJed Brown PetscFunctionBegin; 497445fe48SJed Brown if (X0) { 507445fe48SJed Brown if (dm && dm != ts->dm) { 510d0b770aSPeter Brune ierr = DMGetNamedGlobalVector(dm,"TSTheta_X0",X0);CHKERRQ(ierr); 527445fe48SJed Brown } else *X0 = ts->vec_sol; 537445fe48SJed Brown } 547445fe48SJed Brown if (Xdot) { 557445fe48SJed Brown if (dm && dm != ts->dm) { 560d0b770aSPeter Brune ierr = DMGetNamedGlobalVector(dm,"TSTheta_Xdot",Xdot);CHKERRQ(ierr); 577445fe48SJed Brown } else *Xdot = th->Xdot; 587445fe48SJed Brown } 597445fe48SJed Brown PetscFunctionReturn(0); 607445fe48SJed Brown } 617445fe48SJed Brown 620d0b770aSPeter Brune static PetscErrorCode TSThetaRestoreX0AndXdot(TS ts,DM dm,Vec *X0,Vec *Xdot) 630d0b770aSPeter Brune { 640d0b770aSPeter Brune PetscErrorCode ierr; 650d0b770aSPeter Brune 660d0b770aSPeter Brune PetscFunctionBegin; 670d0b770aSPeter Brune if (X0) { 680d0b770aSPeter Brune if (dm && dm != ts->dm) { 690d0b770aSPeter Brune ierr = DMRestoreNamedGlobalVector(dm,"TSTheta_X0",X0);CHKERRQ(ierr); 700d0b770aSPeter Brune } 710d0b770aSPeter Brune } 720d0b770aSPeter Brune if (Xdot) { 730d0b770aSPeter Brune if (dm && dm != ts->dm) { 740d0b770aSPeter Brune ierr = DMRestoreNamedGlobalVector(dm,"TSTheta_Xdot",Xdot);CHKERRQ(ierr); 750d0b770aSPeter Brune } 760d0b770aSPeter Brune } 770d0b770aSPeter Brune PetscFunctionReturn(0); 780d0b770aSPeter Brune } 790d0b770aSPeter Brune 807445fe48SJed Brown static PetscErrorCode DMCoarsenHook_TSTheta(DM fine,DM coarse,void *ctx) 817445fe48SJed Brown { 827445fe48SJed Brown PetscFunctionBegin; 837445fe48SJed Brown PetscFunctionReturn(0); 847445fe48SJed Brown } 857445fe48SJed Brown 867445fe48SJed Brown static PetscErrorCode DMRestrictHook_TSTheta(DM fine,Mat restrct,Vec rscale,Mat inject,DM coarse,void *ctx) 877445fe48SJed Brown { 887445fe48SJed Brown TS ts = (TS)ctx; 897445fe48SJed Brown PetscErrorCode ierr; 907445fe48SJed Brown Vec X0,Xdot,X0_c,Xdot_c; 917445fe48SJed Brown 927445fe48SJed Brown PetscFunctionBegin; 937445fe48SJed Brown ierr = TSThetaGetX0AndXdot(ts,fine,&X0,&Xdot);CHKERRQ(ierr); 947445fe48SJed Brown ierr = TSThetaGetX0AndXdot(ts,coarse,&X0_c,&Xdot_c);CHKERRQ(ierr); 957445fe48SJed Brown ierr = MatRestrict(restrct,X0,X0_c);CHKERRQ(ierr); 967445fe48SJed Brown ierr = MatRestrict(restrct,Xdot,Xdot_c);CHKERRQ(ierr); 977445fe48SJed Brown ierr = VecPointwiseMult(X0_c,rscale,X0_c);CHKERRQ(ierr); 987445fe48SJed Brown ierr = VecPointwiseMult(Xdot_c,rscale,Xdot_c);CHKERRQ(ierr); 990d0b770aSPeter Brune ierr = TSThetaRestoreX0AndXdot(ts,fine,&X0,&Xdot);CHKERRQ(ierr); 1000d0b770aSPeter Brune ierr = TSThetaRestoreX0AndXdot(ts,coarse,&X0_c,&Xdot_c);CHKERRQ(ierr); 1017445fe48SJed Brown PetscFunctionReturn(0); 1027445fe48SJed Brown } 1037445fe48SJed Brown 104258e1594SPeter Brune static PetscErrorCode DMSubDomainHook_TSTheta(DM dm,DM subdm,void *ctx) 105258e1594SPeter Brune { 106258e1594SPeter Brune PetscFunctionBegin; 107258e1594SPeter Brune PetscFunctionReturn(0); 108258e1594SPeter Brune } 109258e1594SPeter Brune 110258e1594SPeter Brune static PetscErrorCode DMSubDomainRestrictHook_TSTheta(DM dm,VecScatter gscat,VecScatter lscat,DM subdm,void *ctx) 111258e1594SPeter Brune { 112258e1594SPeter Brune TS ts = (TS)ctx; 113258e1594SPeter Brune PetscErrorCode ierr; 114258e1594SPeter Brune Vec X0,Xdot,X0_sub,Xdot_sub; 115258e1594SPeter Brune 116258e1594SPeter Brune PetscFunctionBegin; 117258e1594SPeter Brune ierr = TSThetaGetX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 118258e1594SPeter Brune ierr = TSThetaGetX0AndXdot(ts,subdm,&X0_sub,&Xdot_sub);CHKERRQ(ierr); 119258e1594SPeter Brune 120258e1594SPeter Brune ierr = VecScatterBegin(gscat,X0,X0_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 121258e1594SPeter Brune ierr = VecScatterEnd(gscat,X0,X0_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 122258e1594SPeter Brune 123258e1594SPeter Brune ierr = VecScatterBegin(gscat,Xdot,Xdot_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 124258e1594SPeter Brune ierr = VecScatterEnd(gscat,Xdot,Xdot_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 125258e1594SPeter Brune 126258e1594SPeter Brune ierr = TSThetaRestoreX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 127258e1594SPeter Brune ierr = TSThetaRestoreX0AndXdot(ts,subdm,&X0_sub,&Xdot_sub);CHKERRQ(ierr); 128258e1594SPeter Brune PetscFunctionReturn(0); 129258e1594SPeter Brune } 130258e1594SPeter Brune 131022c081aSHong Zhang static PetscErrorCode TSThetaEvaluateCostIntegral(TS ts) 132022c081aSHong Zhang { 133022c081aSHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 134cd4cee2dSHong Zhang TS quadts = ts->quadraturets; 135022c081aSHong Zhang PetscErrorCode ierr; 136022c081aSHong Zhang 137022c081aSHong Zhang PetscFunctionBegin; 138022c081aSHong Zhang if (th->endpoint) { 139022c081aSHong Zhang /* Evolve ts->vec_costintegral to compute integrals */ 140022c081aSHong Zhang if (th->Theta!=1.0) { 141cd4cee2dSHong Zhang ierr = TSComputeRHSFunction(quadts,th->ptime,th->X0,ts->vec_costintegrand);CHKERRQ(ierr); 142cd4cee2dSHong Zhang ierr = VecAXPY(quadts->vec_sol,th->time_step*(1.0-th->Theta),ts->vec_costintegrand);CHKERRQ(ierr); 143022c081aSHong Zhang } 144cd4cee2dSHong Zhang ierr = TSComputeRHSFunction(quadts,ts->ptime,ts->vec_sol,ts->vec_costintegrand);CHKERRQ(ierr); 145cd4cee2dSHong Zhang ierr = VecAXPY(quadts->vec_sol,th->time_step*th->Theta,ts->vec_costintegrand);CHKERRQ(ierr); 146022c081aSHong Zhang } else { 147cd4cee2dSHong Zhang ierr = TSComputeRHSFunction(quadts,th->stage_time,th->X,ts->vec_costintegrand);CHKERRQ(ierr); 148cd4cee2dSHong Zhang ierr = VecAXPY(quadts->vec_sol,th->time_step,ts->vec_costintegrand);CHKERRQ(ierr); 149022c081aSHong Zhang } 150022c081aSHong Zhang PetscFunctionReturn(0); 151022c081aSHong Zhang } 152022c081aSHong Zhang 153b1cb36f3SHong Zhang static PetscErrorCode TSForwardCostIntegral_Theta(TS ts) 154b1cb36f3SHong Zhang { 155b1cb36f3SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 156cd4cee2dSHong Zhang TS quadts = ts->quadraturets; 157b1cb36f3SHong Zhang PetscErrorCode ierr; 158b1cb36f3SHong Zhang 159b1cb36f3SHong Zhang PetscFunctionBegin; 160b1cb36f3SHong Zhang /* backup cost integral */ 161cd4cee2dSHong Zhang ierr = VecCopy(quadts->vec_sol,th->VecCostIntegral0);CHKERRQ(ierr); 162022c081aSHong Zhang ierr = TSThetaEvaluateCostIntegral(ts);CHKERRQ(ierr); 163b1cb36f3SHong Zhang PetscFunctionReturn(0); 164b1cb36f3SHong Zhang } 165b1cb36f3SHong Zhang 166b1cb36f3SHong Zhang static PetscErrorCode TSAdjointCostIntegral_Theta(TS ts) 167b1cb36f3SHong Zhang { 168b1cb36f3SHong Zhang PetscErrorCode ierr; 169b1cb36f3SHong Zhang 170b1cb36f3SHong Zhang PetscFunctionBegin; 171022c081aSHong Zhang ierr = TSThetaEvaluateCostIntegral(ts);CHKERRQ(ierr); 17224655328SShri PetscFunctionReturn(0); 17324655328SShri } 17424655328SShri 175470880abSPatrick Sanan static PetscErrorCode TSTheta_SNESSolve(TS ts,Vec b,Vec x) 1761566a47fSLisandro Dalcin { 1771566a47fSLisandro Dalcin PetscInt nits,lits; 1781566a47fSLisandro Dalcin PetscErrorCode ierr; 1791566a47fSLisandro Dalcin 1801566a47fSLisandro Dalcin PetscFunctionBegin; 1811566a47fSLisandro Dalcin ierr = SNESSolve(ts->snes,b,x);CHKERRQ(ierr); 1821566a47fSLisandro Dalcin ierr = SNESGetIterationNumber(ts->snes,&nits);CHKERRQ(ierr); 1831566a47fSLisandro Dalcin ierr = SNESGetLinearSolveIterations(ts->snes,&lits);CHKERRQ(ierr); 1841566a47fSLisandro Dalcin ts->snes_its += nits; ts->ksp_its += lits; 1851566a47fSLisandro Dalcin PetscFunctionReturn(0); 1861566a47fSLisandro Dalcin } 1871566a47fSLisandro Dalcin 188193ac0bcSJed Brown static PetscErrorCode TSStep_Theta(TS ts) 189316643e7SJed Brown { 190316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 1911566a47fSLisandro Dalcin PetscInt rejections = 0; 1924957b756SLisandro Dalcin PetscBool stageok,accept = PETSC_TRUE; 1931566a47fSLisandro Dalcin PetscReal next_time_step = ts->time_step; 194051f2191SLisandro Dalcin PetscErrorCode ierr; 195316643e7SJed Brown 196316643e7SJed Brown PetscFunctionBegin; 1971566a47fSLisandro Dalcin if (!ts->steprollback) { 1982ffb9264SLisandro Dalcin if (th->vec_sol_prev) { ierr = VecCopy(th->X0,th->vec_sol_prev);CHKERRQ(ierr); } 1993b1890cdSShri Abhyankar ierr = VecCopy(ts->vec_sol,th->X0);CHKERRQ(ierr); 2001566a47fSLisandro Dalcin } 2011566a47fSLisandro Dalcin 2021566a47fSLisandro Dalcin th->status = TS_STEP_INCOMPLETE; 2031566a47fSLisandro Dalcin while (!ts->reason && th->status != TS_STEP_COMPLETE) { 204715f1b00SHong Zhang 2053e05ceb1SHong Zhang th->shift = 1/(th->Theta*ts->time_step); 2061566a47fSLisandro Dalcin th->stage_time = ts->ptime + (th->endpoint ? (PetscReal)1 : th->Theta)*ts->time_step; 207316643e7SJed Brown 208be5899b3SLisandro Dalcin ierr = VecCopy(th->X0,th->X);CHKERRQ(ierr); 209fecfb714SLisandro Dalcin if (th->extrapolate && !ts->steprestart) { 2103e05ceb1SHong Zhang ierr = VecAXPY(th->X,1/th->shift,th->Xdot);CHKERRQ(ierr); 211be5899b3SLisandro Dalcin } 212eb284becSJed Brown if (th->endpoint) { /* This formulation assumes linear time-independent mass matrix */ 213eb284becSJed Brown if (!th->affine) {ierr = VecDuplicate(ts->vec_sol,&th->affine);CHKERRQ(ierr);} 2141566a47fSLisandro Dalcin ierr = VecZeroEntries(th->Xdot);CHKERRQ(ierr); 2151566a47fSLisandro Dalcin ierr = TSComputeIFunction(ts,ts->ptime,th->X0,th->Xdot,th->affine,PETSC_FALSE);CHKERRQ(ierr); 2161566a47fSLisandro Dalcin ierr = VecScale(th->affine,(th->Theta-1)/th->Theta);CHKERRQ(ierr); 2171566a47fSLisandro Dalcin } else if (th->affine) { /* Just in case th->endpoint is changed between calls to TSStep_Theta() */ 2181566a47fSLisandro Dalcin ierr = VecZeroEntries(th->affine);CHKERRQ(ierr); 219eb284becSJed Brown } 220be5899b3SLisandro Dalcin ierr = TSPreStage(ts,th->stage_time);CHKERRQ(ierr); 221470880abSPatrick Sanan ierr = TSTheta_SNESSolve(ts,th->affine,th->X);CHKERRQ(ierr); 222be5899b3SLisandro Dalcin ierr = TSPostStage(ts,th->stage_time,0,&th->X);CHKERRQ(ierr); 2231566a47fSLisandro Dalcin ierr = TSAdaptCheckStage(ts->adapt,ts,th->stage_time,th->X,&stageok);CHKERRQ(ierr); 224fecfb714SLisandro Dalcin if (!stageok) goto reject_step; 225051f2191SLisandro Dalcin 226051f2191SLisandro Dalcin th->status = TS_STEP_PENDING; 2271566a47fSLisandro Dalcin if (th->endpoint) { 2281566a47fSLisandro Dalcin ierr = VecCopy(th->X,ts->vec_sol);CHKERRQ(ierr); 2291566a47fSLisandro Dalcin } else { 2303e05ceb1SHong Zhang ierr = VecAXPBYPCZ(th->Xdot,-th->shift,th->shift,0,th->X0,th->X);CHKERRQ(ierr); 2311566a47fSLisandro Dalcin ierr = VecAXPY(ts->vec_sol,ts->time_step,th->Xdot);CHKERRQ(ierr); 2321566a47fSLisandro Dalcin } 2331566a47fSLisandro Dalcin ierr = TSAdaptChoose(ts->adapt,ts,ts->time_step,NULL,&next_time_step,&accept);CHKERRQ(ierr); 2341566a47fSLisandro Dalcin th->status = accept ? TS_STEP_COMPLETE : TS_STEP_INCOMPLETE; 2351566a47fSLisandro Dalcin if (!accept) { 2361566a47fSLisandro Dalcin ierr = VecCopy(th->X0,ts->vec_sol);CHKERRQ(ierr); 237be5899b3SLisandro Dalcin ts->time_step = next_time_step; 238be5899b3SLisandro Dalcin goto reject_step; 239051f2191SLisandro Dalcin } 2403b1890cdSShri Abhyankar 241715f1b00SHong Zhang if (ts->forward_solve || ts->costintegralfwd) { /* Save the info for the later use in cost integral evaluation */ 242b1cb36f3SHong Zhang th->ptime = ts->ptime; 243b1cb36f3SHong Zhang th->time_step = ts->time_step; 24417145e75SHong Zhang } 2451566a47fSLisandro Dalcin 2462b5a38e1SLisandro Dalcin ts->ptime += ts->time_step; 247cdbf8f93SLisandro Dalcin ts->time_step = next_time_step; 248051f2191SLisandro Dalcin break; 249051f2191SLisandro Dalcin 250051f2191SLisandro Dalcin reject_step: 251fecfb714SLisandro Dalcin ts->reject++; accept = PETSC_FALSE; 2521566a47fSLisandro Dalcin if (!ts->reason && ++rejections > ts->max_reject && ts->max_reject >= 0) { 253051f2191SLisandro Dalcin ts->reason = TS_DIVERGED_STEP_REJECTED; 2541566a47fSLisandro Dalcin ierr = PetscInfo2(ts,"Step=%D, step rejections %D greater than current TS allowed, stopping solve\n",ts->steps,rejections);CHKERRQ(ierr); 2553b1890cdSShri Abhyankar } 2563b1890cdSShri Abhyankar } 257316643e7SJed Brown PetscFunctionReturn(0); 258316643e7SJed Brown } 259316643e7SJed Brown 260c9681e5dSHong Zhang static PetscErrorCode TSAdjointStepBEuler_Private(TS ts) 261c9681e5dSHong Zhang { 262c9681e5dSHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 263cd4cee2dSHong Zhang TS quadts = ts->quadraturets; 264c9681e5dSHong Zhang Vec *VecsDeltaLam = th->VecsDeltaLam,*VecsDeltaMu = th->VecsDeltaMu,*VecsSensiTemp = th->VecsSensiTemp; 265c9681e5dSHong Zhang Vec *VecsDeltaLam2 = th->VecsDeltaLam2,*VecsDeltaMu2 = th->VecsDeltaMu2,*VecsSensi2Temp = th->VecsSensi2Temp; 266c9681e5dSHong Zhang PetscInt nadj; 2677207e0fdSHong Zhang Mat J,Jpre,quadJ = NULL,quadJp = NULL; 268c9681e5dSHong Zhang KSP ksp; 269c9681e5dSHong Zhang PetscScalar *xarr; 270077c4feaSHong Zhang TSEquationType eqtype; 271077c4feaSHong Zhang PetscBool isexplicitode = PETSC_FALSE; 272c9681e5dSHong Zhang PetscErrorCode ierr; 273c9681e5dSHong Zhang 274c9681e5dSHong Zhang PetscFunctionBegin; 275077c4feaSHong Zhang ierr = TSGetEquationType(ts,&eqtype);CHKERRQ(ierr); 276077c4feaSHong Zhang if (eqtype == TS_EQ_ODE_EXPLICIT) { 277077c4feaSHong Zhang isexplicitode = PETSC_TRUE; 278077c4feaSHong Zhang VecsDeltaLam = ts->vecs_sensi; 279077c4feaSHong Zhang VecsDeltaLam2 = ts->vecs_sensi2; 280077c4feaSHong Zhang } 281c9681e5dSHong Zhang th->status = TS_STEP_INCOMPLETE; 282c9681e5dSHong Zhang ierr = SNESGetKSP(ts->snes,&ksp);CHKERRQ(ierr); 283cd4cee2dSHong Zhang ierr = TSGetIJacobian(ts,&J,&Jpre,NULL,NULL);CHKERRQ(ierr); 2847207e0fdSHong Zhang if (quadts) { 285cd4cee2dSHong Zhang ierr = TSGetRHSJacobian(quadts,&quadJ,NULL,NULL,NULL);CHKERRQ(ierr); 286cd4cee2dSHong Zhang ierr = TSGetRHSJacobianP(quadts,&quadJp,NULL,NULL);CHKERRQ(ierr); 2877207e0fdSHong Zhang } 288c9681e5dSHong Zhang 289c9681e5dSHong Zhang /* If endpoint=1, th->ptime and th->X0 will be used; if endpoint=0, th->stage_time and th->X will be used. */ 290c9681e5dSHong Zhang th->stage_time = ts->ptime; /* time_step is negative*/ 291c9681e5dSHong Zhang th->ptime = ts->ptime + ts->time_step; 292c9681e5dSHong Zhang th->time_step = -ts->time_step; 293c9681e5dSHong Zhang 29433f72c5dSHong Zhang /* Build RHS for first-order adjoint lambda_{n+1}/h + r_u^T(n+1) */ 2957207e0fdSHong Zhang if (quadts) { 296cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->stage_time,th->X,quadJ,NULL);CHKERRQ(ierr); 2977207e0fdSHong Zhang } 298cd4cee2dSHong Zhang 299c9681e5dSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 300c9681e5dSHong Zhang ierr = VecCopy(ts->vecs_sensi[nadj],VecsSensiTemp[nadj]);CHKERRQ(ierr); 301c9681e5dSHong Zhang ierr = VecScale(VecsSensiTemp[nadj],1./th->time_step);CHKERRQ(ierr); /* lambda_{n+1}/h */ 302cd4cee2dSHong Zhang if (quadJ) { 303cd4cee2dSHong Zhang ierr = MatDenseGetColumn(quadJ,nadj,&xarr);CHKERRQ(ierr); 304cd4cee2dSHong Zhang ierr = VecPlaceArray(ts->vec_drdu_col,xarr);CHKERRQ(ierr); 305cd4cee2dSHong Zhang ierr = VecAXPY(VecsSensiTemp[nadj],1.,ts->vec_drdu_col);CHKERRQ(ierr); 306cd4cee2dSHong Zhang ierr = VecResetArray(ts->vec_drdu_col);CHKERRQ(ierr); 307cd4cee2dSHong Zhang ierr = MatDenseRestoreColumn(quadJ,&xarr);CHKERRQ(ierr); 308c9681e5dSHong Zhang } 309c9681e5dSHong Zhang } 310c9681e5dSHong Zhang 311c9681e5dSHong Zhang /* Build LHS for first-order adjoint */ 31204f7482eSHong Zhang ierr = TSComputeSNESJacobian(ts,th->X,J,Jpre);CHKERRQ(ierr); 31304f7482eSHong Zhang ierr = KSPSetOperators(ksp,J,Jpre);CHKERRQ(ierr); 314c9681e5dSHong Zhang 315c9681e5dSHong Zhang /* Solve stage equation LHS*lambda_s = RHS for first-order adjoint */ 316c9681e5dSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 317c9681e5dSHong Zhang KSPConvergedReason kspreason; 318c9681e5dSHong Zhang ierr = KSPSolveTranspose(ksp,VecsSensiTemp[nadj],VecsDeltaLam[nadj]);CHKERRQ(ierr); 319c9681e5dSHong Zhang ierr = KSPGetConvergedReason(ksp,&kspreason);CHKERRQ(ierr); 320c9681e5dSHong Zhang if (kspreason < 0) { 321c9681e5dSHong Zhang ts->reason = TSADJOINT_DIVERGED_LINEAR_SOLVE; 32229b3c8a1SHong Zhang ierr = PetscInfo2(ts,"Step=%D, %Dth cost function, transposed linear solve fails, stopping 1st-order adjoint solve\n",ts->steps,nadj);CHKERRQ(ierr); 323c9681e5dSHong Zhang } 324c9681e5dSHong Zhang } 325c9681e5dSHong Zhang 326c9681e5dSHong Zhang if (ts->vecs_sensi2) { /* U_{n+1} */ 327c9681e5dSHong Zhang /* Get w1 at t_{n+1} from TLM matrix */ 328c9681e5dSHong Zhang ierr = MatDenseGetColumn(ts->mat_sensip,0,&xarr);CHKERRQ(ierr); 329c9681e5dSHong Zhang ierr = VecPlaceArray(ts->vec_sensip_col,xarr);CHKERRQ(ierr); 330c9681e5dSHong Zhang /* lambda_s^T F_UU w_1 */ 331b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionUU(ts,th->stage_time,th->X,VecsDeltaLam,ts->vec_sensip_col,ts->vecs_fuu);CHKERRQ(ierr); 332c9681e5dSHong Zhang /* lambda_s^T F_UP w_2 */ 333b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionUP(ts,th->stage_time,th->X,VecsDeltaLam,ts->vec_dir,ts->vecs_fup);CHKERRQ(ierr); 334c9681e5dSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { /* compute the residual */ 335c9681e5dSHong Zhang ierr = VecCopy(ts->vecs_sensi2[nadj],VecsSensi2Temp[nadj]);CHKERRQ(ierr); 3366980b705SHong Zhang ierr = VecScale(VecsSensi2Temp[nadj],1./th->time_step);CHKERRQ(ierr); 33733f72c5dSHong Zhang ierr = VecAXPY(VecsSensi2Temp[nadj],-1.,ts->vecs_fuu[nadj]);CHKERRQ(ierr); 338c9681e5dSHong Zhang if (ts->vecs_fup) { 33933f72c5dSHong Zhang ierr = VecAXPY(VecsSensi2Temp[nadj],-1.,ts->vecs_fup[nadj]);CHKERRQ(ierr); 340c9681e5dSHong Zhang } 341c9681e5dSHong Zhang } 342c9681e5dSHong Zhang /* Solve stage equation LHS X = RHS for second-order adjoint */ 343c9681e5dSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 34405c9950eSHong Zhang KSPConvergedReason kspreason; 345c9681e5dSHong Zhang ierr = KSPSolveTranspose(ksp,VecsSensi2Temp[nadj],VecsDeltaLam2[nadj]);CHKERRQ(ierr); 34605c9950eSHong Zhang ierr = KSPGetConvergedReason(ksp,&kspreason);CHKERRQ(ierr); 34705c9950eSHong Zhang if (kspreason < 0) { 34805c9950eSHong Zhang ts->reason = TSADJOINT_DIVERGED_LINEAR_SOLVE; 34929b3c8a1SHong Zhang ierr = PetscInfo2(ts,"Step=%D, %Dth cost function, transposed linear solve fails, stopping 2nd-order adjoint solve\n",ts->steps,nadj);CHKERRQ(ierr); 35005c9950eSHong Zhang } 351c9681e5dSHong Zhang } 352c9681e5dSHong Zhang } 353c9681e5dSHong Zhang 354c9681e5dSHong Zhang /* Update sensitivities, and evaluate integrals if there is any */ 355077c4feaSHong Zhang if (!isexplicitode) { 3563e05ceb1SHong Zhang th->shift = 0.0; 35704f7482eSHong Zhang ierr = TSComputeSNESJacobian(ts,th->X,J,Jpre);CHKERRQ(ierr); 35804f7482eSHong Zhang ierr = KSPSetOperators(ksp,J,Jpre);CHKERRQ(ierr); 359c9681e5dSHong Zhang ierr = MatScale(J,-1.);CHKERRQ(ierr); 360c9681e5dSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 36133f72c5dSHong Zhang /* Add f_U \lambda_s to the original RHS */ 362c9681e5dSHong Zhang ierr = MatMultTransposeAdd(J,VecsDeltaLam[nadj],VecsSensiTemp[nadj],VecsSensiTemp[nadj]);CHKERRQ(ierr); 363c9681e5dSHong Zhang ierr = VecScale(VecsSensiTemp[nadj],th->time_step);CHKERRQ(ierr); 364c9681e5dSHong Zhang ierr = VecCopy(VecsSensiTemp[nadj],ts->vecs_sensi[nadj]);CHKERRQ(ierr); 365c9681e5dSHong Zhang if (ts->vecs_sensi2) { 366c9681e5dSHong Zhang ierr = MatMultTransposeAdd(J,VecsDeltaLam2[nadj],VecsSensi2Temp[nadj],VecsSensi2Temp[nadj]);CHKERRQ(ierr); 367c9681e5dSHong Zhang ierr = VecScale(VecsSensi2Temp[nadj],th->time_step);CHKERRQ(ierr); 368c9681e5dSHong Zhang ierr = VecCopy(VecsSensi2Temp[nadj],ts->vecs_sensi2[nadj]);CHKERRQ(ierr); 369c9681e5dSHong Zhang } 370c9681e5dSHong Zhang } 371077c4feaSHong Zhang } 372c9681e5dSHong Zhang if (ts->vecs_sensip) { 373feb237baSPierre Jolivet th->shift = 1./th->time_step; 3743e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->stage_time,th->X,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); /* get -f_p */ 3757207e0fdSHong Zhang if (quadts) { 376cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->stage_time,th->X,quadJp);CHKERRQ(ierr); 3777207e0fdSHong Zhang } 378c9681e5dSHong Zhang if (ts->vecs_sensi2p) { 379c9681e5dSHong Zhang /* lambda_s^T F_PU w_1 */ 380b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionPU(ts,th->stage_time,th->X,VecsDeltaLam,ts->vec_sensip_col,ts->vecs_fpu);CHKERRQ(ierr); 38133f72c5dSHong Zhang /* lambda_s^T F_PP w_2 */ 382b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionPP(ts,th->stage_time,th->X,VecsDeltaLam,ts->vec_dir,ts->vecs_fpp);CHKERRQ(ierr); 383c9681e5dSHong Zhang } 384cd4cee2dSHong Zhang 385c9681e5dSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 386c9681e5dSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam[nadj],VecsDeltaMu[nadj]);CHKERRQ(ierr); 387c9681e5dSHong Zhang ierr = VecAXPY(ts->vecs_sensip[nadj],-th->time_step,VecsDeltaMu[nadj]);CHKERRQ(ierr); 388cd4cee2dSHong Zhang if (quadJp) { 389cd4cee2dSHong Zhang ierr = MatDenseGetColumn(quadJp,nadj,&xarr);CHKERRQ(ierr); 390cd4cee2dSHong Zhang ierr = VecPlaceArray(ts->vec_drdp_col,xarr);CHKERRQ(ierr); 391cd4cee2dSHong Zhang ierr = VecAXPY(ts->vecs_sensip[nadj],th->time_step,ts->vec_drdp_col);CHKERRQ(ierr); 392cd4cee2dSHong Zhang ierr = VecResetArray(ts->vec_drdp_col);CHKERRQ(ierr); 393cd4cee2dSHong Zhang ierr = MatDenseRestoreColumn(quadJp,&xarr);CHKERRQ(ierr); 39433f72c5dSHong Zhang } 395c9681e5dSHong Zhang if (ts->vecs_sensi2p) { 396c9681e5dSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam2[nadj],VecsDeltaMu2[nadj]);CHKERRQ(ierr); 397c9681e5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step,VecsDeltaMu2[nadj]);CHKERRQ(ierr); 398c9681e5dSHong Zhang if (ts->vecs_fpu) { 399c9681e5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step,ts->vecs_fpu[nadj]);CHKERRQ(ierr); 400c9681e5dSHong Zhang } 401c9681e5dSHong Zhang if (ts->vecs_fpp) { 402c9681e5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step,ts->vecs_fpp[nadj]);CHKERRQ(ierr); 403c9681e5dSHong Zhang } 404c9681e5dSHong Zhang } 405c9681e5dSHong Zhang } 406c9681e5dSHong Zhang } 407c9681e5dSHong Zhang 408c9681e5dSHong Zhang if (ts->vecs_sensi2) { 409c9681e5dSHong Zhang ierr = VecResetArray(ts->vec_sensip_col);CHKERRQ(ierr); 410c9681e5dSHong Zhang ierr = MatDenseRestoreColumn(ts->mat_sensip,&xarr);CHKERRQ(ierr); 411c9681e5dSHong Zhang } 412c9681e5dSHong Zhang th->status = TS_STEP_COMPLETE; 413c9681e5dSHong Zhang PetscFunctionReturn(0); 414c9681e5dSHong Zhang } 415c9681e5dSHong Zhang 41642f2b339SBarry Smith static PetscErrorCode TSAdjointStep_Theta(TS ts) 4172ca6e920SHong Zhang { 4182ca6e920SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 419cd4cee2dSHong Zhang TS quadts = ts->quadraturets; 420b5e0532dSHong Zhang Vec *VecsDeltaLam = th->VecsDeltaLam,*VecsDeltaMu = th->VecsDeltaMu,*VecsSensiTemp = th->VecsSensiTemp; 421b5b4017aSHong Zhang Vec *VecsDeltaLam2 = th->VecsDeltaLam2,*VecsDeltaMu2 = th->VecsDeltaMu2,*VecsSensi2Temp = th->VecsSensi2Temp; 4222ca6e920SHong Zhang PetscInt nadj; 4237207e0fdSHong Zhang Mat J,Jpre,quadJ = NULL,quadJp = NULL; 4242ca6e920SHong Zhang KSP ksp; 425b5b4017aSHong Zhang PetscScalar *xarr; 426b5b4017aSHong Zhang PetscErrorCode ierr; 4272ca6e920SHong Zhang 4282ca6e920SHong Zhang PetscFunctionBegin; 429c9681e5dSHong Zhang if (th->Theta == 1.) { 430c9681e5dSHong Zhang ierr = TSAdjointStepBEuler_Private(ts);CHKERRQ(ierr); 431c9681e5dSHong Zhang PetscFunctionReturn(0); 432c9681e5dSHong Zhang } 4332ca6e920SHong Zhang th->status = TS_STEP_INCOMPLETE; 434302440fdSBarry Smith ierr = SNESGetKSP(ts->snes,&ksp);CHKERRQ(ierr); 435cd4cee2dSHong Zhang ierr = TSGetIJacobian(ts,&J,&Jpre,NULL,NULL);CHKERRQ(ierr); 4367207e0fdSHong Zhang if (quadts) { 437cd4cee2dSHong Zhang ierr = TSGetRHSJacobian(quadts,&quadJ,NULL,NULL,NULL);CHKERRQ(ierr); 438cd4cee2dSHong Zhang ierr = TSGetRHSJacobianP(quadts,&quadJp,NULL,NULL);CHKERRQ(ierr); 4397207e0fdSHong Zhang } 440b5e0532dSHong Zhang /* If endpoint=1, th->ptime and th->X0 will be used; if endpoint=0, th->stage_time and th->X will be used. */ 441022c081aSHong Zhang th->stage_time = th->endpoint ? ts->ptime : (ts->ptime+(1.-th->Theta)*ts->time_step); /* time_step is negative*/ 442b5e0532dSHong Zhang th->ptime = ts->ptime + ts->time_step; 443022c081aSHong Zhang th->time_step = -ts->time_step; 4442ca6e920SHong Zhang 445b5b4017aSHong Zhang /* Build RHS for first-order adjoint */ 44633f72c5dSHong Zhang /* Cost function has an integral term */ 4477207e0fdSHong Zhang if (quadts) { 44805755b9cSHong Zhang if (th->endpoint) { 449cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->stage_time,ts->vec_sol,quadJ,NULL);CHKERRQ(ierr); 45005755b9cSHong Zhang } else { 451cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->stage_time,th->X,quadJ,NULL);CHKERRQ(ierr); 45205755b9cSHong Zhang } 4537207e0fdSHong Zhang } 45433f72c5dSHong Zhang 455abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 456b5e0532dSHong Zhang ierr = VecCopy(ts->vecs_sensi[nadj],VecsSensiTemp[nadj]);CHKERRQ(ierr); 457022c081aSHong Zhang ierr = VecScale(VecsSensiTemp[nadj],1./(th->Theta*th->time_step));CHKERRQ(ierr); 458cd4cee2dSHong Zhang if (quadJ) { 459cd4cee2dSHong Zhang ierr = MatDenseGetColumn(quadJ,nadj,&xarr);CHKERRQ(ierr); 460cd4cee2dSHong Zhang ierr = VecPlaceArray(ts->vec_drdu_col,xarr);CHKERRQ(ierr); 461cd4cee2dSHong Zhang ierr = VecAXPY(VecsSensiTemp[nadj],1.,ts->vec_drdu_col);CHKERRQ(ierr); 462cd4cee2dSHong Zhang ierr = VecResetArray(ts->vec_drdu_col);CHKERRQ(ierr); 463cd4cee2dSHong Zhang ierr = MatDenseRestoreColumn(quadJ,&xarr);CHKERRQ(ierr); 46436eaed60SHong Zhang } 4652ca6e920SHong Zhang } 4663c54f92cSHong Zhang 467b5b4017aSHong Zhang /* Build LHS for first-order adjoint */ 4683e05ceb1SHong Zhang th->shift = 1./(th->Theta*th->time_step); 4693c54f92cSHong Zhang if (th->endpoint) { 47004f7482eSHong Zhang ierr = TSComputeSNESJacobian(ts,ts->vec_sol,J,Jpre);CHKERRQ(ierr); 4713c54f92cSHong Zhang } else { 47204f7482eSHong Zhang ierr = TSComputeSNESJacobian(ts,th->X,J,Jpre);CHKERRQ(ierr); 4733c54f92cSHong Zhang } 474cd4cee2dSHong Zhang ierr = KSPSetOperators(ksp,J,Jpre);CHKERRQ(ierr); 4752ca6e920SHong Zhang 476b5b4017aSHong Zhang /* Solve stage equation LHS*lambda_s = RHS for first-order adjoint */ 477abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 4781d14d03bSHong Zhang KSPConvergedReason kspreason; 479b5e0532dSHong Zhang ierr = KSPSolveTranspose(ksp,VecsSensiTemp[nadj],VecsDeltaLam[nadj]);CHKERRQ(ierr); 4801d14d03bSHong Zhang ierr = KSPGetConvergedReason(ksp,&kspreason);CHKERRQ(ierr); 4811d14d03bSHong Zhang if (kspreason < 0) { 4821d14d03bSHong Zhang ts->reason = TSADJOINT_DIVERGED_LINEAR_SOLVE; 48329b3c8a1SHong Zhang ierr = PetscInfo2(ts,"Step=%D, %Dth cost function, transposed linear solve fails, stopping 1st-order adjoint solve\n",ts->steps,nadj);CHKERRQ(ierr); 4841d14d03bSHong Zhang } 4852ca6e920SHong Zhang } 4863c54f92cSHong Zhang 4871d14d03bSHong Zhang /* Second-order adjoint */ 488b5b4017aSHong Zhang if (ts->vecs_sensi2) { /* U_{n+1} */ 489b5b4017aSHong Zhang if (!th->endpoint) SETERRQ(PetscObjectComm((PetscObject)ts),PETSC_ERR_SUP,"Operation not implemented in TS_Theta"); 490b5b4017aSHong Zhang /* Get w1 at t_{n+1} from TLM matrix */ 491b5b4017aSHong Zhang ierr = MatDenseGetColumn(ts->mat_sensip,0,&xarr);CHKERRQ(ierr); 492b5b4017aSHong Zhang ierr = VecPlaceArray(ts->vec_sensip_col,xarr);CHKERRQ(ierr); 493b5b4017aSHong Zhang /* lambda_s^T F_UU w_1 */ 494b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionUU(ts,th->stage_time,ts->vec_sol,VecsDeltaLam,ts->vec_sensip_col,ts->vecs_fuu);CHKERRQ(ierr); 495b5b4017aSHong Zhang ierr = VecResetArray(ts->vec_sensip_col);CHKERRQ(ierr); 496b5b4017aSHong Zhang ierr = MatDenseRestoreColumn(ts->mat_sensip,&xarr);CHKERRQ(ierr); 497b5b4017aSHong Zhang /* lambda_s^T F_UP w_2 */ 498b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionUP(ts,th->stage_time,ts->vec_sol,VecsDeltaLam,ts->vec_dir,ts->vecs_fup);CHKERRQ(ierr); 499b5b4017aSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { /* compute the residual */ 500b5b4017aSHong Zhang ierr = VecCopy(ts->vecs_sensi2[nadj],VecsSensi2Temp[nadj]);CHKERRQ(ierr); 5013e05ceb1SHong Zhang ierr = VecScale(VecsSensi2Temp[nadj],th->shift);CHKERRQ(ierr); 50233f72c5dSHong Zhang ierr = VecAXPY(VecsSensi2Temp[nadj],-1.,ts->vecs_fuu[nadj]);CHKERRQ(ierr); 503b5b4017aSHong Zhang if (ts->vecs_fup) { 50433f72c5dSHong Zhang ierr = VecAXPY(VecsSensi2Temp[nadj],-1.,ts->vecs_fup[nadj]);CHKERRQ(ierr); 505b5b4017aSHong Zhang } 506b5b4017aSHong Zhang } 507b5b4017aSHong Zhang /* Solve stage equation LHS X = RHS for second-order adjoint */ 508b5b4017aSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 5091d14d03bSHong Zhang KSPConvergedReason kspreason; 5101d14d03bSHong Zhang ierr = KSPSolveTranspose(ksp,VecsSensi2Temp[nadj],VecsDeltaLam2[nadj]);CHKERRQ(ierr); 5111d14d03bSHong Zhang ierr = KSPGetConvergedReason(ksp,&kspreason);CHKERRQ(ierr); 5121d14d03bSHong Zhang if (kspreason < 0) { 5131d14d03bSHong Zhang ts->reason = TSADJOINT_DIVERGED_LINEAR_SOLVE; 51429b3c8a1SHong Zhang ierr = PetscInfo2(ts,"Step=%D, %Dth cost function, transposed linear solve fails, stopping 2nd-order adjoint solve\n",ts->steps,nadj);CHKERRQ(ierr); 5151d14d03bSHong Zhang } 516b5b4017aSHong Zhang } 517b5b4017aSHong Zhang } 518b5b4017aSHong Zhang 51936eaed60SHong Zhang /* Update sensitivities, and evaluate integrals if there is any */ 5201d14d03bSHong Zhang if(th->endpoint) { /* two-stage Theta methods with th->Theta!=1, th->Theta==1 leads to BEuler */ 5213e05ceb1SHong Zhang th->shift = 1./((th->Theta-1.)*th->time_step); 522c586f2e8SHong Zhang th->stage_time = th->ptime; 52304f7482eSHong Zhang ierr = TSComputeSNESJacobian(ts,th->X0,J,Jpre);CHKERRQ(ierr); 52404f7482eSHong Zhang ierr = KSPSetOperators(ksp,J,Jpre);CHKERRQ(ierr); 52533f72c5dSHong Zhang /* R_U at t_n */ 5267207e0fdSHong Zhang if (quadts) { 527cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->ptime,th->X0,quadJ,NULL);CHKERRQ(ierr); 5287207e0fdSHong Zhang } 529abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 530b5e0532dSHong Zhang ierr = MatMultTranspose(J,VecsDeltaLam[nadj],ts->vecs_sensi[nadj]);CHKERRQ(ierr); 531cd4cee2dSHong Zhang if (quadJ) { 532cd4cee2dSHong Zhang ierr = MatDenseGetColumn(quadJ,nadj,&xarr);CHKERRQ(ierr); 533cd4cee2dSHong Zhang ierr = VecPlaceArray(ts->vec_drdu_col,xarr);CHKERRQ(ierr); 534cd4cee2dSHong Zhang ierr = VecAXPY(ts->vecs_sensi[nadj],-1.,ts->vec_drdu_col);CHKERRQ(ierr); 535cd4cee2dSHong Zhang ierr = VecResetArray(ts->vec_drdu_col);CHKERRQ(ierr); 536cd4cee2dSHong Zhang ierr = MatDenseRestoreColumn(quadJ,&xarr);CHKERRQ(ierr); 537b5b4017aSHong Zhang } 5383e05ceb1SHong Zhang ierr = VecScale(ts->vecs_sensi[nadj],1./th->shift);CHKERRQ(ierr); 539b5b4017aSHong Zhang } 5401d14d03bSHong Zhang 5411d14d03bSHong Zhang /* Second-order adjoint */ 5421d14d03bSHong Zhang if (ts->vecs_sensi2) { /* U_n */ 543b5b4017aSHong Zhang /* Get w1 at t_n from TLM matrix */ 544b5b4017aSHong Zhang ierr = MatDenseGetColumn(th->MatFwdSensip0,0,&xarr);CHKERRQ(ierr); 545b5b4017aSHong Zhang ierr = VecPlaceArray(ts->vec_sensip_col,xarr);CHKERRQ(ierr); 546b5b4017aSHong Zhang /* lambda_s^T F_UU w_1 */ 547b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionUU(ts,th->ptime,th->X0,VecsDeltaLam,ts->vec_sensip_col,ts->vecs_fuu);CHKERRQ(ierr); 548b5b4017aSHong Zhang ierr = VecResetArray(ts->vec_sensip_col);CHKERRQ(ierr); 54933f72c5dSHong Zhang ierr = MatDenseRestoreColumn(th->MatFwdSensip0,&xarr);CHKERRQ(ierr); 550b5b4017aSHong Zhang /* lambda_s^T F_UU w_2 */ 551b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionUP(ts,th->ptime,th->X0,VecsDeltaLam,ts->vec_dir,ts->vecs_fup);CHKERRQ(ierr); 552b5b4017aSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 55333f72c5dSHong Zhang /* M^T Lambda_s + h(1-theta) F_U^T Lambda_s + h(1-theta) lambda_s^T F_UU w_1 + lambda_s^T F_UP w_2 */ 554b5b4017aSHong Zhang ierr = MatMultTranspose(J,VecsDeltaLam2[nadj],ts->vecs_sensi2[nadj]);CHKERRQ(ierr); 55533f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2[nadj],1.,ts->vecs_fuu[nadj]);CHKERRQ(ierr); 556b5b4017aSHong Zhang if (ts->vecs_fup) { 55733f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2[nadj],1.,ts->vecs_fup[nadj]);CHKERRQ(ierr); 558b5b4017aSHong Zhang } 5593e05ceb1SHong Zhang ierr = VecScale(ts->vecs_sensi2[nadj],1./th->shift);CHKERRQ(ierr); 560b5b4017aSHong Zhang } 561b5e0532dSHong Zhang } 5623fd52205SHong Zhang 563c586f2e8SHong Zhang th->stage_time = ts->ptime; /* recover the old value */ 564c586f2e8SHong Zhang 5653fd52205SHong Zhang if (ts->vecs_sensip) { /* sensitivities wrt parameters */ 566b5b4017aSHong Zhang /* U_{n+1} */ 5673e05ceb1SHong Zhang th->shift = -1./(th->Theta*th->time_step); 5683e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->stage_time,ts->vec_sol,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); 5697207e0fdSHong Zhang if (quadts) { 570cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->stage_time,ts->vec_sol,quadJp);CHKERRQ(ierr); 5717207e0fdSHong Zhang } 572abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 573b5e0532dSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam[nadj],VecsDeltaMu[nadj]);CHKERRQ(ierr); 57433f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensip[nadj],-th->time_step*th->Theta,VecsDeltaMu[nadj]);CHKERRQ(ierr); 5753fd52205SHong Zhang } 57633f72c5dSHong Zhang if (ts->vecs_sensi2p) { /* second-order */ 57733f72c5dSHong Zhang /* Get w1 at t_{n+1} from TLM matrix */ 57833f72c5dSHong Zhang ierr = MatDenseGetColumn(ts->mat_sensip,0,&xarr);CHKERRQ(ierr); 57933f72c5dSHong Zhang ierr = VecPlaceArray(ts->vec_sensip_col,xarr);CHKERRQ(ierr); 580b5b4017aSHong Zhang /* lambda_s^T F_PU w_1 */ 581b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionPU(ts,th->stage_time,ts->vec_sol,VecsDeltaLam,ts->vec_sensip_col,ts->vecs_fpu);CHKERRQ(ierr); 58233f72c5dSHong Zhang ierr = VecResetArray(ts->vec_sensip_col);CHKERRQ(ierr); 58333f72c5dSHong Zhang ierr = MatDenseRestoreColumn(ts->mat_sensip,&xarr);CHKERRQ(ierr); 58433f72c5dSHong Zhang 585b5b4017aSHong Zhang /* lambda_s^T F_PP w_2 */ 586b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionPP(ts,th->stage_time,ts->vec_sol,VecsDeltaLam,ts->vec_dir,ts->vecs_fpp);CHKERRQ(ierr); 587b5b4017aSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 58833f72c5dSHong Zhang /* Mu2 <- Mu2 + h theta F_P^T Lambda_s + h theta (lambda_s^T F_UU w_1 + lambda_s^T F_UP w_2) */ 589b5b4017aSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam2[nadj],VecsDeltaMu2[nadj]);CHKERRQ(ierr); 59033f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step*th->Theta,VecsDeltaMu2[nadj]);CHKERRQ(ierr); 591b5b4017aSHong Zhang if (ts->vecs_fpu) { 59233f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step*th->Theta,ts->vecs_fpu[nadj]);CHKERRQ(ierr); 593b5b4017aSHong Zhang } 594b5b4017aSHong Zhang if (ts->vecs_fpp) { 59533f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step*th->Theta,ts->vecs_fpp[nadj]);CHKERRQ(ierr); 596b5b4017aSHong Zhang } 597b5b4017aSHong Zhang } 598b5b4017aSHong Zhang } 599b5b4017aSHong Zhang 600b5b4017aSHong Zhang /* U_s */ 6013e05ceb1SHong Zhang th->shift = 1./((th->Theta-1.0)*th->time_step); 6023e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->ptime,th->X0,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); 6037207e0fdSHong Zhang if (quadts) { 604cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->ptime,th->X0,quadJp);CHKERRQ(ierr); 6057207e0fdSHong Zhang } 606abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 607b5e0532dSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam[nadj],VecsDeltaMu[nadj]);CHKERRQ(ierr); 60833f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensip[nadj],-th->time_step*(1.0-th->Theta),VecsDeltaMu[nadj]);CHKERRQ(ierr); 60933f72c5dSHong Zhang if (ts->vecs_sensi2p) { /* second-order */ 61033f72c5dSHong Zhang /* Get w1 at t_n from TLM matrix */ 61133f72c5dSHong Zhang ierr = MatDenseGetColumn(th->MatFwdSensip0,0,&xarr);CHKERRQ(ierr); 61233f72c5dSHong Zhang ierr = VecPlaceArray(ts->vec_sensip_col,xarr);CHKERRQ(ierr); 613b5b4017aSHong Zhang /* lambda_s^T F_PU w_1 */ 614b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionPU(ts,th->ptime,th->X0,VecsDeltaLam,ts->vec_sensip_col,ts->vecs_fpu);CHKERRQ(ierr); 61533f72c5dSHong Zhang ierr = VecResetArray(ts->vec_sensip_col);CHKERRQ(ierr); 61633f72c5dSHong Zhang ierr = MatDenseRestoreColumn(th->MatFwdSensip0,&xarr);CHKERRQ(ierr); 617b5b4017aSHong Zhang /* lambda_s^T F_PP w_2 */ 618b1e111ebSHong Zhang ierr = TSComputeIHessianProductFunctionPP(ts,th->ptime,th->X0,VecsDeltaLam,ts->vec_dir,ts->vecs_fpp);CHKERRQ(ierr); 619b5b4017aSHong Zhang for (nadj=0; nadj<ts->numcost; nadj++) { 62033f72c5dSHong Zhang /* Mu2 <- Mu2 + h(1-theta) F_P^T Lambda_s + h(1-theta) (lambda_s^T F_UU w_1 + lambda_s^T F_UP w_2) */ 621b5b4017aSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam2[nadj],VecsDeltaMu2[nadj]);CHKERRQ(ierr); 62233f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step*(1.0-th->Theta),VecsDeltaMu2[nadj]);CHKERRQ(ierr); 623b5b4017aSHong Zhang if (ts->vecs_fpu) { 62433f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step*(1.0-th->Theta),ts->vecs_fpu[nadj]);CHKERRQ(ierr); 625b5e0532dSHong Zhang } 626b5b4017aSHong Zhang if (ts->vecs_fpp) { 62733f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensi2p[nadj],-th->time_step*(1.0-th->Theta),ts->vecs_fpp[nadj]);CHKERRQ(ierr); 628b5b4017aSHong Zhang } 62936eaed60SHong Zhang } 63036eaed60SHong Zhang } 6313fd52205SHong Zhang } 632b5e0532dSHong Zhang } 6333fd52205SHong Zhang } else { /* one-stage case */ 6343e05ceb1SHong Zhang th->shift = 0.0; 63504f7482eSHong Zhang ierr = TSComputeSNESJacobian(ts,th->X,J,Jpre);CHKERRQ(ierr); /* get -f_y */ 63604f7482eSHong Zhang ierr = KSPSetOperators(ksp,J,Jpre);CHKERRQ(ierr); 6377207e0fdSHong Zhang if (quadts) { 638cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->stage_time,th->X,quadJ,NULL);CHKERRQ(ierr); 6397207e0fdSHong Zhang } 640abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 641b5e0532dSHong Zhang ierr = MatMultTranspose(J,VecsDeltaLam[nadj],VecsSensiTemp[nadj]);CHKERRQ(ierr); 642022c081aSHong Zhang ierr = VecAXPY(ts->vecs_sensi[nadj],-th->time_step,VecsSensiTemp[nadj]);CHKERRQ(ierr); 643cd4cee2dSHong Zhang if (quadJ) { 644cd4cee2dSHong Zhang ierr = MatDenseGetColumn(quadJ,nadj,&xarr);CHKERRQ(ierr); 645cd4cee2dSHong Zhang ierr = VecPlaceArray(ts->vec_drdu_col,xarr);CHKERRQ(ierr); 646cd4cee2dSHong Zhang ierr = VecAXPY(ts->vecs_sensi[nadj],th->time_step,ts->vec_drdu_col);CHKERRQ(ierr); 647cd4cee2dSHong Zhang ierr = VecResetArray(ts->vec_drdu_col);CHKERRQ(ierr); 648cd4cee2dSHong Zhang ierr = MatDenseRestoreColumn(quadJ,&xarr);CHKERRQ(ierr); 64936eaed60SHong Zhang } 6502ca6e920SHong Zhang } 6513fd52205SHong Zhang if (ts->vecs_sensip) { 6523e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->stage_time,th->X,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); 6537207e0fdSHong Zhang if (quadts) { 654cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->stage_time,th->X,quadJp);CHKERRQ(ierr); 6557207e0fdSHong Zhang } 656abc2977eSBarry Smith for (nadj=0; nadj<ts->numcost; nadj++) { 65733f72c5dSHong Zhang ierr = MatMultTranspose(ts->Jacp,VecsDeltaLam[nadj],VecsDeltaMu[nadj]);CHKERRQ(ierr); 65833f72c5dSHong Zhang ierr = VecAXPY(ts->vecs_sensip[nadj],-th->time_step,VecsDeltaMu[nadj]);CHKERRQ(ierr); 659cd4cee2dSHong Zhang if (quadJp) { 660cd4cee2dSHong Zhang ierr = MatDenseGetColumn(quadJp,nadj,&xarr);CHKERRQ(ierr); 661cd4cee2dSHong Zhang ierr = VecPlaceArray(ts->vec_drdp_col,xarr);CHKERRQ(ierr); 662cd4cee2dSHong Zhang ierr = VecAXPY(ts->vecs_sensip[nadj],th->time_step,ts->vec_drdp_col);CHKERRQ(ierr); 663cd4cee2dSHong Zhang ierr = VecResetArray(ts->vec_drdp_col);CHKERRQ(ierr); 664cd4cee2dSHong Zhang ierr = MatDenseRestoreColumn(quadJp,&xarr);CHKERRQ(ierr); 66536eaed60SHong Zhang } 66636eaed60SHong Zhang } 6673fd52205SHong Zhang } 6682ca6e920SHong Zhang } 6692ca6e920SHong Zhang 6702ca6e920SHong Zhang th->status = TS_STEP_COMPLETE; 6712ca6e920SHong Zhang PetscFunctionReturn(0); 6722ca6e920SHong Zhang } 6732ca6e920SHong Zhang 674cd652676SJed Brown static PetscErrorCode TSInterpolate_Theta(TS ts,PetscReal t,Vec X) 675cd652676SJed Brown { 676cd652676SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 677be5899b3SLisandro Dalcin PetscReal dt = t - ts->ptime; 678cd652676SJed Brown PetscErrorCode ierr; 679cd652676SJed Brown 680cd652676SJed Brown PetscFunctionBegin; 681a43b19c4SJed Brown ierr = VecCopy(ts->vec_sol,th->X);CHKERRQ(ierr); 682be5899b3SLisandro Dalcin if (th->endpoint) dt *= th->Theta; 683be5899b3SLisandro Dalcin ierr = VecWAXPY(X,dt,th->Xdot,th->X);CHKERRQ(ierr); 684cd652676SJed Brown PetscFunctionReturn(0); 685cd652676SJed Brown } 686cd652676SJed Brown 6871566a47fSLisandro Dalcin static PetscErrorCode TSEvaluateWLTE_Theta(TS ts,NormType wnormtype,PetscInt *order,PetscReal *wlte) 6881566a47fSLisandro Dalcin { 6891566a47fSLisandro Dalcin TS_Theta *th = (TS_Theta*)ts->data; 6901566a47fSLisandro Dalcin Vec X = ts->vec_sol; /* X = solution */ 6911566a47fSLisandro Dalcin Vec Y = th->vec_lte_work; /* Y = X + LTE */ 6927453f775SEmil Constantinescu PetscReal wltea,wlter; 6931566a47fSLisandro Dalcin PetscErrorCode ierr; 6941566a47fSLisandro Dalcin 6951566a47fSLisandro Dalcin PetscFunctionBegin; 6962ffb9264SLisandro Dalcin if (!th->vec_sol_prev) {*wlte = -1; PetscFunctionReturn(0);} 6971566a47fSLisandro Dalcin /* Cannot compute LTE in first step or in restart after event */ 698fecfb714SLisandro Dalcin if (ts->steprestart) {*wlte = -1; PetscFunctionReturn(0);} 6991566a47fSLisandro Dalcin /* Compute LTE using backward differences with non-constant time step */ 700fecfb714SLisandro Dalcin { 701be5899b3SLisandro Dalcin PetscReal h = ts->time_step, h_prev = ts->ptime - ts->ptime_prev; 702be5899b3SLisandro Dalcin PetscReal a = 1 + h_prev/h; 7031566a47fSLisandro Dalcin PetscScalar scal[3]; Vec vecs[3]; 7041566a47fSLisandro Dalcin scal[0] = +1/a; scal[1] = -1/(a-1); scal[2] = +1/(a*(a-1)); 7051566a47fSLisandro Dalcin vecs[0] = X; vecs[1] = th->X0; vecs[2] = th->vec_sol_prev; 7061566a47fSLisandro Dalcin ierr = VecCopy(X,Y);CHKERRQ(ierr); 7071566a47fSLisandro Dalcin ierr = VecMAXPY(Y,3,scal,vecs);CHKERRQ(ierr); 7087453f775SEmil Constantinescu ierr = TSErrorWeightedNorm(ts,X,Y,wnormtype,wlte,&wltea,&wlter);CHKERRQ(ierr); 7091566a47fSLisandro Dalcin } 7101566a47fSLisandro Dalcin if (order) *order = 2; 7111566a47fSLisandro Dalcin PetscFunctionReturn(0); 7121566a47fSLisandro Dalcin } 7131566a47fSLisandro Dalcin 7141566a47fSLisandro Dalcin static PetscErrorCode TSRollBack_Theta(TS ts) 7151566a47fSLisandro Dalcin { 7161566a47fSLisandro Dalcin TS_Theta *th = (TS_Theta*)ts->data; 7177207e0fdSHong Zhang TS quadts = ts->quadraturets; 7181566a47fSLisandro Dalcin PetscErrorCode ierr; 7191566a47fSLisandro Dalcin 7201566a47fSLisandro Dalcin PetscFunctionBegin; 7211566a47fSLisandro Dalcin ierr = VecCopy(th->X0,ts->vec_sol);CHKERRQ(ierr); 722cd4cee2dSHong Zhang if (quadts && ts->costintegralfwd) { 723cd4cee2dSHong Zhang ierr = VecCopy(th->VecCostIntegral0,quadts->vec_sol);CHKERRQ(ierr); 7241566a47fSLisandro Dalcin } 725715f1b00SHong Zhang th->status = TS_STEP_INCOMPLETE; 72613b1b0ffSHong Zhang if (ts->mat_sensip) { 72713b1b0ffSHong Zhang ierr = MatCopy(th->MatFwdSensip0,ts->mat_sensip,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 7286f92202bSHong Zhang } 7297207e0fdSHong Zhang if (quadts && quadts->mat_sensip) { 7307207e0fdSHong Zhang ierr = MatCopy(th->MatIntegralSensip0,quadts->mat_sensip,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 7316f92202bSHong Zhang } 732715f1b00SHong Zhang PetscFunctionReturn(0); 733715f1b00SHong Zhang } 734715f1b00SHong Zhang 735715f1b00SHong Zhang static PetscErrorCode TSForwardStep_Theta(TS ts) 736715f1b00SHong Zhang { 737715f1b00SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 738cd4cee2dSHong Zhang TS quadts = ts->quadraturets; 73913b1b0ffSHong Zhang Mat MatDeltaFwdSensip = th->MatDeltaFwdSensip; 740b5b4017aSHong Zhang Vec VecDeltaFwdSensipCol = th->VecDeltaFwdSensipCol; 7417207e0fdSHong Zhang PetscInt ntlm; 742715f1b00SHong Zhang KSP ksp; 7437207e0fdSHong Zhang Mat J,Jpre,quadJ = NULL,quadJp = NULL; 74413b1b0ffSHong Zhang PetscScalar *barr,*xarr; 745715f1b00SHong Zhang PetscErrorCode ierr; 746715f1b00SHong Zhang 747715f1b00SHong Zhang PetscFunctionBegin; 74813b1b0ffSHong Zhang ierr = MatCopy(ts->mat_sensip,th->MatFwdSensip0,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 74913b1b0ffSHong Zhang 7507207e0fdSHong Zhang if (quadts && quadts->mat_sensip) { 7517207e0fdSHong Zhang ierr = MatCopy(quadts->mat_sensip,th->MatIntegralSensip0,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 7526f92202bSHong Zhang } 753715f1b00SHong Zhang ierr = SNESGetKSP(ts->snes,&ksp);CHKERRQ(ierr); 754cd4cee2dSHong Zhang ierr = TSGetIJacobian(ts,&J,&Jpre,NULL,NULL);CHKERRQ(ierr); 7557207e0fdSHong Zhang if (quadts) { 756cd4cee2dSHong Zhang ierr = TSGetRHSJacobian(quadts,&quadJ,NULL,NULL,NULL);CHKERRQ(ierr); 757cd4cee2dSHong Zhang ierr = TSGetRHSJacobianP(quadts,&quadJp,NULL,NULL);CHKERRQ(ierr); 7587207e0fdSHong Zhang } 759715f1b00SHong Zhang 760715f1b00SHong Zhang /* Build RHS */ 761715f1b00SHong Zhang if (th->endpoint) { /* 2-stage method*/ 7623e05ceb1SHong Zhang th->shift = 1./((th->Theta-1.)*th->time_step); 7633e05ceb1SHong Zhang ierr = TSComputeIJacobian(ts,th->ptime,th->X0,th->Xdot,th->shift,J,Jpre,PETSC_FALSE);CHKERRQ(ierr); 76413b1b0ffSHong Zhang ierr = MatMatMult(J,ts->mat_sensip,MAT_REUSE_MATRIX,PETSC_DEFAULT,&MatDeltaFwdSensip);CHKERRQ(ierr); 76513b1b0ffSHong Zhang ierr = MatScale(MatDeltaFwdSensip,(th->Theta-1.)/th->Theta);CHKERRQ(ierr); 766715f1b00SHong Zhang 767022c081aSHong Zhang /* Add the f_p forcing terms */ 7680e11c21fSHong Zhang if (ts->Jacp) { 7693e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->ptime,th->X0,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); 77033f72c5dSHong Zhang ierr = MatAXPY(MatDeltaFwdSensip,(th->Theta-1.)/th->Theta,ts->Jacp,SUBSET_NONZERO_PATTERN);CHKERRQ(ierr); 7713e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->stage_time,ts->vec_sol,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); 77233f72c5dSHong Zhang ierr = MatAXPY(MatDeltaFwdSensip,-1.,ts->Jacp,SUBSET_NONZERO_PATTERN);CHKERRQ(ierr); 7730e11c21fSHong Zhang } 774715f1b00SHong Zhang } else { /* 1-stage method */ 7753e05ceb1SHong Zhang th->shift = 0.0; 7763e05ceb1SHong Zhang ierr = TSComputeIJacobian(ts,th->stage_time,th->X,th->Xdot,th->shift,J,Jpre,PETSC_FALSE);CHKERRQ(ierr); 77713b1b0ffSHong Zhang ierr = MatMatMult(J,ts->mat_sensip,MAT_REUSE_MATRIX,PETSC_DEFAULT,&MatDeltaFwdSensip);CHKERRQ(ierr); 77813b1b0ffSHong Zhang ierr = MatScale(MatDeltaFwdSensip,-1.);CHKERRQ(ierr); 77913b1b0ffSHong Zhang 780022c081aSHong Zhang /* Add the f_p forcing terms */ 7810e11c21fSHong Zhang if (ts->Jacp) { 7823e05ceb1SHong Zhang ierr = TSComputeIJacobianP(ts,th->stage_time,th->X,th->Xdot,th->shift,ts->Jacp,PETSC_FALSE);CHKERRQ(ierr); 78333f72c5dSHong Zhang ierr = MatAXPY(MatDeltaFwdSensip,-1.,ts->Jacp,SUBSET_NONZERO_PATTERN);CHKERRQ(ierr); 784715f1b00SHong Zhang } 7850e11c21fSHong Zhang } 786715f1b00SHong Zhang 787715f1b00SHong Zhang /* Build LHS */ 7883e05ceb1SHong Zhang th->shift = 1/(th->Theta*th->time_step); 789715f1b00SHong Zhang if (th->endpoint) { 7903e05ceb1SHong Zhang ierr = TSComputeIJacobian(ts,th->stage_time,ts->vec_sol,th->Xdot,th->shift,J,Jpre,PETSC_FALSE);CHKERRQ(ierr); 791715f1b00SHong Zhang } else { 7923e05ceb1SHong Zhang ierr = TSComputeIJacobian(ts,th->stage_time,th->X,th->Xdot,th->shift,J,Jpre,PETSC_FALSE);CHKERRQ(ierr); 793715f1b00SHong Zhang } 794cd4cee2dSHong Zhang ierr = KSPSetOperators(ksp,J,Jpre);CHKERRQ(ierr); 795715f1b00SHong Zhang 796715f1b00SHong Zhang /* 797715f1b00SHong Zhang Evaluate the first stage of integral gradients with the 2-stage method: 798c9ad9de0SHong Zhang drdu|t_n*S(t_n) + drdp|t_n 799715f1b00SHong Zhang This is done before the linear solve because the sensitivity variable S(t_n) will be propagated to S(t_{n+1}) 800715f1b00SHong Zhang */ 801715f1b00SHong Zhang if (th->endpoint) { /* 2-stage method only */ 8027207e0fdSHong Zhang if (quadts && quadts->mat_sensip) { 803cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->ptime,th->X0,quadJ,NULL);CHKERRQ(ierr); 804cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->ptime,th->X0,quadJp);CHKERRQ(ierr); 8057207e0fdSHong Zhang ierr = MatTransposeMatMult(ts->mat_sensip,quadJ,MAT_REUSE_MATRIX,PETSC_DEFAULT,&th->MatIntegralSensipTemp);CHKERRQ(ierr); 8067207e0fdSHong Zhang ierr = MatAXPY(th->MatIntegralSensipTemp,1,quadJp,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 8077207e0fdSHong Zhang ierr = MatAXPY(quadts->mat_sensip,th->time_step*(1.-th->Theta),th->MatIntegralSensipTemp,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 808715f1b00SHong Zhang } 809715f1b00SHong Zhang } 810715f1b00SHong Zhang 811715f1b00SHong Zhang /* Solve the tangent linear equation for forward sensitivities to parameters */ 812022c081aSHong Zhang for (ntlm=0; ntlm<th->num_tlm; ntlm++) { 813b5b4017aSHong Zhang KSPConvergedReason kspreason; 81413b1b0ffSHong Zhang ierr = MatDenseGetColumn(MatDeltaFwdSensip,ntlm,&barr);CHKERRQ(ierr); 815b5b4017aSHong Zhang ierr = VecPlaceArray(VecDeltaFwdSensipCol,barr);CHKERRQ(ierr); 816715f1b00SHong Zhang if (th->endpoint) { 81713b1b0ffSHong Zhang ierr = MatDenseGetColumn(ts->mat_sensip,ntlm,&xarr);CHKERRQ(ierr); 818b5b4017aSHong Zhang ierr = VecPlaceArray(ts->vec_sensip_col,xarr);CHKERRQ(ierr); 819b5b4017aSHong Zhang ierr = KSPSolve(ksp,VecDeltaFwdSensipCol,ts->vec_sensip_col);CHKERRQ(ierr); 820b5b4017aSHong Zhang ierr = VecResetArray(ts->vec_sensip_col);CHKERRQ(ierr); 82113b1b0ffSHong Zhang ierr = MatDenseRestoreColumn(ts->mat_sensip,&xarr);CHKERRQ(ierr); 822715f1b00SHong Zhang } else { 823b5b4017aSHong Zhang ierr = KSPSolve(ksp,VecDeltaFwdSensipCol,VecDeltaFwdSensipCol);CHKERRQ(ierr); 824715f1b00SHong Zhang } 825b5b4017aSHong Zhang ierr = KSPGetConvergedReason(ksp,&kspreason);CHKERRQ(ierr); 826b5b4017aSHong Zhang if (kspreason < 0) { 827b5b4017aSHong Zhang ts->reason = TSFORWARD_DIVERGED_LINEAR_SOLVE; 828b5b4017aSHong Zhang ierr = PetscInfo2(ts,"Step=%D, %Dth tangent linear solve, linear solve fails, stopping tangent linear solve\n",ts->steps,ntlm);CHKERRQ(ierr); 829b5b4017aSHong Zhang } 830b5b4017aSHong Zhang ierr = VecResetArray(VecDeltaFwdSensipCol);CHKERRQ(ierr); 83113b1b0ffSHong Zhang ierr = MatDenseRestoreColumn(MatDeltaFwdSensip,&barr);CHKERRQ(ierr); 832715f1b00SHong Zhang } 833715f1b00SHong Zhang 834b5b4017aSHong Zhang 83513b1b0ffSHong Zhang /* 83613b1b0ffSHong Zhang Evaluate the second stage of integral gradients with the 2-stage method: 837c9ad9de0SHong Zhang drdu|t_{n+1}*S(t_{n+1}) + drdp|t_{n+1} 83813b1b0ffSHong Zhang */ 8397207e0fdSHong Zhang if (quadts && quadts->mat_sensip) { 84013b1b0ffSHong Zhang if (!th->endpoint) { 8417207e0fdSHong Zhang ierr = MatAXPY(ts->mat_sensip,1,MatDeltaFwdSensip,SAME_NONZERO_PATTERN);CHKERRQ(ierr); /* stage sensitivity */ 842cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->stage_time,th->X,quadJ,NULL);CHKERRQ(ierr); 843cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->stage_time,th->X,quadJp);CHKERRQ(ierr); 8447207e0fdSHong Zhang ierr = MatTransposeMatMult(ts->mat_sensip,quadJ,MAT_REUSE_MATRIX,PETSC_DEFAULT,&th->MatIntegralSensipTemp);CHKERRQ(ierr); 8457207e0fdSHong Zhang ierr = MatAXPY(th->MatIntegralSensipTemp,1,quadJp,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 8467207e0fdSHong Zhang ierr = MatAXPY(quadts->mat_sensip,th->time_step,th->MatIntegralSensipTemp,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 84713b1b0ffSHong Zhang ierr = MatAXPY(ts->mat_sensip,(1.-th->Theta)/th->Theta,MatDeltaFwdSensip,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 84813b1b0ffSHong Zhang } else { 849cd4cee2dSHong Zhang ierr = TSComputeRHSJacobian(quadts,th->stage_time,ts->vec_sol,quadJ,NULL);CHKERRQ(ierr); 850cd4cee2dSHong Zhang ierr = TSComputeRHSJacobianP(quadts,th->stage_time,ts->vec_sol,quadJp);CHKERRQ(ierr); 8517207e0fdSHong Zhang ierr = MatTransposeMatMult(ts->mat_sensip,quadJ,MAT_REUSE_MATRIX,PETSC_DEFAULT,&th->MatIntegralSensipTemp);CHKERRQ(ierr); 8527207e0fdSHong Zhang ierr = MatAXPY(th->MatIntegralSensipTemp,1,quadJp,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 8537207e0fdSHong Zhang ierr = MatAXPY(quadts->mat_sensip,th->time_step*th->Theta,th->MatIntegralSensipTemp,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 85413b1b0ffSHong Zhang } 85513b1b0ffSHong Zhang } else { 85613b1b0ffSHong Zhang if (!th->endpoint) { 85713b1b0ffSHong Zhang ierr = MatAXPY(ts->mat_sensip,1./th->Theta,MatDeltaFwdSensip,SAME_NONZERO_PATTERN);CHKERRQ(ierr); 858715f1b00SHong Zhang } 859715f1b00SHong Zhang } 8601566a47fSLisandro Dalcin PetscFunctionReturn(0); 8611566a47fSLisandro Dalcin } 8621566a47fSLisandro Dalcin 8636affb6f8SHong Zhang static PetscErrorCode TSForwardGetStages_Theta(TS ts,PetscInt *ns,Mat **stagesensip) 8646affb6f8SHong Zhang { 8656affb6f8SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 8666affb6f8SHong Zhang 8676affb6f8SHong Zhang PetscFunctionBegin; 8686affb6f8SHong Zhang if (ns) *ns = 1; 8696affb6f8SHong Zhang if (stagesensip) *stagesensip = th->endpoint ? &(th->MatFwdSensip0) : &(th->MatDeltaFwdSensip); 8706affb6f8SHong Zhang PetscFunctionReturn(0); 8716affb6f8SHong Zhang } 8726affb6f8SHong Zhang 873316643e7SJed Brown /*------------------------------------------------------------*/ 874277b19d0SLisandro Dalcin static PetscErrorCode TSReset_Theta(TS ts) 875316643e7SJed Brown { 876316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 877316643e7SJed Brown PetscErrorCode ierr; 878316643e7SJed Brown 879316643e7SJed Brown PetscFunctionBegin; 8806bf464f9SBarry Smith ierr = VecDestroy(&th->X);CHKERRQ(ierr); 8816bf464f9SBarry Smith ierr = VecDestroy(&th->Xdot);CHKERRQ(ierr); 8823b1890cdSShri Abhyankar ierr = VecDestroy(&th->X0);CHKERRQ(ierr); 883eb284becSJed Brown ierr = VecDestroy(&th->affine);CHKERRQ(ierr); 8841566a47fSLisandro Dalcin 8851566a47fSLisandro Dalcin ierr = VecDestroy(&th->vec_sol_prev);CHKERRQ(ierr); 8861566a47fSLisandro Dalcin ierr = VecDestroy(&th->vec_lte_work);CHKERRQ(ierr); 8871566a47fSLisandro Dalcin 888b1cb36f3SHong Zhang ierr = VecDestroy(&th->VecCostIntegral0);CHKERRQ(ierr); 889277b19d0SLisandro Dalcin PetscFunctionReturn(0); 890277b19d0SLisandro Dalcin } 891277b19d0SLisandro Dalcin 892ece46509SHong Zhang static PetscErrorCode TSAdjointReset_Theta(TS ts) 893ece46509SHong Zhang { 894ece46509SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 895ece46509SHong Zhang PetscErrorCode ierr; 896ece46509SHong Zhang 897ece46509SHong Zhang PetscFunctionBegin; 898ece46509SHong Zhang ierr = VecDestroyVecs(ts->numcost,&th->VecsDeltaLam);CHKERRQ(ierr); 899ece46509SHong Zhang ierr = VecDestroyVecs(ts->numcost,&th->VecsDeltaMu);CHKERRQ(ierr); 900ece46509SHong Zhang ierr = VecDestroyVecs(ts->numcost,&th->VecsDeltaLam2);CHKERRQ(ierr); 901ece46509SHong Zhang ierr = VecDestroyVecs(ts->numcost,&th->VecsDeltaMu2);CHKERRQ(ierr); 902ece46509SHong Zhang ierr = VecDestroyVecs(ts->numcost,&th->VecsSensiTemp);CHKERRQ(ierr); 903ece46509SHong Zhang ierr = VecDestroyVecs(ts->numcost,&th->VecsSensi2Temp);CHKERRQ(ierr); 904ece46509SHong Zhang PetscFunctionReturn(0); 905ece46509SHong Zhang } 906ece46509SHong Zhang 907277b19d0SLisandro Dalcin static PetscErrorCode TSDestroy_Theta(TS ts) 908277b19d0SLisandro Dalcin { 909277b19d0SLisandro Dalcin PetscErrorCode ierr; 910277b19d0SLisandro Dalcin 911277b19d0SLisandro Dalcin PetscFunctionBegin; 912277b19d0SLisandro Dalcin ierr = TSReset_Theta(ts);CHKERRQ(ierr); 913b3a6b972SJed Brown if (ts->dm) { 914b3a6b972SJed Brown ierr = DMCoarsenHookRemove(ts->dm,DMCoarsenHook_TSTheta,DMRestrictHook_TSTheta,ts);CHKERRQ(ierr); 915b3a6b972SJed Brown ierr = DMSubDomainHookRemove(ts->dm,DMSubDomainHook_TSTheta,DMSubDomainRestrictHook_TSTheta,ts);CHKERRQ(ierr); 916b3a6b972SJed Brown } 917277b19d0SLisandro Dalcin ierr = PetscFree(ts->data);CHKERRQ(ierr); 918bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetTheta_C",NULL);CHKERRQ(ierr); 919bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetTheta_C",NULL);CHKERRQ(ierr); 920bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetEndpoint_C",NULL);CHKERRQ(ierr); 921bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetEndpoint_C",NULL);CHKERRQ(ierr); 922316643e7SJed Brown PetscFunctionReturn(0); 923316643e7SJed Brown } 924316643e7SJed Brown 925316643e7SJed Brown /* 926316643e7SJed Brown This defines the nonlinear equation that is to be solved with SNES 9272b5a38e1SLisandro Dalcin G(U) = F[t0+Theta*dt, U, (U-U0)*shift] = 0 928316643e7SJed Brown */ 9290f5c6efeSJed Brown static PetscErrorCode SNESTSFormFunction_Theta(SNES snes,Vec x,Vec y,TS ts) 930316643e7SJed Brown { 931316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 932316643e7SJed Brown PetscErrorCode ierr; 9337445fe48SJed Brown Vec X0,Xdot; 9347445fe48SJed Brown DM dm,dmsave; 9353e05ceb1SHong Zhang PetscReal shift = th->shift; 936316643e7SJed Brown 937316643e7SJed Brown PetscFunctionBegin; 9387445fe48SJed Brown ierr = SNESGetDM(snes,&dm);CHKERRQ(ierr); 9395a3a76d0SJed Brown /* When using the endpoint variant, this is actually 1/Theta * Xdot */ 9407445fe48SJed Brown ierr = TSThetaGetX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 941494ce9fcSHong Zhang if (x != X0) { 942b296d7d5SJed Brown ierr = VecAXPBYPCZ(Xdot,-shift,shift,0,X0,x);CHKERRQ(ierr); 943494ce9fcSHong Zhang } else { 944494ce9fcSHong Zhang ierr = VecZeroEntries(Xdot);CHKERRQ(ierr); 945494ce9fcSHong Zhang } 9467445fe48SJed Brown /* DM monkey-business allows user code to call TSGetDM() inside of functions evaluated on levels of FAS */ 9477445fe48SJed Brown dmsave = ts->dm; 9487445fe48SJed Brown ts->dm = dm; 9497445fe48SJed Brown ierr = TSComputeIFunction(ts,th->stage_time,x,Xdot,y,PETSC_FALSE);CHKERRQ(ierr); 9507445fe48SJed Brown ts->dm = dmsave; 9510d0b770aSPeter Brune ierr = TSThetaRestoreX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 952316643e7SJed Brown PetscFunctionReturn(0); 953316643e7SJed Brown } 954316643e7SJed Brown 955d1e9a80fSBarry Smith static PetscErrorCode SNESTSFormJacobian_Theta(SNES snes,Vec x,Mat A,Mat B,TS ts) 956316643e7SJed Brown { 957316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 958316643e7SJed Brown PetscErrorCode ierr; 9597445fe48SJed Brown Vec Xdot; 9607445fe48SJed Brown DM dm,dmsave; 9613e05ceb1SHong Zhang PetscReal shift = th->shift; 962316643e7SJed Brown 963316643e7SJed Brown PetscFunctionBegin; 9647445fe48SJed Brown ierr = SNESGetDM(snes,&dm);CHKERRQ(ierr); 965be5899b3SLisandro Dalcin /* Xdot has already been computed in SNESTSFormFunction_Theta (SNES guarantees this) */ 9660298fd71SBarry Smith ierr = TSThetaGetX0AndXdot(ts,dm,NULL,&Xdot);CHKERRQ(ierr); 9677445fe48SJed Brown 9687445fe48SJed Brown dmsave = ts->dm; 9697445fe48SJed Brown ts->dm = dm; 970d1e9a80fSBarry Smith ierr = TSComputeIJacobian(ts,th->stage_time,x,Xdot,shift,A,B,PETSC_FALSE);CHKERRQ(ierr); 9717445fe48SJed Brown ts->dm = dmsave; 9720298fd71SBarry Smith ierr = TSThetaRestoreX0AndXdot(ts,dm,NULL,&Xdot);CHKERRQ(ierr); 973316643e7SJed Brown PetscFunctionReturn(0); 974316643e7SJed Brown } 975316643e7SJed Brown 976715f1b00SHong Zhang static PetscErrorCode TSForwardSetUp_Theta(TS ts) 977715f1b00SHong Zhang { 978715f1b00SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 9797207e0fdSHong Zhang TS quadts = ts->quadraturets; 980715f1b00SHong Zhang PetscErrorCode ierr; 981715f1b00SHong Zhang 982715f1b00SHong Zhang PetscFunctionBegin; 983022c081aSHong Zhang /* combine sensitivities to parameters and sensitivities to initial values into one array */ 98413b1b0ffSHong Zhang th->num_tlm = ts->num_parameters; 98513b1b0ffSHong Zhang ierr = MatDuplicate(ts->mat_sensip,MAT_DO_NOT_COPY_VALUES,&th->MatDeltaFwdSensip);CHKERRQ(ierr); 9867207e0fdSHong Zhang if (quadts && quadts->mat_sensip) { 9877207e0fdSHong Zhang ierr = MatDuplicate(quadts->mat_sensip,MAT_DO_NOT_COPY_VALUES,&th->MatIntegralSensipTemp);CHKERRQ(ierr); 9887207e0fdSHong Zhang ierr = MatDuplicate(quadts->mat_sensip,MAT_DO_NOT_COPY_VALUES,&th->MatIntegralSensip0);CHKERRQ(ierr); 989715f1b00SHong Zhang } 9906f92202bSHong Zhang /* backup sensitivity results for roll-backs */ 99113b1b0ffSHong Zhang ierr = MatDuplicate(ts->mat_sensip,MAT_DO_NOT_COPY_VALUES,&th->MatFwdSensip0);CHKERRQ(ierr); 99213b1b0ffSHong Zhang 993b5b4017aSHong Zhang ierr = VecDuplicate(ts->vec_sol,&th->VecDeltaFwdSensipCol);CHKERRQ(ierr); 994715f1b00SHong Zhang PetscFunctionReturn(0); 995715f1b00SHong Zhang } 996715f1b00SHong Zhang 9977adebddeSHong Zhang static PetscErrorCode TSForwardReset_Theta(TS ts) 9987adebddeSHong Zhang { 9997adebddeSHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 10007207e0fdSHong Zhang TS quadts = ts->quadraturets; 10017adebddeSHong Zhang PetscErrorCode ierr; 10027adebddeSHong Zhang 10037adebddeSHong Zhang PetscFunctionBegin; 10047207e0fdSHong Zhang if (quadts && quadts->mat_sensip) { 10057207e0fdSHong Zhang ierr = MatDestroy(&th->MatIntegralSensipTemp);CHKERRQ(ierr); 10067207e0fdSHong Zhang ierr = MatDestroy(&th->MatIntegralSensip0);CHKERRQ(ierr); 10077adebddeSHong Zhang } 10087adebddeSHong Zhang ierr = VecDestroy(&th->VecDeltaFwdSensipCol);CHKERRQ(ierr); 10097adebddeSHong Zhang ierr = MatDestroy(&th->MatDeltaFwdSensip);CHKERRQ(ierr); 10107adebddeSHong Zhang ierr = MatDestroy(&th->MatFwdSensip0);CHKERRQ(ierr); 10117adebddeSHong Zhang PetscFunctionReturn(0); 10127adebddeSHong Zhang } 10137adebddeSHong Zhang 1014316643e7SJed Brown static PetscErrorCode TSSetUp_Theta(TS ts) 1015316643e7SJed Brown { 1016316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 1017cd4cee2dSHong Zhang TS quadts = ts->quadraturets; 10182ffb9264SLisandro Dalcin PetscBool match; 1019316643e7SJed Brown PetscErrorCode ierr; 1020316643e7SJed Brown 1021316643e7SJed Brown PetscFunctionBegin; 1022cd4cee2dSHong Zhang if (!th->VecCostIntegral0 && quadts && ts->costintegralfwd) { /* back up cost integral */ 1023cd4cee2dSHong Zhang ierr = VecDuplicate(quadts->vec_sol,&th->VecCostIntegral0);CHKERRQ(ierr); 1024b1cb36f3SHong Zhang } 102539d13666SHong Zhang if (!th->X) { 1026316643e7SJed Brown ierr = VecDuplicate(ts->vec_sol,&th->X);CHKERRQ(ierr); 102739d13666SHong Zhang } 102839d13666SHong Zhang if (!th->Xdot) { 1029316643e7SJed Brown ierr = VecDuplicate(ts->vec_sol,&th->Xdot);CHKERRQ(ierr); 103039d13666SHong Zhang } 103139d13666SHong Zhang if (!th->X0) { 10323b1890cdSShri Abhyankar ierr = VecDuplicate(ts->vec_sol,&th->X0);CHKERRQ(ierr); 103339d13666SHong Zhang } 10341566a47fSLisandro Dalcin if (th->endpoint) { 10351566a47fSLisandro Dalcin ierr = VecDuplicate(ts->vec_sol,&th->affine);CHKERRQ(ierr); 10367445fe48SJed Brown } 10373b1890cdSShri Abhyankar 10381566a47fSLisandro Dalcin th->order = (th->Theta == 0.5) ? 2 : 1; 1039*20d49056SMatthew G. Knepley th->shift = 1/(th->Theta*ts->time_step); 10401566a47fSLisandro Dalcin 10411566a47fSLisandro Dalcin ierr = TSGetDM(ts,&ts->dm);CHKERRQ(ierr); 10421566a47fSLisandro Dalcin ierr = DMCoarsenHookAdd(ts->dm,DMCoarsenHook_TSTheta,DMRestrictHook_TSTheta,ts);CHKERRQ(ierr); 10431566a47fSLisandro Dalcin ierr = DMSubDomainHookAdd(ts->dm,DMSubDomainHook_TSTheta,DMSubDomainRestrictHook_TSTheta,ts);CHKERRQ(ierr); 10441566a47fSLisandro Dalcin 10451566a47fSLisandro Dalcin ierr = TSGetAdapt(ts,&ts->adapt);CHKERRQ(ierr); 10461566a47fSLisandro Dalcin ierr = TSAdaptCandidatesClear(ts->adapt);CHKERRQ(ierr); 10472ffb9264SLisandro Dalcin ierr = PetscObjectTypeCompare((PetscObject)ts->adapt,TSADAPTNONE,&match);CHKERRQ(ierr); 10482ffb9264SLisandro Dalcin if (!match) { 10491566a47fSLisandro Dalcin ierr = VecDuplicate(ts->vec_sol,&th->vec_sol_prev);CHKERRQ(ierr); 10501566a47fSLisandro Dalcin ierr = VecDuplicate(ts->vec_sol,&th->vec_lte_work);CHKERRQ(ierr); 10513b1890cdSShri Abhyankar } 10521566a47fSLisandro Dalcin ierr = TSGetSNES(ts,&ts->snes);CHKERRQ(ierr); 1053b4dd3bf9SBarry Smith PetscFunctionReturn(0); 1054b4dd3bf9SBarry Smith } 10550c7376e5SHong Zhang 1056b4dd3bf9SBarry Smith /*------------------------------------------------------------*/ 1057b4dd3bf9SBarry Smith 1058b4dd3bf9SBarry Smith static PetscErrorCode TSAdjointSetUp_Theta(TS ts) 1059b4dd3bf9SBarry Smith { 1060b4dd3bf9SBarry Smith TS_Theta *th = (TS_Theta*)ts->data; 1061b4dd3bf9SBarry Smith PetscErrorCode ierr; 1062b4dd3bf9SBarry Smith 1063b4dd3bf9SBarry Smith PetscFunctionBegin; 1064b5e0532dSHong Zhang ierr = VecDuplicateVecs(ts->vecs_sensi[0],ts->numcost,&th->VecsDeltaLam);CHKERRQ(ierr); 1065b5b4017aSHong Zhang ierr = VecDuplicateVecs(ts->vecs_sensi[0],ts->numcost,&th->VecsSensiTemp);CHKERRQ(ierr); 10662ca6e920SHong Zhang if (ts->vecs_sensip) { 1067b5e0532dSHong Zhang ierr = VecDuplicateVecs(ts->vecs_sensip[0],ts->numcost,&th->VecsDeltaMu);CHKERRQ(ierr); 10682ca6e920SHong Zhang } 1069b5b4017aSHong Zhang if (ts->vecs_sensi2) { 1070b5b4017aSHong Zhang ierr = VecDuplicateVecs(ts->vecs_sensi[0],ts->numcost,&th->VecsDeltaLam2);CHKERRQ(ierr); 1071b5b4017aSHong Zhang ierr = VecDuplicateVecs(ts->vecs_sensi2[0],ts->numcost,&th->VecsSensi2Temp);CHKERRQ(ierr); 107267633408SHong Zhang /* hack ts to make implicit TS solver work when users provide only explicit versions of callbacks (RHSFunction,RHSJacobian,RHSHessian etc.) */ 107367633408SHong Zhang if (!ts->ihessianproduct_fuu) ts->vecs_fuu = ts->vecs_guu; 107467633408SHong Zhang if (!ts->ihessianproduct_fup) ts->vecs_fup = ts->vecs_gup; 1075b5b4017aSHong Zhang } 1076c9681e5dSHong Zhang if (ts->vecs_sensi2p) { 1077c9681e5dSHong Zhang ierr = VecDuplicateVecs(ts->vecs_sensi2p[0],ts->numcost,&th->VecsDeltaMu2);CHKERRQ(ierr); 107867633408SHong Zhang /* hack ts to make implicit TS solver work when users provide only explicit versions of callbacks (RHSFunction,RHSJacobian,RHSHessian etc.) */ 107967633408SHong Zhang if (!ts->ihessianproduct_fpu) ts->vecs_fpu = ts->vecs_gpu; 108067633408SHong Zhang if (!ts->ihessianproduct_fpp) ts->vecs_fpp = ts->vecs_gpp; 1081b5b4017aSHong Zhang } 1082316643e7SJed Brown PetscFunctionReturn(0); 1083316643e7SJed Brown } 1084316643e7SJed Brown 10854416b707SBarry Smith static PetscErrorCode TSSetFromOptions_Theta(PetscOptionItems *PetscOptionsObject,TS ts) 1086316643e7SJed Brown { 1087316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 1088316643e7SJed Brown PetscErrorCode ierr; 1089316643e7SJed Brown 1090316643e7SJed Brown PetscFunctionBegin; 1091e55864a3SBarry Smith ierr = PetscOptionsHead(PetscOptionsObject,"Theta ODE solver options");CHKERRQ(ierr); 1092316643e7SJed Brown { 10930298fd71SBarry Smith ierr = PetscOptionsReal("-ts_theta_theta","Location of stage (0<Theta<=1)","TSThetaSetTheta",th->Theta,&th->Theta,NULL);CHKERRQ(ierr); 10940298fd71SBarry Smith ierr = PetscOptionsBool("-ts_theta_endpoint","Use the endpoint instead of midpoint form of the Theta method","TSThetaSetEndpoint",th->endpoint,&th->endpoint,NULL);CHKERRQ(ierr); 109503842d09SLisandro Dalcin ierr = PetscOptionsBool("-ts_theta_initial_guess_extrapolate","Extrapolate stage initial guess from previous solution (sometimes unstable)","TSThetaSetExtrapolate",th->extrapolate,&th->extrapolate,NULL);CHKERRQ(ierr); 1096316643e7SJed Brown } 1097316643e7SJed Brown ierr = PetscOptionsTail();CHKERRQ(ierr); 1098316643e7SJed Brown PetscFunctionReturn(0); 1099316643e7SJed Brown } 1100316643e7SJed Brown 1101316643e7SJed Brown static PetscErrorCode TSView_Theta(TS ts,PetscViewer viewer) 1102316643e7SJed Brown { 1103316643e7SJed Brown TS_Theta *th = (TS_Theta*)ts->data; 1104ace3abfcSBarry Smith PetscBool iascii; 1105316643e7SJed Brown PetscErrorCode ierr; 1106316643e7SJed Brown 1107316643e7SJed Brown PetscFunctionBegin; 1108251f4c67SDmitry Karpeev ierr = PetscObjectTypeCompare((PetscObject)viewer,PETSCVIEWERASCII,&iascii);CHKERRQ(ierr); 1109316643e7SJed Brown if (iascii) { 11107c8652ddSBarry Smith ierr = PetscViewerASCIIPrintf(viewer," Theta=%g\n",(double)th->Theta);CHKERRQ(ierr); 1111ace68cafSJed Brown ierr = PetscViewerASCIIPrintf(viewer," Extrapolation=%s\n",th->extrapolate ? "yes" : "no");CHKERRQ(ierr); 1112316643e7SJed Brown } 1113316643e7SJed Brown PetscFunctionReturn(0); 1114316643e7SJed Brown } 1115316643e7SJed Brown 1116560360afSLisandro Dalcin static PetscErrorCode TSThetaGetTheta_Theta(TS ts,PetscReal *theta) 11170de4c49aSJed Brown { 11180de4c49aSJed Brown TS_Theta *th = (TS_Theta*)ts->data; 11190de4c49aSJed Brown 11200de4c49aSJed Brown PetscFunctionBegin; 11210de4c49aSJed Brown *theta = th->Theta; 11220de4c49aSJed Brown PetscFunctionReturn(0); 11230de4c49aSJed Brown } 11240de4c49aSJed Brown 1125560360afSLisandro Dalcin static PetscErrorCode TSThetaSetTheta_Theta(TS ts,PetscReal theta) 11260de4c49aSJed Brown { 11270de4c49aSJed Brown TS_Theta *th = (TS_Theta*)ts->data; 11280de4c49aSJed Brown 11290de4c49aSJed Brown PetscFunctionBegin; 11307c8652ddSBarry Smith if (theta <= 0 || 1 < theta) SETERRQ1(PetscObjectComm((PetscObject)ts),PETSC_ERR_ARG_OUTOFRANGE,"Theta %g not in range (0,1]",(double)theta); 11310de4c49aSJed Brown th->Theta = theta; 11321566a47fSLisandro Dalcin th->order = (th->Theta == 0.5) ? 2 : 1; 11330de4c49aSJed Brown PetscFunctionReturn(0); 11340de4c49aSJed Brown } 1135eb284becSJed Brown 1136560360afSLisandro Dalcin static PetscErrorCode TSThetaGetEndpoint_Theta(TS ts,PetscBool *endpoint) 113726f2ff8fSLisandro Dalcin { 113826f2ff8fSLisandro Dalcin TS_Theta *th = (TS_Theta*)ts->data; 113926f2ff8fSLisandro Dalcin 114026f2ff8fSLisandro Dalcin PetscFunctionBegin; 114126f2ff8fSLisandro Dalcin *endpoint = th->endpoint; 114226f2ff8fSLisandro Dalcin PetscFunctionReturn(0); 114326f2ff8fSLisandro Dalcin } 114426f2ff8fSLisandro Dalcin 1145560360afSLisandro Dalcin static PetscErrorCode TSThetaSetEndpoint_Theta(TS ts,PetscBool flg) 1146eb284becSJed Brown { 1147eb284becSJed Brown TS_Theta *th = (TS_Theta*)ts->data; 1148eb284becSJed Brown 1149eb284becSJed Brown PetscFunctionBegin; 1150eb284becSJed Brown th->endpoint = flg; 1151eb284becSJed Brown PetscFunctionReturn(0); 1152eb284becSJed Brown } 11530de4c49aSJed Brown 1154f9c1d6abSBarry Smith #if defined(PETSC_HAVE_COMPLEX) 1155f9c1d6abSBarry Smith static PetscErrorCode TSComputeLinearStability_Theta(TS ts,PetscReal xr,PetscReal xi,PetscReal *yr,PetscReal *yi) 1156f9c1d6abSBarry Smith { 1157f9c1d6abSBarry Smith PetscComplex z = xr + xi*PETSC_i,f; 1158f9c1d6abSBarry Smith TS_Theta *th = (TS_Theta*)ts->data; 11593fd8ae06SJed Brown const PetscReal one = 1.0; 1160f9c1d6abSBarry Smith 1161f9c1d6abSBarry Smith PetscFunctionBegin; 11623fd8ae06SJed Brown f = (one + (one - th->Theta)*z)/(one - th->Theta*z); 1163f9c1d6abSBarry Smith *yr = PetscRealPartComplex(f); 1164f9c1d6abSBarry Smith *yi = PetscImaginaryPartComplex(f); 1165f9c1d6abSBarry Smith PetscFunctionReturn(0); 1166f9c1d6abSBarry Smith } 1167f9c1d6abSBarry Smith #endif 1168f9c1d6abSBarry Smith 116942682096SHong Zhang static PetscErrorCode TSGetStages_Theta(TS ts,PetscInt *ns,Vec **Y) 117042682096SHong Zhang { 117142682096SHong Zhang TS_Theta *th = (TS_Theta*)ts->data; 117242682096SHong Zhang 117342682096SHong Zhang PetscFunctionBegin; 11741566a47fSLisandro Dalcin if (ns) *ns = 1; 11751566a47fSLisandro Dalcin if (Y) *Y = th->endpoint ? &(th->X0) : &(th->X); 117642682096SHong Zhang PetscFunctionReturn(0); 117742682096SHong Zhang } 1178f9c1d6abSBarry Smith 1179316643e7SJed Brown /* ------------------------------------------------------------ */ 1180316643e7SJed Brown /*MC 118196f5712cSJed Brown TSTHETA - DAE solver using the implicit Theta method 1182316643e7SJed Brown 1183316643e7SJed Brown Level: beginner 1184316643e7SJed Brown 11854eb428fdSBarry Smith Options Database: 1186c82ed962SBarry Smith + -ts_theta_theta <Theta> - Location of stage (0<Theta<=1) 1187c82ed962SBarry Smith . -ts_theta_endpoint <flag> - Use the endpoint (like Crank-Nicholson) instead of midpoint form of the Theta method 118803842d09SLisandro Dalcin - -ts_theta_initial_guess_extrapolate <flg> - Extrapolate stage initial guess from previous solution (sometimes unstable) 11894eb428fdSBarry Smith 1190eb284becSJed Brown Notes: 11910c3ba866SJed Brown $ -ts_type theta -ts_theta_theta 1.0 corresponds to backward Euler (TSBEULER) 11920c3ba866SJed Brown $ -ts_type theta -ts_theta_theta 0.5 corresponds to the implicit midpoint rule 11934eb428fdSBarry Smith $ -ts_type theta -ts_theta_theta 0.5 -ts_theta_endpoint corresponds to Crank-Nicholson (TSCN) 11944eb428fdSBarry Smith 1195eb284becSJed Brown This method can be applied to DAE. 1196eb284becSJed Brown 1197eb284becSJed Brown This method is cast as a 1-stage implicit Runge-Kutta method. 1198eb284becSJed Brown 1199eb284becSJed Brown .vb 1200eb284becSJed Brown Theta | Theta 1201eb284becSJed Brown ------------- 1202eb284becSJed Brown | 1 1203eb284becSJed Brown .ve 1204eb284becSJed Brown 1205eb284becSJed Brown For the default Theta=0.5, this is also known as the implicit midpoint rule. 1206eb284becSJed Brown 1207eb284becSJed Brown When the endpoint variant is chosen, the method becomes a 2-stage method with first stage explicit: 1208eb284becSJed Brown 1209eb284becSJed Brown .vb 1210eb284becSJed Brown 0 | 0 0 1211eb284becSJed Brown 1 | 1-Theta Theta 1212eb284becSJed Brown ------------------- 1213eb284becSJed Brown | 1-Theta Theta 1214eb284becSJed Brown .ve 1215eb284becSJed Brown 1216eb284becSJed Brown For the default Theta=0.5, this is the trapezoid rule (also known as Crank-Nicolson, see TSCN). 1217eb284becSJed Brown 1218eb284becSJed Brown To apply a diagonally implicit RK method to DAE, the stage formula 1219eb284becSJed Brown 1220eb284becSJed Brown $ Y_i = X + h sum_j a_ij Y'_j 1221eb284becSJed Brown 12224eb428fdSBarry Smith is interpreted as a formula for Y'_i in terms of Y_i and known values (Y'_j, j<i) 1223eb284becSJed Brown 1224eb284becSJed Brown .seealso: TSCreate(), TS, TSSetType(), TSCN, TSBEULER, TSThetaSetTheta(), TSThetaSetEndpoint() 1225316643e7SJed Brown 1226316643e7SJed Brown M*/ 12278cc058d9SJed Brown PETSC_EXTERN PetscErrorCode TSCreate_Theta(TS ts) 1228316643e7SJed Brown { 1229316643e7SJed Brown TS_Theta *th; 1230316643e7SJed Brown PetscErrorCode ierr; 1231316643e7SJed Brown 1232316643e7SJed Brown PetscFunctionBegin; 1233277b19d0SLisandro Dalcin ts->ops->reset = TSReset_Theta; 1234ece46509SHong Zhang ts->ops->adjointreset = TSAdjointReset_Theta; 1235316643e7SJed Brown ts->ops->destroy = TSDestroy_Theta; 1236316643e7SJed Brown ts->ops->view = TSView_Theta; 1237316643e7SJed Brown ts->ops->setup = TSSetUp_Theta; 123842f2b339SBarry Smith ts->ops->adjointsetup = TSAdjointSetUp_Theta; 1239ece46509SHong Zhang ts->ops->adjointreset = TSAdjointReset_Theta; 1240316643e7SJed Brown ts->ops->step = TSStep_Theta; 1241cd652676SJed Brown ts->ops->interpolate = TSInterpolate_Theta; 12421566a47fSLisandro Dalcin ts->ops->evaluatewlte = TSEvaluateWLTE_Theta; 124324655328SShri ts->ops->rollback = TSRollBack_Theta; 1244316643e7SJed Brown ts->ops->setfromoptions = TSSetFromOptions_Theta; 12450f5c6efeSJed Brown ts->ops->snesfunction = SNESTSFormFunction_Theta; 12460f5c6efeSJed Brown ts->ops->snesjacobian = SNESTSFormJacobian_Theta; 1247f9c1d6abSBarry Smith #if defined(PETSC_HAVE_COMPLEX) 1248f9c1d6abSBarry Smith ts->ops->linearstability = TSComputeLinearStability_Theta; 1249f9c1d6abSBarry Smith #endif 125042682096SHong Zhang ts->ops->getstages = TSGetStages_Theta; 125142f2b339SBarry Smith ts->ops->adjointstep = TSAdjointStep_Theta; 1252b1cb36f3SHong Zhang ts->ops->adjointintegral = TSAdjointCostIntegral_Theta; 1253b1cb36f3SHong Zhang ts->ops->forwardintegral = TSForwardCostIntegral_Theta; 12542ffb9264SLisandro Dalcin ts->default_adapt_type = TSADAPTNONE; 12556affb6f8SHong Zhang 1256715f1b00SHong Zhang ts->ops->forwardsetup = TSForwardSetUp_Theta; 12577adebddeSHong Zhang ts->ops->forwardreset = TSForwardReset_Theta; 1258715f1b00SHong Zhang ts->ops->forwardstep = TSForwardStep_Theta; 12596affb6f8SHong Zhang ts->ops->forwardgetstages = TSForwardGetStages_Theta; 1260316643e7SJed Brown 1261efd4aadfSBarry Smith ts->usessnes = PETSC_TRUE; 1262efd4aadfSBarry Smith 1263b00a9115SJed Brown ierr = PetscNewLog(ts,&th);CHKERRQ(ierr); 1264316643e7SJed Brown ts->data = (void*)th; 1265316643e7SJed Brown 1266715f1b00SHong Zhang th->VecsDeltaLam = NULL; 1267715f1b00SHong Zhang th->VecsDeltaMu = NULL; 1268715f1b00SHong Zhang th->VecsSensiTemp = NULL; 1269b5b4017aSHong Zhang th->VecsSensi2Temp = NULL; 1270715f1b00SHong Zhang 12716f700aefSJed Brown th->extrapolate = PETSC_FALSE; 1272316643e7SJed Brown th->Theta = 0.5; 12731566a47fSLisandro Dalcin th->order = 2; 1274bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetTheta_C",TSThetaGetTheta_Theta);CHKERRQ(ierr); 1275bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetTheta_C",TSThetaSetTheta_Theta);CHKERRQ(ierr); 1276bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetEndpoint_C",TSThetaGetEndpoint_Theta);CHKERRQ(ierr); 1277bdf89e91SBarry Smith ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetEndpoint_C",TSThetaSetEndpoint_Theta);CHKERRQ(ierr); 1278316643e7SJed Brown PetscFunctionReturn(0); 1279316643e7SJed Brown } 12800de4c49aSJed Brown 12810de4c49aSJed Brown /*@ 12820de4c49aSJed Brown TSThetaGetTheta - Get the abscissa of the stage in (0,1]. 12830de4c49aSJed Brown 12840de4c49aSJed Brown Not Collective 12850de4c49aSJed Brown 12860de4c49aSJed Brown Input Parameter: 12870de4c49aSJed Brown . ts - timestepping context 12880de4c49aSJed Brown 12890de4c49aSJed Brown Output Parameter: 12900de4c49aSJed Brown . theta - stage abscissa 12910de4c49aSJed Brown 12920de4c49aSJed Brown Note: 12930de4c49aSJed Brown Use of this function is normally only required to hack TSTHETA to use a modified integration scheme. 12940de4c49aSJed Brown 12950de4c49aSJed Brown Level: Advanced 12960de4c49aSJed Brown 12970de4c49aSJed Brown .seealso: TSThetaSetTheta() 12980de4c49aSJed Brown @*/ 12997087cfbeSBarry Smith PetscErrorCode TSThetaGetTheta(TS ts,PetscReal *theta) 13000de4c49aSJed Brown { 13014ac538c5SBarry Smith PetscErrorCode ierr; 13020de4c49aSJed Brown 13030de4c49aSJed Brown PetscFunctionBegin; 1304afb20b64SJed Brown PetscValidHeaderSpecific(ts,TS_CLASSID,1); 13050de4c49aSJed Brown PetscValidPointer(theta,2); 13064ac538c5SBarry Smith ierr = PetscUseMethod(ts,"TSThetaGetTheta_C",(TS,PetscReal*),(ts,theta));CHKERRQ(ierr); 13070de4c49aSJed Brown PetscFunctionReturn(0); 13080de4c49aSJed Brown } 13090de4c49aSJed Brown 13100de4c49aSJed Brown /*@ 13110de4c49aSJed Brown TSThetaSetTheta - Set the abscissa of the stage in (0,1]. 13120de4c49aSJed Brown 13130de4c49aSJed Brown Not Collective 13140de4c49aSJed Brown 13150de4c49aSJed Brown Input Parameter: 13160de4c49aSJed Brown + ts - timestepping context 13170de4c49aSJed Brown - theta - stage abscissa 13180de4c49aSJed Brown 13190de4c49aSJed Brown Options Database: 13200de4c49aSJed Brown . -ts_theta_theta <theta> 13210de4c49aSJed Brown 13220de4c49aSJed Brown Level: Intermediate 13230de4c49aSJed Brown 13240de4c49aSJed Brown .seealso: TSThetaGetTheta() 13250de4c49aSJed Brown @*/ 13267087cfbeSBarry Smith PetscErrorCode TSThetaSetTheta(TS ts,PetscReal theta) 13270de4c49aSJed Brown { 13284ac538c5SBarry Smith PetscErrorCode ierr; 13290de4c49aSJed Brown 13300de4c49aSJed Brown PetscFunctionBegin; 1331afb20b64SJed Brown PetscValidHeaderSpecific(ts,TS_CLASSID,1); 13324ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSThetaSetTheta_C",(TS,PetscReal),(ts,theta));CHKERRQ(ierr); 13330de4c49aSJed Brown PetscFunctionReturn(0); 13340de4c49aSJed Brown } 1335f33bbcb6SJed Brown 133626f2ff8fSLisandro Dalcin /*@ 133726f2ff8fSLisandro Dalcin TSThetaGetEndpoint - Gets whether to use the endpoint variant of the method (e.g. trapezoid/Crank-Nicolson instead of midpoint rule). 133826f2ff8fSLisandro Dalcin 133926f2ff8fSLisandro Dalcin Not Collective 134026f2ff8fSLisandro Dalcin 134126f2ff8fSLisandro Dalcin Input Parameter: 134226f2ff8fSLisandro Dalcin . ts - timestepping context 134326f2ff8fSLisandro Dalcin 134426f2ff8fSLisandro Dalcin Output Parameter: 134526f2ff8fSLisandro Dalcin . endpoint - PETSC_TRUE when using the endpoint variant 134626f2ff8fSLisandro Dalcin 134726f2ff8fSLisandro Dalcin Level: Advanced 134826f2ff8fSLisandro Dalcin 134926f2ff8fSLisandro Dalcin .seealso: TSThetaSetEndpoint(), TSTHETA, TSCN 135026f2ff8fSLisandro Dalcin @*/ 135126f2ff8fSLisandro Dalcin PetscErrorCode TSThetaGetEndpoint(TS ts,PetscBool *endpoint) 135226f2ff8fSLisandro Dalcin { 135326f2ff8fSLisandro Dalcin PetscErrorCode ierr; 135426f2ff8fSLisandro Dalcin 135526f2ff8fSLisandro Dalcin PetscFunctionBegin; 135626f2ff8fSLisandro Dalcin PetscValidHeaderSpecific(ts,TS_CLASSID,1); 135726f2ff8fSLisandro Dalcin PetscValidPointer(endpoint,2); 1358163d334eSBarry Smith ierr = PetscUseMethod(ts,"TSThetaGetEndpoint_C",(TS,PetscBool*),(ts,endpoint));CHKERRQ(ierr); 135926f2ff8fSLisandro Dalcin PetscFunctionReturn(0); 136026f2ff8fSLisandro Dalcin } 136126f2ff8fSLisandro Dalcin 1362eb284becSJed Brown /*@ 1363eb284becSJed Brown TSThetaSetEndpoint - Sets whether to use the endpoint variant of the method (e.g. trapezoid/Crank-Nicolson instead of midpoint rule). 1364eb284becSJed Brown 1365eb284becSJed Brown Not Collective 1366eb284becSJed Brown 1367eb284becSJed Brown Input Parameter: 1368eb284becSJed Brown + ts - timestepping context 1369eb284becSJed Brown - flg - PETSC_TRUE to use the endpoint variant 1370eb284becSJed Brown 1371eb284becSJed Brown Options Database: 1372eb284becSJed Brown . -ts_theta_endpoint <flg> 1373eb284becSJed Brown 1374eb284becSJed Brown Level: Intermediate 1375eb284becSJed Brown 1376eb284becSJed Brown .seealso: TSTHETA, TSCN 1377eb284becSJed Brown @*/ 1378eb284becSJed Brown PetscErrorCode TSThetaSetEndpoint(TS ts,PetscBool flg) 1379eb284becSJed Brown { 1380eb284becSJed Brown PetscErrorCode ierr; 1381eb284becSJed Brown 1382eb284becSJed Brown PetscFunctionBegin; 1383eb284becSJed Brown PetscValidHeaderSpecific(ts,TS_CLASSID,1); 1384eb284becSJed Brown ierr = PetscTryMethod(ts,"TSThetaSetEndpoint_C",(TS,PetscBool),(ts,flg));CHKERRQ(ierr); 1385eb284becSJed Brown PetscFunctionReturn(0); 1386eb284becSJed Brown } 1387eb284becSJed Brown 1388f33bbcb6SJed Brown /* 1389f33bbcb6SJed Brown * TSBEULER and TSCN are straightforward specializations of TSTHETA. 1390f33bbcb6SJed Brown * The creation functions for these specializations are below. 1391f33bbcb6SJed Brown */ 1392f33bbcb6SJed Brown 13931566a47fSLisandro Dalcin static PetscErrorCode TSSetUp_BEuler(TS ts) 13941566a47fSLisandro Dalcin { 13951566a47fSLisandro Dalcin TS_Theta *th = (TS_Theta*)ts->data; 13961566a47fSLisandro Dalcin PetscErrorCode ierr; 13971566a47fSLisandro Dalcin 13981566a47fSLisandro Dalcin PetscFunctionBegin; 13991566a47fSLisandro Dalcin if (th->Theta != 1.0) SETERRQ(PetscObjectComm((PetscObject)ts),PETSC_ERR_OPT_OVERWRITE,"Can not change the default value (1) of theta when using backward Euler\n"); 14001566a47fSLisandro Dalcin if (th->endpoint) SETERRQ(PetscObjectComm((PetscObject)ts),PETSC_ERR_OPT_OVERWRITE,"Can not change to the endpoint form of the Theta methods when using backward Euler\n"); 14011566a47fSLisandro Dalcin ierr = TSSetUp_Theta(ts);CHKERRQ(ierr); 14021566a47fSLisandro Dalcin PetscFunctionReturn(0); 14031566a47fSLisandro Dalcin } 14041566a47fSLisandro Dalcin 1405f33bbcb6SJed Brown static PetscErrorCode TSView_BEuler(TS ts,PetscViewer viewer) 1406f33bbcb6SJed Brown { 1407f33bbcb6SJed Brown PetscFunctionBegin; 1408f33bbcb6SJed Brown PetscFunctionReturn(0); 1409f33bbcb6SJed Brown } 1410f33bbcb6SJed Brown 1411f33bbcb6SJed Brown /*MC 1412f33bbcb6SJed Brown TSBEULER - ODE solver using the implicit backward Euler method 1413f33bbcb6SJed Brown 1414f33bbcb6SJed Brown Level: beginner 1415f33bbcb6SJed Brown 14164eb428fdSBarry Smith Notes: 1417c7eb6c99SShri Abhyankar TSBEULER is equivalent to TSTHETA with Theta=1.0 14184eb428fdSBarry Smith 14191566a47fSLisandro Dalcin $ -ts_type theta -ts_theta_theta 1.0 14204eb428fdSBarry Smith 1421f33bbcb6SJed Brown .seealso: TSCreate(), TS, TSSetType(), TSEULER, TSCN, TSTHETA 1422f33bbcb6SJed Brown 1423f33bbcb6SJed Brown M*/ 14248cc058d9SJed Brown PETSC_EXTERN PetscErrorCode TSCreate_BEuler(TS ts) 1425f33bbcb6SJed Brown { 1426f33bbcb6SJed Brown PetscErrorCode ierr; 1427f33bbcb6SJed Brown 1428f33bbcb6SJed Brown PetscFunctionBegin; 1429f33bbcb6SJed Brown ierr = TSCreate_Theta(ts);CHKERRQ(ierr); 1430f33bbcb6SJed Brown ierr = TSThetaSetTheta(ts,1.0);CHKERRQ(ierr); 14311566a47fSLisandro Dalcin ierr = TSThetaSetEndpoint(ts,PETSC_FALSE);CHKERRQ(ierr); 14320c7376e5SHong Zhang ts->ops->setup = TSSetUp_BEuler; 1433f33bbcb6SJed Brown ts->ops->view = TSView_BEuler; 1434f33bbcb6SJed Brown PetscFunctionReturn(0); 1435f33bbcb6SJed Brown } 1436f33bbcb6SJed Brown 14371566a47fSLisandro Dalcin static PetscErrorCode TSSetUp_CN(TS ts) 14381566a47fSLisandro Dalcin { 14391566a47fSLisandro Dalcin TS_Theta *th = (TS_Theta*)ts->data; 14401566a47fSLisandro Dalcin PetscErrorCode ierr; 14411566a47fSLisandro Dalcin 14421566a47fSLisandro Dalcin PetscFunctionBegin; 14431566a47fSLisandro Dalcin if (th->Theta != 0.5) SETERRQ(PetscObjectComm((PetscObject)ts),PETSC_ERR_OPT_OVERWRITE,"Can not change the default value (0.5) of theta when using Crank-Nicolson\n"); 14441566a47fSLisandro Dalcin if (!th->endpoint) SETERRQ(PetscObjectComm((PetscObject)ts),PETSC_ERR_OPT_OVERWRITE,"Can not change to the midpoint form of the Theta methods when using Crank-Nicolson\n"); 14451566a47fSLisandro Dalcin ierr = TSSetUp_Theta(ts);CHKERRQ(ierr); 14461566a47fSLisandro Dalcin PetscFunctionReturn(0); 14471566a47fSLisandro Dalcin } 14481566a47fSLisandro Dalcin 1449f33bbcb6SJed Brown static PetscErrorCode TSView_CN(TS ts,PetscViewer viewer) 1450f33bbcb6SJed Brown { 1451f33bbcb6SJed Brown PetscFunctionBegin; 1452f33bbcb6SJed Brown PetscFunctionReturn(0); 1453f33bbcb6SJed Brown } 1454f33bbcb6SJed Brown 1455f33bbcb6SJed Brown /*MC 1456f33bbcb6SJed Brown TSCN - ODE solver using the implicit Crank-Nicolson method. 1457f33bbcb6SJed Brown 1458f33bbcb6SJed Brown Level: beginner 1459f33bbcb6SJed Brown 1460f33bbcb6SJed Brown Notes: 14617cf5af47SJed Brown TSCN is equivalent to TSTHETA with Theta=0.5 and the "endpoint" option set. I.e. 14627cf5af47SJed Brown 14637cf5af47SJed Brown $ -ts_type theta -ts_theta_theta 0.5 -ts_theta_endpoint 1464f33bbcb6SJed Brown 1465f33bbcb6SJed Brown .seealso: TSCreate(), TS, TSSetType(), TSBEULER, TSTHETA 1466f33bbcb6SJed Brown 1467f33bbcb6SJed Brown M*/ 14688cc058d9SJed Brown PETSC_EXTERN PetscErrorCode TSCreate_CN(TS ts) 1469f33bbcb6SJed Brown { 1470f33bbcb6SJed Brown PetscErrorCode ierr; 1471f33bbcb6SJed Brown 1472f33bbcb6SJed Brown PetscFunctionBegin; 1473f33bbcb6SJed Brown ierr = TSCreate_Theta(ts);CHKERRQ(ierr); 1474f33bbcb6SJed Brown ierr = TSThetaSetTheta(ts,0.5);CHKERRQ(ierr); 1475eb284becSJed Brown ierr = TSThetaSetEndpoint(ts,PETSC_TRUE);CHKERRQ(ierr); 14760c7376e5SHong Zhang ts->ops->setup = TSSetUp_CN; 1477f33bbcb6SJed Brown ts->ops->view = TSView_CN; 1478f33bbcb6SJed Brown PetscFunctionReturn(0); 1479f33bbcb6SJed Brown } 1480