1 /* 2 Code for timestepping with implicit Theta method 3 */ 4 #include <petsc-private/tsimpl.h> /*I "petscts.h" I*/ 5 #include <petscsnes.h> 6 #include <petscdm.h> 7 #include <petscmat.h> 8 9 typedef struct { 10 Vec X,Xdot; /* Storage for one stage */ 11 Vec X0; /* work vector to store X0 */ 12 Vec affine; /* Affine vector needed for residual at beginning of step */ 13 Vec *VecDeltaLam; /* Increment of the adjoint sensitivity w.r.t IC at stage*/ 14 Vec *VecDeltaMu; /* Increment of the adjoint sensitivity w.r.t P at stage*/ 15 Vec *VecSensiTemp; /* Vector to be timed with Jacobian transpose*/ 16 PetscBool extrapolate; 17 PetscBool endpoint; 18 PetscReal Theta; 19 PetscReal stage_time; 20 TSStepStatus status; 21 char *name; 22 PetscInt order; 23 PetscReal ccfl; /* Placeholder for CFL coefficient relative to forward Euler */ 24 PetscBool adapt; /* use time-step adaptivity ? */ 25 } TS_Theta; 26 27 #undef __FUNCT__ 28 #define __FUNCT__ "TSThetaGetX0AndXdot" 29 static PetscErrorCode TSThetaGetX0AndXdot(TS ts,DM dm,Vec *X0,Vec *Xdot) 30 { 31 TS_Theta *th = (TS_Theta*)ts->data; 32 PetscErrorCode ierr; 33 34 PetscFunctionBegin; 35 if (X0) { 36 if (dm && dm != ts->dm) { 37 ierr = DMGetNamedGlobalVector(dm,"TSTheta_X0",X0);CHKERRQ(ierr); 38 } else *X0 = ts->vec_sol; 39 } 40 if (Xdot) { 41 if (dm && dm != ts->dm) { 42 ierr = DMGetNamedGlobalVector(dm,"TSTheta_Xdot",Xdot);CHKERRQ(ierr); 43 } else *Xdot = th->Xdot; 44 } 45 PetscFunctionReturn(0); 46 } 47 48 49 #undef __FUNCT__ 50 #define __FUNCT__ "TSThetaRestoreX0AndXdot" 51 static PetscErrorCode TSThetaRestoreX0AndXdot(TS ts,DM dm,Vec *X0,Vec *Xdot) 52 { 53 PetscErrorCode ierr; 54 55 PetscFunctionBegin; 56 if (X0) { 57 if (dm && dm != ts->dm) { 58 ierr = DMRestoreNamedGlobalVector(dm,"TSTheta_X0",X0);CHKERRQ(ierr); 59 } 60 } 61 if (Xdot) { 62 if (dm && dm != ts->dm) { 63 ierr = DMRestoreNamedGlobalVector(dm,"TSTheta_Xdot",Xdot);CHKERRQ(ierr); 64 } 65 } 66 PetscFunctionReturn(0); 67 } 68 69 #undef __FUNCT__ 70 #define __FUNCT__ "DMCoarsenHook_TSTheta" 71 static PetscErrorCode DMCoarsenHook_TSTheta(DM fine,DM coarse,void *ctx) 72 { 73 74 PetscFunctionBegin; 75 PetscFunctionReturn(0); 76 } 77 78 #undef __FUNCT__ 79 #define __FUNCT__ "DMRestrictHook_TSTheta" 80 static PetscErrorCode DMRestrictHook_TSTheta(DM fine,Mat restrct,Vec rscale,Mat inject,DM coarse,void *ctx) 81 { 82 TS ts = (TS)ctx; 83 PetscErrorCode ierr; 84 Vec X0,Xdot,X0_c,Xdot_c; 85 86 PetscFunctionBegin; 87 ierr = TSThetaGetX0AndXdot(ts,fine,&X0,&Xdot);CHKERRQ(ierr); 88 ierr = TSThetaGetX0AndXdot(ts,coarse,&X0_c,&Xdot_c);CHKERRQ(ierr); 89 ierr = MatRestrict(restrct,X0,X0_c);CHKERRQ(ierr); 90 ierr = MatRestrict(restrct,Xdot,Xdot_c);CHKERRQ(ierr); 91 ierr = VecPointwiseMult(X0_c,rscale,X0_c);CHKERRQ(ierr); 92 ierr = VecPointwiseMult(Xdot_c,rscale,Xdot_c);CHKERRQ(ierr); 93 ierr = TSThetaRestoreX0AndXdot(ts,fine,&X0,&Xdot);CHKERRQ(ierr); 94 ierr = TSThetaRestoreX0AndXdot(ts,coarse,&X0_c,&Xdot_c);CHKERRQ(ierr); 95 PetscFunctionReturn(0); 96 } 97 98 #undef __FUNCT__ 99 #define __FUNCT__ "DMSubDomainHook_TSTheta" 100 static PetscErrorCode DMSubDomainHook_TSTheta(DM dm,DM subdm,void *ctx) 101 { 102 103 PetscFunctionBegin; 104 PetscFunctionReturn(0); 105 } 106 107 #undef __FUNCT__ 108 #define __FUNCT__ "DMSubDomainRestrictHook_TSTheta" 109 static PetscErrorCode DMSubDomainRestrictHook_TSTheta(DM dm,VecScatter gscat,VecScatter lscat,DM subdm,void *ctx) 110 { 111 TS ts = (TS)ctx; 112 PetscErrorCode ierr; 113 Vec X0,Xdot,X0_sub,Xdot_sub; 114 115 PetscFunctionBegin; 116 ierr = TSThetaGetX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 117 ierr = TSThetaGetX0AndXdot(ts,subdm,&X0_sub,&Xdot_sub);CHKERRQ(ierr); 118 119 ierr = VecScatterBegin(gscat,X0,X0_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 120 ierr = VecScatterEnd(gscat,X0,X0_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 121 122 ierr = VecScatterBegin(gscat,Xdot,Xdot_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 123 ierr = VecScatterEnd(gscat,Xdot,Xdot_sub,INSERT_VALUES,SCATTER_FORWARD);CHKERRQ(ierr); 124 125 ierr = TSThetaRestoreX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 126 ierr = TSThetaRestoreX0AndXdot(ts,subdm,&X0_sub,&Xdot_sub);CHKERRQ(ierr); 127 PetscFunctionReturn(0); 128 } 129 130 #undef __FUNCT__ 131 #define __FUNCT__ "TSEvaluateStep_Theta" 132 static PetscErrorCode TSEvaluateStep_Theta(TS ts,PetscInt order,Vec U,PetscBool *done) 133 { 134 PetscErrorCode ierr; 135 TS_Theta *th = (TS_Theta*)ts->data; 136 137 PetscFunctionBegin; 138 if (order == 0) SETERRQ(PetscObjectComm((PetscObject)ts),PETSC_ERR_USER,"No time-step adaptivity implemented for 1st order theta method; Run with -ts_adapt_type none"); 139 if (order == th->order) { 140 if (th->endpoint) { 141 ierr = VecCopy(th->X,U);CHKERRQ(ierr); 142 } else { 143 PetscReal shift = 1./(th->Theta*ts->time_step); 144 ierr = VecAXPBYPCZ(th->Xdot,-shift,shift,0,U,th->X);CHKERRQ(ierr); 145 ierr = VecAXPY(U,ts->time_step,th->Xdot);CHKERRQ(ierr); 146 } 147 } else if (order == th->order-1 && order) { 148 ierr = VecWAXPY(U,ts->time_step,th->Xdot,th->X0);CHKERRQ(ierr); 149 } 150 PetscFunctionReturn(0); 151 } 152 153 #undef __FUNCT__ 154 #define __FUNCT__ "TSRollBack_Theta" 155 static PetscErrorCode TSRollBack_Theta(TS ts) 156 { 157 TS_Theta *th = (TS_Theta*)ts->data; 158 PetscErrorCode ierr; 159 160 PetscFunctionBegin; 161 ierr = VecCopy(th->X0,ts->vec_sol);CHKERRQ(ierr); 162 th->status = TS_STEP_INCOMPLETE; 163 PetscFunctionReturn(0); 164 } 165 166 #undef __FUNCT__ 167 #define __FUNCT__ "TSStep_Theta" 168 static PetscErrorCode TSStep_Theta(TS ts) 169 { 170 TS_Theta *th = (TS_Theta*)ts->data; 171 PetscInt its,lits,reject,next_scheme; 172 PetscReal next_time_step; 173 TSAdapt adapt; 174 PetscBool stageok,accept = PETSC_TRUE; 175 PetscErrorCode ierr; 176 177 PetscFunctionBegin; 178 th->status = TS_STEP_INCOMPLETE; 179 ierr = VecCopy(ts->vec_sol,th->X0);CHKERRQ(ierr); 180 for (reject=0; !ts->reason && th->status != TS_STEP_COMPLETE; ts->reject++) { 181 PetscReal shift = 1./(th->Theta*ts->time_step); 182 th->stage_time = ts->ptime + (th->endpoint ? 1. : th->Theta)*ts->time_step; 183 ierr = TSPreStep(ts);CHKERRQ(ierr); 184 ierr = TSPreStage(ts,th->stage_time);CHKERRQ(ierr); 185 186 if (th->endpoint) { /* This formulation assumes linear time-independent mass matrix */ 187 ierr = VecZeroEntries(th->Xdot);CHKERRQ(ierr); 188 if (!th->affine) {ierr = VecDuplicate(ts->vec_sol,&th->affine);CHKERRQ(ierr);} 189 ierr = TSComputeIFunction(ts,ts->ptime,ts->vec_sol,th->Xdot,th->affine,PETSC_FALSE);CHKERRQ(ierr); 190 ierr = VecScale(th->affine,(th->Theta-1.)/th->Theta);CHKERRQ(ierr); 191 } 192 if (th->extrapolate) { 193 ierr = VecWAXPY(th->X,1./shift,th->Xdot,ts->vec_sol);CHKERRQ(ierr); 194 } else { 195 ierr = VecCopy(ts->vec_sol,th->X);CHKERRQ(ierr); 196 } 197 ierr = SNESSolve(ts->snes,th->affine,th->X);CHKERRQ(ierr); 198 ierr = SNESGetIterationNumber(ts->snes,&its);CHKERRQ(ierr); 199 ierr = SNESGetLinearSolveIterations(ts->snes,&lits);CHKERRQ(ierr); 200 ts->snes_its += its; ts->ksp_its += lits; 201 ierr = TSPostStage(ts,th->stage_time,0,&(th->X));CHKERRQ(ierr); 202 ierr = TSGetAdapt(ts,&adapt);CHKERRQ(ierr); 203 ierr = TSAdaptCheckStage(adapt,ts,&stageok);CHKERRQ(ierr); 204 if (!stageok) {accept = PETSC_FALSE; goto reject_step;} 205 206 ierr = TSEvaluateStep(ts,th->order,ts->vec_sol,NULL);CHKERRQ(ierr); 207 th->status = TS_STEP_PENDING; 208 /* Register only the current method as a candidate because we're not supporting multiple candidates yet. */ 209 ierr = TSGetAdapt(ts,&adapt);CHKERRQ(ierr); 210 ierr = TSAdaptCandidatesClear(adapt);CHKERRQ(ierr); 211 ierr = TSAdaptCandidateAdd(adapt,NULL,th->order,1,th->ccfl,1.0,PETSC_TRUE);CHKERRQ(ierr); 212 ierr = TSAdaptChoose(adapt,ts,ts->time_step,&next_scheme,&next_time_step,&accept);CHKERRQ(ierr); 213 if (!accept) { /* Roll back the current step */ 214 ts->ptime += next_time_step; /* This will be undone in rollback */ 215 th->status = TS_STEP_INCOMPLETE; 216 ierr = TSRollBack(ts);CHKERRQ(ierr); 217 goto reject_step; 218 } 219 220 /* ignore next_scheme for now */ 221 ts->ptime += ts->time_step; 222 ts->time_step = next_time_step; 223 ts->steps++; 224 th->status = TS_STEP_COMPLETE; 225 break; 226 227 reject_step: 228 if (!ts->reason && ++reject > ts->max_reject && ts->max_reject >= 0) { 229 ts->reason = TS_DIVERGED_STEP_REJECTED; 230 ierr = PetscInfo2(ts,"Step=%D, step rejections %D greater than current TS allowed, stopping solve\n",ts->steps,reject);CHKERRQ(ierr); 231 } 232 continue; 233 } 234 PetscFunctionReturn(0); 235 } 236 237 #undef __FUNCT__ 238 #define __FUNCT__ "TSStepAdj_Theta" 239 static PetscErrorCode TSStepAdj_Theta(TS ts) 240 { 241 TS_Theta *th = (TS_Theta*)ts->data; 242 Vec *VecDeltaLam = th->VecDeltaLam,*VecDeltaMu = th->VecDeltaMu,*VecSensiTemp = th->VecSensiTemp; 243 PetscInt nadj; 244 PetscErrorCode ierr; 245 Mat J,Jp; 246 KSP ksp; 247 PetscReal shift; 248 249 PetscFunctionBegin; 250 251 th->status = TS_STEP_INCOMPLETE; 252 ierr = SNESGetKSP(ts->snes,&ksp); 253 ierr = TSGetIJacobian(ts,&J,&Jp,NULL,NULL);CHKERRQ(ierr); 254 th->stage_time = ts->ptime + (th->endpoint ? ts->time_step : (1.-th->Theta)*ts->time_step); /* time_step is negative*/ 255 256 ierr = TSPreStep(ts);CHKERRQ(ierr); 257 258 /* Build RHS */ 259 if (ts->vec_costquad) { /* Cost function has an integral (quadrature) term */ 260 if (th->endpoint) { 261 ierr = TSAdjointComputeDRDYFunction(ts,ts->ptime,ts->vec_sol,ts->vecs_drdy);CHKERRQ(ierr); 262 }else { 263 ierr = TSAdjointComputeDRDYFunction(ts,th->stage_time,th->X,ts->vecs_drdy);CHKERRQ(ierr); 264 } 265 } 266 for (nadj=0; nadj<ts->numberadjs; nadj++) { 267 ierr = VecCopy(ts->vecs_sensi[nadj],VecSensiTemp[nadj]);CHKERRQ(ierr); 268 ierr = VecScale(VecSensiTemp[nadj],-1./(th->Theta*ts->time_step));CHKERRQ(ierr); 269 if (ts->vec_costquad) { 270 ierr = VecAXPY(VecSensiTemp[nadj],1.,ts->vecs_drdy[nadj]);CHKERRQ(ierr); 271 } 272 } 273 274 /* Build LHS */ 275 shift = -1./(th->Theta*ts->time_step); 276 if (th->endpoint) { 277 ierr = TSComputeIJacobian(ts,ts->ptime,ts->vec_sol,th->Xdot,shift,J,Jp,PETSC_FALSE);CHKERRQ(ierr); 278 }else { 279 ierr = TSComputeIJacobian(ts,th->stage_time,th->X,th->Xdot,shift,J,Jp,PETSC_FALSE);CHKERRQ(ierr); 280 } 281 ierr = KSPSetOperators(ksp,J,Jp);CHKERRQ(ierr); 282 283 /* Solve LHS X = RHS */ 284 for (nadj=0; nadj<ts->numberadjs; nadj++) { 285 ierr = KSPSolveTranspose(ksp,VecSensiTemp[nadj],VecDeltaLam[nadj]);CHKERRQ(ierr); 286 } 287 288 /* Update sensitivities, and evaluate integrals if there is any */ 289 if(th->endpoint && th->Theta!=1.) { /* two-stage case */ 290 shift = -1./((th->Theta-1.)*ts->time_step); 291 ierr = TSComputeIJacobian(ts,th->stage_time,th->X,th->Xdot,shift,J,Jp,PETSC_FALSE);CHKERRQ(ierr); 292 if (ts->vec_costquad) { 293 ierr = TSAdjointComputeDRDYFunction(ts,th->stage_time,th->X,ts->vecs_drdy);CHKERRQ(ierr); 294 /* Evolve ts->vec_costquad to compute integrals */ 295 ierr = TSAdjointComputeCostIntegrand(ts,ts->ptime,ts->vec_sol,ts->vec_costintegrand);CHKERRQ(ierr); 296 ierr = VecAXPY(ts->vec_costquad,-ts->time_step*th->Theta,ts->vec_costintegrand);CHKERRQ(ierr); 297 ierr = TSAdjointComputeCostIntegrand(ts,th->stage_time,th->X,ts->vec_costintegrand);CHKERRQ(ierr); 298 ierr = VecAXPY(ts->vec_costquad,ts->time_step*(th->Theta-1.),ts->vec_costintegrand);CHKERRQ(ierr); 299 } 300 for (nadj=0; nadj<ts->numberadjs; nadj++) { 301 ierr = MatMultTranspose(J,VecDeltaLam[nadj],ts->vecs_sensi[nadj]);CHKERRQ(ierr); 302 if (ts->vec_costquad) { 303 ierr = VecAXPY(ts->vecs_sensi[nadj],-1.,ts->vecs_drdy[nadj]);CHKERRQ(ierr); 304 } 305 ierr = VecScale(ts->vecs_sensi[nadj],1./shift);CHKERRQ(ierr); 306 } 307 308 if (ts->vecs_sensip) { /* sensitivities wrt parameters */ 309 ierr = TSAdjointComputeRHSJacobianP(ts,ts->ptime,ts->vec_sol,ts->Jacp);CHKERRQ(ierr); 310 for (nadj=0; nadj<ts->numberadjs; nadj++) { 311 ierr = MatMultTranspose(ts->Jacp,VecDeltaLam[nadj],VecDeltaMu[nadj]);CHKERRQ(ierr); 312 ierr = VecAXPY(ts->vecs_sensip[nadj],-ts->time_step*th->Theta,VecDeltaMu[nadj]);CHKERRQ(ierr); 313 } 314 ierr = TSAdjointComputeRHSJacobianP(ts,th->stage_time,th->X,ts->Jacp);CHKERRQ(ierr); 315 for (nadj=0; nadj<ts->numberadjs; nadj++) { 316 ierr = MatMultTranspose(ts->Jacp,VecDeltaLam[nadj],VecDeltaMu[nadj]);CHKERRQ(ierr); 317 ierr = VecAXPY(ts->vecs_sensip[nadj],-ts->time_step*(1.-th->Theta),VecDeltaMu[nadj]);CHKERRQ(ierr); 318 } 319 if (ts->vec_costquad) { 320 ierr = TSAdjointComputeDRDPFunction(ts,ts->ptime,ts->vec_sol,ts->vecs_drdp);CHKERRQ(ierr); 321 for (nadj=0; nadj<ts->numberadjs; nadj++) { 322 ierr = VecAXPY(ts->vecs_sensip[nadj],-ts->time_step*th->Theta,ts->vecs_drdp[nadj]);CHKERRQ(ierr); 323 } 324 ierr = TSAdjointComputeDRDPFunction(ts,th->stage_time,th->X,ts->vecs_drdp);CHKERRQ(ierr); 325 for (nadj=0; nadj<ts->numberadjs; nadj++) { 326 ierr = VecAXPY(ts->vecs_sensip[nadj],-ts->time_step*(1.-th->Theta),ts->vecs_drdp[nadj]);CHKERRQ(ierr); 327 } 328 } 329 } 330 }else { /* one-stage case */ 331 shift = 0.0; 332 ierr = TSComputeIJacobian(ts,th->stage_time,th->X,th->Xdot,shift,J,Jp,PETSC_FALSE);CHKERRQ(ierr); /* get -f_y */ 333 if (ts->vec_costquad) { 334 ierr = TSAdjointComputeDRDYFunction(ts,th->stage_time,th->X,ts->vecs_drdy);CHKERRQ(ierr); 335 /* Evolve ts->vec_costquad to compute integrals */ 336 ierr = TSAdjointComputeCostIntegrand(ts,th->stage_time,th->X,ts->vec_costintegrand);CHKERRQ(ierr); 337 ierr = VecAXPY(ts->vec_costquad,-ts->time_step,ts->vec_costintegrand);CHKERRQ(ierr); 338 } 339 /* When th->endpoint is true and th->Theta==1 (beuler method), the Jacobian is supposed to be evaluated at ts->ptime like this: 340 if(th->endpoint) { 341 ierr = TSComputeIJacobian(ts,ts->ptime,ts->vec_sol,th->Xdot,shift,J,Jp,PETSC_FALSE);CHKERRQ(ierr); 342 } 343 but ts->ptime and ts->vec_sol have the same values as th->stage_time and th->X in this case. So the code is simplified here. 344 */ 345 for (nadj=0; nadj<ts->numberadjs; nadj++) { 346 ierr = MatMultTranspose(J,VecDeltaLam[nadj],VecSensiTemp[nadj]);CHKERRQ(ierr); 347 ierr = VecAXPY(ts->vecs_sensi[nadj],ts->time_step,VecSensiTemp[nadj]);CHKERRQ(ierr); 348 if (ts->vec_costquad) { 349 ierr = VecAXPY(ts->vecs_sensi[nadj],-ts->time_step,ts->vecs_drdy[nadj]);CHKERRQ(ierr); 350 } 351 } 352 if (ts->vecs_sensip) { 353 ierr = TSAdjointComputeRHSJacobianP(ts,th->stage_time,th->X,ts->Jacp);CHKERRQ(ierr); 354 for (nadj=0; nadj<ts->numberadjs; nadj++) { 355 ierr = MatMultTranspose(ts->Jacp,VecDeltaLam[nadj],VecDeltaMu[nadj]);CHKERRQ(ierr); 356 ierr = VecAXPY(ts->vecs_sensip[nadj],-ts->time_step,VecDeltaMu[nadj]);CHKERRQ(ierr); 357 } 358 if (ts->vec_costquad) { 359 ierr = TSAdjointComputeDRDPFunction(ts,th->stage_time,th->X,ts->vecs_drdp);CHKERRQ(ierr); 360 for (nadj=0; nadj<ts->numberadjs; nadj++) { 361 ierr = VecAXPY(ts->vecs_sensip[nadj],-ts->time_step,ts->vecs_drdp[nadj]);CHKERRQ(ierr); 362 } 363 } 364 } 365 } 366 367 ts->ptime += ts->time_step; 368 ts->steps++; 369 th->status = TS_STEP_COMPLETE; 370 PetscFunctionReturn(0); 371 } 372 373 #undef __FUNCT__ 374 #define __FUNCT__ "TSInterpolate_Theta" 375 static PetscErrorCode TSInterpolate_Theta(TS ts,PetscReal t,Vec X) 376 { 377 TS_Theta *th = (TS_Theta*)ts->data; 378 PetscReal alpha = t - ts->ptime; 379 PetscErrorCode ierr; 380 381 PetscFunctionBegin; 382 ierr = VecCopy(ts->vec_sol,th->X);CHKERRQ(ierr); 383 if (th->endpoint) alpha *= th->Theta; 384 ierr = VecWAXPY(X,alpha,th->Xdot,th->X);CHKERRQ(ierr); 385 PetscFunctionReturn(0); 386 } 387 388 /*------------------------------------------------------------*/ 389 #undef __FUNCT__ 390 #define __FUNCT__ "TSReset_Theta" 391 static PetscErrorCode TSReset_Theta(TS ts) 392 { 393 TS_Theta *th = (TS_Theta*)ts->data; 394 PetscErrorCode ierr; 395 396 PetscFunctionBegin; 397 ierr = VecDestroy(&th->X);CHKERRQ(ierr); 398 ierr = VecDestroy(&th->Xdot);CHKERRQ(ierr); 399 ierr = VecDestroy(&th->X0);CHKERRQ(ierr); 400 ierr = VecDestroy(&th->affine);CHKERRQ(ierr); 401 if(ts->reverse_mode) { 402 ierr = VecDestroyVecs(ts->numberadjs,&th->VecDeltaLam);CHKERRQ(ierr); 403 if(th->VecDeltaMu) { 404 ierr = VecDestroyVecs(ts->numberadjs,&th->VecDeltaMu);CHKERRQ(ierr); 405 } 406 ierr = VecDestroyVecs(ts->numberadjs,&th->VecSensiTemp);CHKERRQ(ierr); 407 } 408 PetscFunctionReturn(0); 409 } 410 411 #undef __FUNCT__ 412 #define __FUNCT__ "TSDestroy_Theta" 413 static PetscErrorCode TSDestroy_Theta(TS ts) 414 { 415 PetscErrorCode ierr; 416 417 PetscFunctionBegin; 418 ierr = TSReset_Theta(ts);CHKERRQ(ierr); 419 ierr = PetscFree(ts->data);CHKERRQ(ierr); 420 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetTheta_C",NULL);CHKERRQ(ierr); 421 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetTheta_C",NULL);CHKERRQ(ierr); 422 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetEndpoint_C",NULL);CHKERRQ(ierr); 423 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetEndpoint_C",NULL);CHKERRQ(ierr); 424 PetscFunctionReturn(0); 425 } 426 427 /* 428 This defines the nonlinear equation that is to be solved with SNES 429 G(U) = F[t0+Theta*dt, U, (U-U0)*shift] = 0 430 */ 431 #undef __FUNCT__ 432 #define __FUNCT__ "SNESTSFormFunction_Theta" 433 static PetscErrorCode SNESTSFormFunction_Theta(SNES snes,Vec x,Vec y,TS ts) 434 { 435 TS_Theta *th = (TS_Theta*)ts->data; 436 PetscErrorCode ierr; 437 Vec X0,Xdot; 438 DM dm,dmsave; 439 PetscReal shift = 1./(th->Theta*ts->time_step); 440 441 PetscFunctionBegin; 442 ierr = SNESGetDM(snes,&dm);CHKERRQ(ierr); 443 /* When using the endpoint variant, this is actually 1/Theta * Xdot */ 444 ierr = TSThetaGetX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 445 ierr = VecAXPBYPCZ(Xdot,-shift,shift,0,X0,x);CHKERRQ(ierr); 446 447 /* DM monkey-business allows user code to call TSGetDM() inside of functions evaluated on levels of FAS */ 448 dmsave = ts->dm; 449 ts->dm = dm; 450 ierr = TSComputeIFunction(ts,th->stage_time,x,Xdot,y,PETSC_FALSE);CHKERRQ(ierr); 451 ts->dm = dmsave; 452 ierr = TSThetaRestoreX0AndXdot(ts,dm,&X0,&Xdot);CHKERRQ(ierr); 453 PetscFunctionReturn(0); 454 } 455 456 #undef __FUNCT__ 457 #define __FUNCT__ "SNESTSFormJacobian_Theta" 458 static PetscErrorCode SNESTSFormJacobian_Theta(SNES snes,Vec x,Mat A,Mat B,TS ts) 459 { 460 TS_Theta *th = (TS_Theta*)ts->data; 461 PetscErrorCode ierr; 462 Vec Xdot; 463 DM dm,dmsave; 464 PetscReal shift = 1./(th->Theta*ts->time_step); 465 466 PetscFunctionBegin; 467 ierr = SNESGetDM(snes,&dm);CHKERRQ(ierr); 468 469 /* th->Xdot has already been computed in SNESTSFormFunction_Theta (SNES guarantees this) */ 470 ierr = TSThetaGetX0AndXdot(ts,dm,NULL,&Xdot);CHKERRQ(ierr); 471 472 dmsave = ts->dm; 473 ts->dm = dm; 474 ierr = TSComputeIJacobian(ts,th->stage_time,x,Xdot,shift,A,B,PETSC_FALSE);CHKERRQ(ierr); 475 ts->dm = dmsave; 476 ierr = TSThetaRestoreX0AndXdot(ts,dm,NULL,&Xdot);CHKERRQ(ierr); 477 PetscFunctionReturn(0); 478 } 479 480 #undef __FUNCT__ 481 #define __FUNCT__ "TSSetUp_Theta" 482 static PetscErrorCode TSSetUp_Theta(TS ts) 483 { 484 TS_Theta *th = (TS_Theta*)ts->data; 485 PetscErrorCode ierr; 486 SNES snes; 487 TSAdapt adapt; 488 DM dm; 489 490 PetscFunctionBegin; 491 if (!th->X) { 492 ierr = VecDuplicate(ts->vec_sol,&th->X);CHKERRQ(ierr); 493 } 494 if (!th->Xdot) { 495 ierr = VecDuplicate(ts->vec_sol,&th->Xdot);CHKERRQ(ierr); 496 } 497 if (!th->X0) { 498 ierr = VecDuplicate(ts->vec_sol,&th->X0);CHKERRQ(ierr); 499 } 500 ierr = TSGetSNES(ts,&snes);CHKERRQ(ierr); 501 ierr = TSGetDM(ts,&dm);CHKERRQ(ierr); 502 if (dm) { 503 ierr = DMCoarsenHookAdd(dm,DMCoarsenHook_TSTheta,DMRestrictHook_TSTheta,ts);CHKERRQ(ierr); 504 ierr = DMSubDomainHookAdd(dm,DMSubDomainHook_TSTheta,DMSubDomainRestrictHook_TSTheta,ts);CHKERRQ(ierr); 505 } 506 if (th->Theta == 0.5 && th->endpoint) th->order = 2; 507 else th->order = 1; 508 509 ierr = TSGetAdapt(ts,&adapt);CHKERRQ(ierr); 510 if (!th->adapt) { 511 ierr = TSAdaptSetType(adapt,TSADAPTNONE);CHKERRQ(ierr); 512 } 513 PetscFunctionReturn(0); 514 } 515 /*------------------------------------------------------------*/ 516 517 #undef __FUNCT__ 518 #define __FUNCT__ "TSAdjointSetUp_Theta" 519 static PetscErrorCode TSAdjointSetUp_Theta(TS ts) 520 { 521 TS_Theta *th = (TS_Theta*)ts->data; 522 PetscErrorCode ierr; 523 524 PetscFunctionBegin; 525 ierr = VecDuplicateVecs(ts->vecs_sensi[0],ts->numberadjs,&th->VecDeltaLam);CHKERRQ(ierr); 526 if(ts->vecs_sensip) { 527 ierr = VecDuplicateVecs(ts->vecs_sensip[0],ts->numberadjs,&th->VecDeltaMu);CHKERRQ(ierr); 528 } 529 ierr = VecDuplicateVecs(ts->vecs_sensi[0],ts->numberadjs,&th->VecSensiTemp);CHKERRQ(ierr); 530 PetscFunctionReturn(0); 531 } 532 /*------------------------------------------------------------*/ 533 534 #undef __FUNCT__ 535 #define __FUNCT__ "TSSetFromOptions_Theta" 536 static PetscErrorCode TSSetFromOptions_Theta(PetscOptions *PetscOptionsObject,TS ts) 537 { 538 TS_Theta *th = (TS_Theta*)ts->data; 539 PetscErrorCode ierr; 540 541 PetscFunctionBegin; 542 ierr = PetscOptionsHead(PetscOptionsObject,"Theta ODE solver options");CHKERRQ(ierr); 543 { 544 ierr = PetscOptionsReal("-ts_theta_theta","Location of stage (0<Theta<=1)","TSThetaSetTheta",th->Theta,&th->Theta,NULL);CHKERRQ(ierr); 545 ierr = PetscOptionsBool("-ts_theta_extrapolate","Extrapolate stage solution from previous solution (sometimes unstable)","TSThetaSetExtrapolate",th->extrapolate,&th->extrapolate,NULL);CHKERRQ(ierr); 546 ierr = PetscOptionsBool("-ts_theta_endpoint","Use the endpoint instead of midpoint form of the Theta method","TSThetaSetEndpoint",th->endpoint,&th->endpoint,NULL);CHKERRQ(ierr); 547 ierr = PetscOptionsBool("-ts_theta_adapt","Use time-step adaptivity with the Theta method","",th->adapt,&th->adapt,NULL);CHKERRQ(ierr); 548 ierr = SNESSetFromOptions(ts->snes);CHKERRQ(ierr); 549 } 550 ierr = PetscOptionsTail();CHKERRQ(ierr); 551 PetscFunctionReturn(0); 552 } 553 554 #undef __FUNCT__ 555 #define __FUNCT__ "TSView_Theta" 556 static PetscErrorCode TSView_Theta(TS ts,PetscViewer viewer) 557 { 558 TS_Theta *th = (TS_Theta*)ts->data; 559 PetscBool iascii; 560 PetscErrorCode ierr; 561 562 PetscFunctionBegin; 563 ierr = PetscObjectTypeCompare((PetscObject)viewer,PETSCVIEWERASCII,&iascii);CHKERRQ(ierr); 564 if (iascii) { 565 ierr = PetscViewerASCIIPrintf(viewer," Theta=%g\n",(double)th->Theta);CHKERRQ(ierr); 566 ierr = PetscViewerASCIIPrintf(viewer," Extrapolation=%s\n",th->extrapolate ? "yes" : "no");CHKERRQ(ierr); 567 } 568 if (ts->snes) {ierr = SNESView(ts->snes,viewer);CHKERRQ(ierr);} 569 PetscFunctionReturn(0); 570 } 571 572 #undef __FUNCT__ 573 #define __FUNCT__ "TSThetaGetTheta_Theta" 574 PetscErrorCode TSThetaGetTheta_Theta(TS ts,PetscReal *theta) 575 { 576 TS_Theta *th = (TS_Theta*)ts->data; 577 578 PetscFunctionBegin; 579 *theta = th->Theta; 580 PetscFunctionReturn(0); 581 } 582 583 #undef __FUNCT__ 584 #define __FUNCT__ "TSThetaSetTheta_Theta" 585 PetscErrorCode TSThetaSetTheta_Theta(TS ts,PetscReal theta) 586 { 587 TS_Theta *th = (TS_Theta*)ts->data; 588 589 PetscFunctionBegin; 590 if (theta <= 0 || 1 < theta) SETERRQ1(PetscObjectComm((PetscObject)ts),PETSC_ERR_ARG_OUTOFRANGE,"Theta %g not in range (0,1]",(double)theta); 591 th->Theta = theta; 592 PetscFunctionReturn(0); 593 } 594 595 #undef __FUNCT__ 596 #define __FUNCT__ "TSThetaGetEndpoint_Theta" 597 PetscErrorCode TSThetaGetEndpoint_Theta(TS ts,PetscBool *endpoint) 598 { 599 TS_Theta *th = (TS_Theta*)ts->data; 600 601 PetscFunctionBegin; 602 *endpoint = th->endpoint; 603 PetscFunctionReturn(0); 604 } 605 606 #undef __FUNCT__ 607 #define __FUNCT__ "TSThetaSetEndpoint_Theta" 608 PetscErrorCode TSThetaSetEndpoint_Theta(TS ts,PetscBool flg) 609 { 610 TS_Theta *th = (TS_Theta*)ts->data; 611 612 PetscFunctionBegin; 613 th->endpoint = flg; 614 PetscFunctionReturn(0); 615 } 616 617 #if defined(PETSC_HAVE_COMPLEX) 618 #undef __FUNCT__ 619 #define __FUNCT__ "TSComputeLinearStability_Theta" 620 static PetscErrorCode TSComputeLinearStability_Theta(TS ts,PetscReal xr,PetscReal xi,PetscReal *yr,PetscReal *yi) 621 { 622 PetscComplex z = xr + xi*PETSC_i,f; 623 TS_Theta *th = (TS_Theta*)ts->data; 624 const PetscReal one = 1.0; 625 626 PetscFunctionBegin; 627 f = (one + (one - th->Theta)*z)/(one - th->Theta*z); 628 *yr = PetscRealPartComplex(f); 629 *yi = PetscImaginaryPartComplex(f); 630 PetscFunctionReturn(0); 631 } 632 #endif 633 634 #undef __FUNCT__ 635 #define __FUNCT__ "TSGetStages_Theta" 636 static PetscErrorCode TSGetStages_Theta(TS ts,PetscInt *ns,Vec **Y) 637 { 638 TS_Theta *th = (TS_Theta*)ts->data; 639 640 PetscFunctionBegin; 641 *ns = 1; 642 if(Y) { 643 *Y = &(th->X); 644 } 645 PetscFunctionReturn(0); 646 } 647 648 /* ------------------------------------------------------------ */ 649 /*MC 650 TSTHETA - DAE solver using the implicit Theta method 651 652 Level: beginner 653 654 Options Database: 655 -ts_theta_theta <Theta> - Location of stage (0<Theta<=1) 656 -ts_theta_extrapolate <flg> Extrapolate stage solution from previous solution (sometimes unstable) 657 -ts_theta_endpoint <flag> - Use the endpoint (like Crank-Nicholson) instead of midpoint form of the Theta method 658 659 Notes: 660 $ -ts_type theta -ts_theta_theta 1.0 corresponds to backward Euler (TSBEULER) 661 $ -ts_type theta -ts_theta_theta 0.5 corresponds to the implicit midpoint rule 662 $ -ts_type theta -ts_theta_theta 0.5 -ts_theta_endpoint corresponds to Crank-Nicholson (TSCN) 663 664 665 666 This method can be applied to DAE. 667 668 This method is cast as a 1-stage implicit Runge-Kutta method. 669 670 .vb 671 Theta | Theta 672 ------------- 673 | 1 674 .ve 675 676 For the default Theta=0.5, this is also known as the implicit midpoint rule. 677 678 When the endpoint variant is chosen, the method becomes a 2-stage method with first stage explicit: 679 680 .vb 681 0 | 0 0 682 1 | 1-Theta Theta 683 ------------------- 684 | 1-Theta Theta 685 .ve 686 687 For the default Theta=0.5, this is the trapezoid rule (also known as Crank-Nicolson, see TSCN). 688 689 To apply a diagonally implicit RK method to DAE, the stage formula 690 691 $ Y_i = X + h sum_j a_ij Y'_j 692 693 is interpreted as a formula for Y'_i in terms of Y_i and known values (Y'_j, j<i) 694 695 .seealso: TSCreate(), TS, TSSetType(), TSCN, TSBEULER, TSThetaSetTheta(), TSThetaSetEndpoint() 696 697 M*/ 698 #undef __FUNCT__ 699 #define __FUNCT__ "TSCreate_Theta" 700 PETSC_EXTERN PetscErrorCode TSCreate_Theta(TS ts) 701 { 702 TS_Theta *th; 703 PetscErrorCode ierr; 704 705 PetscFunctionBegin; 706 ts->ops->reset = TSReset_Theta; 707 ts->ops->destroy = TSDestroy_Theta; 708 ts->ops->view = TSView_Theta; 709 ts->ops->setup = TSSetUp_Theta; 710 ts->ops->setupadj = TSAdjointSetUp_Theta; 711 ts->ops->step = TSStep_Theta; 712 ts->ops->interpolate = TSInterpolate_Theta; 713 ts->ops->evaluatestep = TSEvaluateStep_Theta; 714 ts->ops->rollback = TSRollBack_Theta; 715 ts->ops->setfromoptions = TSSetFromOptions_Theta; 716 ts->ops->snesfunction = SNESTSFormFunction_Theta; 717 ts->ops->snesjacobian = SNESTSFormJacobian_Theta; 718 #if defined(PETSC_HAVE_COMPLEX) 719 ts->ops->linearstability = TSComputeLinearStability_Theta; 720 #endif 721 ts->ops->getstages = TSGetStages_Theta; 722 ts->ops->stepadj = TSStepAdj_Theta; 723 724 ierr = PetscNewLog(ts,&th);CHKERRQ(ierr); 725 ts->data = (void*)th; 726 727 th->extrapolate = PETSC_FALSE; 728 th->Theta = 0.5; 729 th->ccfl = 1.0; 730 th->adapt = PETSC_FALSE; 731 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetTheta_C",TSThetaGetTheta_Theta);CHKERRQ(ierr); 732 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetTheta_C",TSThetaSetTheta_Theta);CHKERRQ(ierr); 733 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaGetEndpoint_C",TSThetaGetEndpoint_Theta);CHKERRQ(ierr); 734 ierr = PetscObjectComposeFunction((PetscObject)ts,"TSThetaSetEndpoint_C",TSThetaSetEndpoint_Theta);CHKERRQ(ierr); 735 PetscFunctionReturn(0); 736 } 737 738 #undef __FUNCT__ 739 #define __FUNCT__ "TSThetaGetTheta" 740 /*@ 741 TSThetaGetTheta - Get the abscissa of the stage in (0,1]. 742 743 Not Collective 744 745 Input Parameter: 746 . ts - timestepping context 747 748 Output Parameter: 749 . theta - stage abscissa 750 751 Note: 752 Use of this function is normally only required to hack TSTHETA to use a modified integration scheme. 753 754 Level: Advanced 755 756 .seealso: TSThetaSetTheta() 757 @*/ 758 PetscErrorCode TSThetaGetTheta(TS ts,PetscReal *theta) 759 { 760 PetscErrorCode ierr; 761 762 PetscFunctionBegin; 763 PetscValidHeaderSpecific(ts,TS_CLASSID,1); 764 PetscValidPointer(theta,2); 765 ierr = PetscUseMethod(ts,"TSThetaGetTheta_C",(TS,PetscReal*),(ts,theta));CHKERRQ(ierr); 766 PetscFunctionReturn(0); 767 } 768 769 #undef __FUNCT__ 770 #define __FUNCT__ "TSThetaSetTheta" 771 /*@ 772 TSThetaSetTheta - Set the abscissa of the stage in (0,1]. 773 774 Not Collective 775 776 Input Parameter: 777 + ts - timestepping context 778 - theta - stage abscissa 779 780 Options Database: 781 . -ts_theta_theta <theta> 782 783 Level: Intermediate 784 785 .seealso: TSThetaGetTheta() 786 @*/ 787 PetscErrorCode TSThetaSetTheta(TS ts,PetscReal theta) 788 { 789 PetscErrorCode ierr; 790 791 PetscFunctionBegin; 792 PetscValidHeaderSpecific(ts,TS_CLASSID,1); 793 ierr = PetscTryMethod(ts,"TSThetaSetTheta_C",(TS,PetscReal),(ts,theta));CHKERRQ(ierr); 794 PetscFunctionReturn(0); 795 } 796 797 #undef __FUNCT__ 798 #define __FUNCT__ "TSThetaGetEndpoint" 799 /*@ 800 TSThetaGetEndpoint - Gets whether to use the endpoint variant of the method (e.g. trapezoid/Crank-Nicolson instead of midpoint rule). 801 802 Not Collective 803 804 Input Parameter: 805 . ts - timestepping context 806 807 Output Parameter: 808 . endpoint - PETSC_TRUE when using the endpoint variant 809 810 Level: Advanced 811 812 .seealso: TSThetaSetEndpoint(), TSTHETA, TSCN 813 @*/ 814 PetscErrorCode TSThetaGetEndpoint(TS ts,PetscBool *endpoint) 815 { 816 PetscErrorCode ierr; 817 818 PetscFunctionBegin; 819 PetscValidHeaderSpecific(ts,TS_CLASSID,1); 820 PetscValidPointer(endpoint,2); 821 ierr = PetscTryMethod(ts,"TSThetaGetEndpoint_C",(TS,PetscBool*),(ts,endpoint));CHKERRQ(ierr); 822 PetscFunctionReturn(0); 823 } 824 825 #undef __FUNCT__ 826 #define __FUNCT__ "TSThetaSetEndpoint" 827 /*@ 828 TSThetaSetEndpoint - Sets whether to use the endpoint variant of the method (e.g. trapezoid/Crank-Nicolson instead of midpoint rule). 829 830 Not Collective 831 832 Input Parameter: 833 + ts - timestepping context 834 - flg - PETSC_TRUE to use the endpoint variant 835 836 Options Database: 837 . -ts_theta_endpoint <flg> 838 839 Level: Intermediate 840 841 .seealso: TSTHETA, TSCN 842 @*/ 843 PetscErrorCode TSThetaSetEndpoint(TS ts,PetscBool flg) 844 { 845 PetscErrorCode ierr; 846 847 PetscFunctionBegin; 848 PetscValidHeaderSpecific(ts,TS_CLASSID,1); 849 ierr = PetscTryMethod(ts,"TSThetaSetEndpoint_C",(TS,PetscBool),(ts,flg));CHKERRQ(ierr); 850 PetscFunctionReturn(0); 851 } 852 853 /* 854 * TSBEULER and TSCN are straightforward specializations of TSTHETA. 855 * The creation functions for these specializations are below. 856 */ 857 858 #undef __FUNCT__ 859 #define __FUNCT__ "TSView_BEuler" 860 static PetscErrorCode TSView_BEuler(TS ts,PetscViewer viewer) 861 { 862 PetscErrorCode ierr; 863 864 PetscFunctionBegin; 865 ierr = SNESView(ts->snes,viewer);CHKERRQ(ierr); 866 PetscFunctionReturn(0); 867 } 868 869 /*MC 870 TSBEULER - ODE solver using the implicit backward Euler method 871 872 Level: beginner 873 874 Notes: 875 TSBEULER is equivalent to TSTHETA with Theta=1.0 876 877 $ -ts_type theta -ts_theta_theta 1. 878 879 .seealso: TSCreate(), TS, TSSetType(), TSEULER, TSCN, TSTHETA 880 881 M*/ 882 #undef __FUNCT__ 883 #define __FUNCT__ "TSCreate_BEuler" 884 PETSC_EXTERN PetscErrorCode TSCreate_BEuler(TS ts) 885 { 886 PetscErrorCode ierr; 887 888 PetscFunctionBegin; 889 ierr = TSCreate_Theta(ts);CHKERRQ(ierr); 890 ierr = TSThetaSetTheta(ts,1.0);CHKERRQ(ierr); 891 ts->ops->view = TSView_BEuler; 892 PetscFunctionReturn(0); 893 } 894 895 #undef __FUNCT__ 896 #define __FUNCT__ "TSView_CN" 897 static PetscErrorCode TSView_CN(TS ts,PetscViewer viewer) 898 { 899 PetscErrorCode ierr; 900 901 PetscFunctionBegin; 902 ierr = SNESView(ts->snes,viewer);CHKERRQ(ierr); 903 PetscFunctionReturn(0); 904 } 905 906 /*MC 907 TSCN - ODE solver using the implicit Crank-Nicolson method. 908 909 Level: beginner 910 911 Notes: 912 TSCN is equivalent to TSTHETA with Theta=0.5 and the "endpoint" option set. I.e. 913 914 $ -ts_type theta -ts_theta_theta 0.5 -ts_theta_endpoint 915 916 .seealso: TSCreate(), TS, TSSetType(), TSBEULER, TSTHETA 917 918 M*/ 919 #undef __FUNCT__ 920 #define __FUNCT__ "TSCreate_CN" 921 PETSC_EXTERN PetscErrorCode TSCreate_CN(TS ts) 922 { 923 PetscErrorCode ierr; 924 925 PetscFunctionBegin; 926 ierr = TSCreate_Theta(ts);CHKERRQ(ierr); 927 ierr = TSThetaSetTheta(ts,0.5);CHKERRQ(ierr); 928 ierr = TSThetaSetEndpoint(ts,PETSC_TRUE);CHKERRQ(ierr); 929 ts->ops->view = TSView_CN; 930 PetscFunctionReturn(0); 931 } 932