1 /* 2 Code for timestepping with implicit Runge-Kutta method 3 4 Notes: 5 The general system is written as 6 7 F(t,U,Udot) = 0 8 9 */ 10 #include <petsc/private/tsimpl.h> /*I "petscts.h" I*/ 11 #include <petscdm.h> 12 #include <petscdt.h> 13 14 static TSIRKType TSIRKDefault = TSIRKGAUSS; 15 static PetscBool TSIRKRegisterAllCalled; 16 static PetscBool TSIRKPackageInitialized; 17 static PetscFunctionList TSIRKList; 18 19 struct _IRKTableau { 20 PetscReal *A, *b, *c; 21 PetscScalar *A_inv, *A_inv_rowsum, *I_s; 22 PetscReal *binterp; /* Dense output formula */ 23 }; 24 25 typedef struct _IRKTableau *IRKTableau; 26 27 typedef struct { 28 char *method_name; 29 PetscInt order; /* Classical approximation order of the method */ 30 PetscInt nstages; /* Number of stages */ 31 PetscBool stiffly_accurate; 32 PetscInt pinterp; /* Interpolation order */ 33 IRKTableau tableau; 34 Vec U0; /* Backup vector */ 35 Vec Z; /* Combined stage vector */ 36 Vec *Y; /* States computed during the step */ 37 Vec Ydot; /* Work vector holding time derivatives during residual evaluation */ 38 Vec U; /* U is used to compute Ydot = shift(Y-U) */ 39 Vec *YdotI; /* Work vectors to hold the residual evaluation */ 40 Mat TJ; /* KAIJ matrix for the Jacobian of the combined system */ 41 PetscScalar *work; /* Scalar work */ 42 TSStepStatus status; 43 PetscBool rebuild_completion; 44 PetscReal ccfl; 45 } TS_IRK; 46 47 /*@C 48 TSIRKTableauCreate - create the tableau for `TSIRK` and provide the entries 49 50 Not Collective 51 52 Input Parameters: 53 + ts - timestepping context 54 . nstages - number of stages, this is the dimension of the matrices below 55 . A - stage coefficients (dimension nstages*nstages, row-major) 56 . b - step completion table (dimension nstages) 57 . c - abscissa (dimension nstages) 58 . binterp - coefficients of the interpolation formula (dimension nstages) 59 . A_inv - inverse of A (dimension nstages*nstages, row-major) 60 . A_inv_rowsum - row sum of the inverse of A (dimension nstages) 61 - I_s - identity matrix (dimension nstages*nstages) 62 63 Level: advanced 64 65 .seealso: [](ch_ts), `TSIRK`, `TSIRKRegister()` 66 @*/ 67 PetscErrorCode TSIRKTableauCreate(TS ts, PetscInt nstages, const PetscReal *A, const PetscReal *b, const PetscReal *c, const PetscReal *binterp, const PetscScalar *A_inv, const PetscScalar *A_inv_rowsum, const PetscScalar *I_s) 68 { 69 TS_IRK *irk = (TS_IRK *)ts->data; 70 IRKTableau tab = irk->tableau; 71 72 PetscFunctionBegin; 73 irk->order = nstages; 74 PetscCall(PetscMalloc3(PetscSqr(nstages), &tab->A, PetscSqr(nstages), &tab->A_inv, PetscSqr(nstages), &tab->I_s)); 75 PetscCall(PetscMalloc4(nstages, &tab->b, nstages, &tab->c, nstages, &tab->binterp, nstages, &tab->A_inv_rowsum)); 76 PetscCall(PetscArraycpy(tab->A, A, PetscSqr(nstages))); 77 PetscCall(PetscArraycpy(tab->b, b, nstages)); 78 PetscCall(PetscArraycpy(tab->c, c, nstages)); 79 /* optional coefficient arrays */ 80 if (binterp) PetscCall(PetscArraycpy(tab->binterp, binterp, nstages)); 81 if (A_inv) PetscCall(PetscArraycpy(tab->A_inv, A_inv, PetscSqr(nstages))); 82 if (A_inv_rowsum) PetscCall(PetscArraycpy(tab->A_inv_rowsum, A_inv_rowsum, nstages)); 83 if (I_s) PetscCall(PetscArraycpy(tab->I_s, I_s, PetscSqr(nstages))); 84 PetscFunctionReturn(PETSC_SUCCESS); 85 } 86 87 /* Arrays should be freed with PetscFree3(A,b,c) */ 88 static PetscErrorCode TSIRKCreate_Gauss(TS ts) 89 { 90 PetscInt nstages; 91 PetscReal *gauss_A_real, *gauss_b, *b, *gauss_c; 92 PetscScalar *gauss_A, *gauss_A_inv, *gauss_A_inv_rowsum, *I_s; 93 PetscScalar *G0, *G1; 94 PetscInt i, j; 95 Mat G0mat, G1mat, Amat; 96 97 PetscFunctionBegin; 98 PetscCall(TSIRKGetNumStages(ts, &nstages)); 99 PetscCall(PetscMalloc3(PetscSqr(nstages), &gauss_A_real, nstages, &gauss_b, nstages, &gauss_c)); 100 PetscCall(PetscMalloc4(PetscSqr(nstages), &gauss_A, PetscSqr(nstages), &gauss_A_inv, nstages, &gauss_A_inv_rowsum, PetscSqr(nstages), &I_s)); 101 PetscCall(PetscMalloc3(nstages, &b, PetscSqr(nstages), &G0, PetscSqr(nstages), &G1)); 102 PetscCall(PetscDTGaussQuadrature(nstages, 0., 1., gauss_c, b)); 103 for (i = 0; i < nstages; i++) gauss_b[i] = b[i]; /* copy to possibly-complex array */ 104 105 /* A^T = G0^{-1} G1 */ 106 for (i = 0; i < nstages; i++) { 107 for (j = 0; j < nstages; j++) { 108 G0[i * nstages + j] = PetscPowRealInt(gauss_c[i], j); 109 G1[i * nstages + j] = PetscPowRealInt(gauss_c[i], j + 1) / (j + 1); 110 } 111 } 112 /* The arrays above are row-aligned, but we create dense matrices as the transpose */ 113 PetscCall(MatCreateSeqDense(PETSC_COMM_SELF, nstages, nstages, G0, &G0mat)); 114 PetscCall(MatCreateSeqDense(PETSC_COMM_SELF, nstages, nstages, G1, &G1mat)); 115 PetscCall(MatCreateSeqDense(PETSC_COMM_SELF, nstages, nstages, gauss_A, &Amat)); 116 PetscCall(MatLUFactor(G0mat, NULL, NULL, NULL)); 117 PetscCall(MatMatSolve(G0mat, G1mat, Amat)); 118 PetscCall(MatTranspose(Amat, MAT_INPLACE_MATRIX, &Amat)); 119 for (i = 0; i < nstages; i++) 120 for (j = 0; j < nstages; j++) gauss_A_real[i * nstages + j] = PetscRealPart(gauss_A[i * nstages + j]); 121 122 PetscCall(MatDestroy(&G0mat)); 123 PetscCall(MatDestroy(&G1mat)); 124 PetscCall(MatDestroy(&Amat)); 125 PetscCall(PetscFree3(b, G0, G1)); 126 127 { /* Invert A */ 128 /* PETSc does not provide a routine to calculate the inverse of a general matrix. 129 * To get the inverse of A, we form a sequential BAIJ matrix from it, consisting of a single block with block size 130 * equal to the dimension of A, and then use MatInvertBlockDiagonal(). */ 131 Mat A_baij; 132 PetscInt idxm[1] = {0}, idxn[1] = {0}; 133 const PetscScalar *A_inv; 134 135 PetscCall(MatCreateSeqBAIJ(PETSC_COMM_SELF, nstages, nstages, nstages, 1, NULL, &A_baij)); 136 PetscCall(MatSetOption(A_baij, MAT_ROW_ORIENTED, PETSC_FALSE)); 137 PetscCall(MatSetValuesBlocked(A_baij, 1, idxm, 1, idxn, gauss_A, INSERT_VALUES)); 138 PetscCall(MatAssemblyBegin(A_baij, MAT_FINAL_ASSEMBLY)); 139 PetscCall(MatAssemblyEnd(A_baij, MAT_FINAL_ASSEMBLY)); 140 PetscCall(MatInvertBlockDiagonal(A_baij, &A_inv)); 141 PetscCall(PetscMemcpy(gauss_A_inv, A_inv, nstages * nstages * sizeof(PetscScalar))); 142 PetscCall(MatDestroy(&A_baij)); 143 } 144 145 /* Compute row sums A_inv_rowsum and identity I_s */ 146 for (i = 0; i < nstages; i++) { 147 gauss_A_inv_rowsum[i] = 0; 148 for (j = 0; j < nstages; j++) { 149 gauss_A_inv_rowsum[i] += gauss_A_inv[i + nstages * j]; 150 I_s[i + nstages * j] = 1. * (i == j); 151 } 152 } 153 PetscCall(TSIRKTableauCreate(ts, nstages, gauss_A_real, gauss_b, gauss_c, NULL, gauss_A_inv, gauss_A_inv_rowsum, I_s)); 154 PetscCall(PetscFree3(gauss_A_real, gauss_b, gauss_c)); 155 PetscCall(PetscFree4(gauss_A, gauss_A_inv, gauss_A_inv_rowsum, I_s)); 156 PetscFunctionReturn(PETSC_SUCCESS); 157 } 158 159 /*@C 160 TSIRKRegister - adds a `TSIRK` implementation 161 162 Not Collective, No Fortran Support 163 164 Input Parameters: 165 + sname - name of user-defined IRK scheme 166 - function - function to create method context 167 168 Level: advanced 169 170 Note: 171 `TSIRKRegister()` may be called multiple times to add several user-defined families. 172 173 Example Usage: 174 .vb 175 TSIRKRegister("my_scheme", MySchemeCreate); 176 .ve 177 178 Then, your scheme can be chosen with the procedural interface via 179 .vb 180 TSIRKSetType(ts, "my_scheme") 181 .ve 182 or at runtime via the option 183 .vb 184 -ts_irk_type my_scheme 185 .ve 186 187 .seealso: [](ch_ts), `TSIRK`, `TSIRKRegisterAll()` 188 @*/ 189 PetscErrorCode TSIRKRegister(const char sname[], PetscErrorCode (*function)(TS)) 190 { 191 PetscFunctionBegin; 192 PetscCall(TSIRKInitializePackage()); 193 PetscCall(PetscFunctionListAdd(&TSIRKList, sname, function)); 194 PetscFunctionReturn(PETSC_SUCCESS); 195 } 196 197 /*@C 198 TSIRKRegisterAll - Registers all of the implicit Runge-Kutta methods in `TSIRK` 199 200 Not Collective, but should be called by all processes which will need the schemes to be registered 201 202 Level: advanced 203 204 .seealso: [](ch_ts), `TSIRK`, `TSIRKRegisterDestroy()` 205 @*/ 206 PetscErrorCode TSIRKRegisterAll(void) 207 { 208 PetscFunctionBegin; 209 if (TSIRKRegisterAllCalled) PetscFunctionReturn(PETSC_SUCCESS); 210 TSIRKRegisterAllCalled = PETSC_TRUE; 211 212 PetscCall(TSIRKRegister(TSIRKGAUSS, TSIRKCreate_Gauss)); 213 PetscFunctionReturn(PETSC_SUCCESS); 214 } 215 216 /*@C 217 TSIRKRegisterDestroy - Frees the list of schemes that were registered by `TSIRKRegister()`. 218 219 Not Collective 220 221 Level: advanced 222 223 .seealso: [](ch_ts), `TSIRK`, `TSIRKRegister()`, `TSIRKRegisterAll()` 224 @*/ 225 PetscErrorCode TSIRKRegisterDestroy(void) 226 { 227 PetscFunctionBegin; 228 TSIRKRegisterAllCalled = PETSC_FALSE; 229 PetscFunctionReturn(PETSC_SUCCESS); 230 } 231 232 /*@C 233 TSIRKInitializePackage - This function initializes everything in the `TSIRK` package. It is called 234 from `TSInitializePackage()`. 235 236 Level: developer 237 238 .seealso: [](ch_ts), `TSIRK`, `PetscInitialize()`, `TSIRKFinalizePackage()`, `TSInitializePackage()` 239 @*/ 240 PetscErrorCode TSIRKInitializePackage(void) 241 { 242 PetscFunctionBegin; 243 if (TSIRKPackageInitialized) PetscFunctionReturn(PETSC_SUCCESS); 244 TSIRKPackageInitialized = PETSC_TRUE; 245 PetscCall(TSIRKRegisterAll()); 246 PetscCall(PetscRegisterFinalize(TSIRKFinalizePackage)); 247 PetscFunctionReturn(PETSC_SUCCESS); 248 } 249 250 /*@C 251 TSIRKFinalizePackage - This function destroys everything in the `TSIRK` package. It is 252 called from `PetscFinalize()`. 253 254 Level: developer 255 256 .seealso: [](ch_ts), `TSIRK`, `PetscFinalize()`, `TSInitializePackage()` 257 @*/ 258 PetscErrorCode TSIRKFinalizePackage(void) 259 { 260 PetscFunctionBegin; 261 PetscCall(PetscFunctionListDestroy(&TSIRKList)); 262 TSIRKPackageInitialized = PETSC_FALSE; 263 PetscFunctionReturn(PETSC_SUCCESS); 264 } 265 266 /* 267 This function can be called before or after ts->vec_sol has been updated. 268 */ 269 static PetscErrorCode TSEvaluateStep_IRK(TS ts, PetscInt order, Vec U, PetscBool *done) 270 { 271 TS_IRK *irk = (TS_IRK *)ts->data; 272 IRKTableau tab = irk->tableau; 273 Vec *YdotI = irk->YdotI; 274 PetscScalar *w = irk->work; 275 PetscReal h; 276 PetscInt j; 277 278 PetscFunctionBegin; 279 switch (irk->status) { 280 case TS_STEP_INCOMPLETE: 281 case TS_STEP_PENDING: 282 h = ts->time_step; 283 break; 284 case TS_STEP_COMPLETE: 285 h = ts->ptime - ts->ptime_prev; 286 break; 287 default: 288 SETERRQ(PetscObjectComm((PetscObject)ts), PETSC_ERR_PLIB, "Invalid TSStepStatus"); 289 } 290 291 PetscCall(VecCopy(ts->vec_sol, U)); 292 for (j = 0; j < irk->nstages; j++) w[j] = h * tab->b[j]; 293 PetscCall(VecMAXPY(U, irk->nstages, w, YdotI)); 294 PetscFunctionReturn(PETSC_SUCCESS); 295 } 296 297 static PetscErrorCode TSRollBack_IRK(TS ts) 298 { 299 TS_IRK *irk = (TS_IRK *)ts->data; 300 301 PetscFunctionBegin; 302 PetscCall(VecCopy(irk->U0, ts->vec_sol)); 303 PetscFunctionReturn(PETSC_SUCCESS); 304 } 305 306 static PetscErrorCode TSStep_IRK(TS ts) 307 { 308 TS_IRK *irk = (TS_IRK *)ts->data; 309 IRKTableau tab = irk->tableau; 310 PetscScalar *A_inv = tab->A_inv, *A_inv_rowsum = tab->A_inv_rowsum; 311 const PetscInt nstages = irk->nstages; 312 SNES snes; 313 PetscInt i, j, its, lits, bs; 314 TSAdapt adapt; 315 PetscInt rejections = 0; 316 PetscBool accept = PETSC_TRUE; 317 PetscReal next_time_step = ts->time_step; 318 319 PetscFunctionBegin; 320 if (!ts->steprollback) PetscCall(VecCopy(ts->vec_sol, irk->U0)); 321 PetscCall(VecGetBlockSize(ts->vec_sol, &bs)); 322 for (i = 0; i < nstages; i++) PetscCall(VecStrideScatter(ts->vec_sol, i * bs, irk->Z, INSERT_VALUES)); 323 324 irk->status = TS_STEP_INCOMPLETE; 325 while (!ts->reason && irk->status != TS_STEP_COMPLETE) { 326 PetscCall(VecCopy(ts->vec_sol, irk->U)); 327 PetscCall(TSGetSNES(ts, &snes)); 328 PetscCall(SNESSolve(snes, NULL, irk->Z)); 329 PetscCall(SNESGetIterationNumber(snes, &its)); 330 PetscCall(SNESGetLinearSolveIterations(snes, &lits)); 331 ts->snes_its += its; 332 ts->ksp_its += lits; 333 PetscCall(VecStrideGatherAll(irk->Z, irk->Y, INSERT_VALUES)); 334 for (i = 0; i < nstages; i++) { 335 PetscCall(VecZeroEntries(irk->YdotI[i])); 336 for (j = 0; j < nstages; j++) PetscCall(VecAXPY(irk->YdotI[i], A_inv[i + j * nstages] / ts->time_step, irk->Y[j])); 337 PetscCall(VecAXPY(irk->YdotI[i], -A_inv_rowsum[i] / ts->time_step, irk->U)); 338 } 339 irk->status = TS_STEP_INCOMPLETE; 340 PetscCall(TSEvaluateStep_IRK(ts, irk->order, ts->vec_sol, NULL)); 341 irk->status = TS_STEP_PENDING; 342 PetscCall(TSGetAdapt(ts, &adapt)); 343 PetscCall(TSAdaptChoose(adapt, ts, ts->time_step, NULL, &next_time_step, &accept)); 344 irk->status = accept ? TS_STEP_COMPLETE : TS_STEP_INCOMPLETE; 345 if (!accept) { 346 PetscCall(TSRollBack_IRK(ts)); 347 ts->time_step = next_time_step; 348 goto reject_step; 349 } 350 351 ts->ptime += ts->time_step; 352 ts->time_step = next_time_step; 353 break; 354 reject_step: 355 ts->reject++; 356 accept = PETSC_FALSE; 357 if (!ts->reason && ++rejections > ts->max_reject && ts->max_reject >= 0) { 358 ts->reason = TS_DIVERGED_STEP_REJECTED; 359 PetscCall(PetscInfo(ts, "Step=%" PetscInt_FMT ", step rejections %" PetscInt_FMT " greater than current TS allowed, stopping solve\n", ts->steps, rejections)); 360 } 361 } 362 PetscFunctionReturn(PETSC_SUCCESS); 363 } 364 365 static PetscErrorCode TSInterpolate_IRK(TS ts, PetscReal itime, Vec U) 366 { 367 TS_IRK *irk = (TS_IRK *)ts->data; 368 PetscInt nstages = irk->nstages, pinterp = irk->pinterp, i, j; 369 PetscReal h; 370 PetscReal tt, t; 371 PetscScalar *bt; 372 const PetscReal *B = irk->tableau->binterp; 373 374 PetscFunctionBegin; 375 PetscCheck(B, PetscObjectComm((PetscObject)ts), PETSC_ERR_SUP, "TSIRK %s does not have an interpolation formula", irk->method_name); 376 switch (irk->status) { 377 case TS_STEP_INCOMPLETE: 378 case TS_STEP_PENDING: 379 h = ts->time_step; 380 t = (itime - ts->ptime) / h; 381 break; 382 case TS_STEP_COMPLETE: 383 h = ts->ptime - ts->ptime_prev; 384 t = (itime - ts->ptime) / h + 1; /* In the interval [0,1] */ 385 break; 386 default: 387 SETERRQ(PetscObjectComm((PetscObject)ts), PETSC_ERR_PLIB, "Invalid TSStepStatus"); 388 } 389 PetscCall(PetscMalloc1(nstages, &bt)); 390 for (i = 0; i < nstages; i++) bt[i] = 0; 391 for (j = 0, tt = t; j < pinterp; j++, tt *= t) { 392 for (i = 0; i < nstages; i++) bt[i] += h * B[i * pinterp + j] * tt; 393 } 394 PetscCall(VecMAXPY(U, nstages, bt, irk->YdotI)); 395 PetscFunctionReturn(PETSC_SUCCESS); 396 } 397 398 static PetscErrorCode TSIRKTableauReset(TS ts) 399 { 400 TS_IRK *irk = (TS_IRK *)ts->data; 401 IRKTableau tab = irk->tableau; 402 403 PetscFunctionBegin; 404 if (!tab) PetscFunctionReturn(PETSC_SUCCESS); 405 PetscCall(PetscFree3(tab->A, tab->A_inv, tab->I_s)); 406 PetscCall(PetscFree4(tab->b, tab->c, tab->binterp, tab->A_inv_rowsum)); 407 PetscFunctionReturn(PETSC_SUCCESS); 408 } 409 410 static PetscErrorCode TSReset_IRK(TS ts) 411 { 412 TS_IRK *irk = (TS_IRK *)ts->data; 413 414 PetscFunctionBegin; 415 PetscCall(TSIRKTableauReset(ts)); 416 if (irk->tableau) PetscCall(PetscFree(irk->tableau)); 417 if (irk->method_name) PetscCall(PetscFree(irk->method_name)); 418 if (irk->work) PetscCall(PetscFree(irk->work)); 419 PetscCall(VecDestroyVecs(irk->nstages, &irk->Y)); 420 PetscCall(VecDestroyVecs(irk->nstages, &irk->YdotI)); 421 PetscCall(VecDestroy(&irk->Ydot)); 422 PetscCall(VecDestroy(&irk->Z)); 423 PetscCall(VecDestroy(&irk->U)); 424 PetscCall(VecDestroy(&irk->U0)); 425 PetscCall(MatDestroy(&irk->TJ)); 426 PetscFunctionReturn(PETSC_SUCCESS); 427 } 428 429 static PetscErrorCode TSIRKGetVecs(TS ts, DM dm, Vec *U) 430 { 431 TS_IRK *irk = (TS_IRK *)ts->data; 432 433 PetscFunctionBegin; 434 if (U) { 435 if (dm && dm != ts->dm) PetscCall(DMGetNamedGlobalVector(dm, "TSIRK_U", U)); 436 else *U = irk->U; 437 } 438 PetscFunctionReturn(PETSC_SUCCESS); 439 } 440 441 static PetscErrorCode TSIRKRestoreVecs(TS ts, DM dm, Vec *U) 442 { 443 PetscFunctionBegin; 444 if (U) { 445 if (dm && dm != ts->dm) PetscCall(DMRestoreNamedGlobalVector(dm, "TSIRK_U", U)); 446 } 447 PetscFunctionReturn(PETSC_SUCCESS); 448 } 449 450 /* 451 This defines the nonlinear equations that is to be solved with SNES 452 G[e\otimes t + C*dt, Z, Zdot] = 0 453 Zdot = (In \otimes S)*Z - (In \otimes Se) U 454 where S = 1/(dt*A) 455 */ 456 static PetscErrorCode SNESTSFormFunction_IRK(SNES snes, Vec ZC, Vec FC, TS ts) 457 { 458 TS_IRK *irk = (TS_IRK *)ts->data; 459 IRKTableau tab = irk->tableau; 460 const PetscInt nstages = irk->nstages; 461 const PetscReal *c = tab->c; 462 const PetscScalar *A_inv = tab->A_inv, *A_inv_rowsum = tab->A_inv_rowsum; 463 DM dm, dmsave; 464 Vec U, *YdotI = irk->YdotI, Ydot = irk->Ydot, *Y = irk->Y; 465 PetscReal h = ts->time_step; 466 PetscInt i, j; 467 468 PetscFunctionBegin; 469 PetscCall(SNESGetDM(snes, &dm)); 470 PetscCall(TSIRKGetVecs(ts, dm, &U)); 471 PetscCall(VecStrideGatherAll(ZC, Y, INSERT_VALUES)); 472 dmsave = ts->dm; 473 ts->dm = dm; 474 for (i = 0; i < nstages; i++) { 475 PetscCall(VecZeroEntries(Ydot)); 476 for (j = 0; j < nstages; j++) PetscCall(VecAXPY(Ydot, A_inv[j * nstages + i] / h, Y[j])); 477 PetscCall(VecAXPY(Ydot, -A_inv_rowsum[i] / h, U)); /* Ydot = (S \otimes In)*Z - (Se \otimes In) U */ 478 PetscCall(TSComputeIFunction(ts, ts->ptime + ts->time_step * c[i], Y[i], Ydot, YdotI[i], PETSC_FALSE)); 479 } 480 PetscCall(VecStrideScatterAll(YdotI, FC, INSERT_VALUES)); 481 ts->dm = dmsave; 482 PetscCall(TSIRKRestoreVecs(ts, dm, &U)); 483 PetscFunctionReturn(PETSC_SUCCESS); 484 } 485 486 /* 487 For explicit ODE, the Jacobian is 488 JC = I_n \otimes S - J \otimes I_s 489 For DAE, the Jacobian is 490 JC = M_n \otimes S - J \otimes I_s 491 */ 492 static PetscErrorCode SNESTSFormJacobian_IRK(SNES snes, Vec ZC, Mat JC, Mat JCpre, TS ts) 493 { 494 TS_IRK *irk = (TS_IRK *)ts->data; 495 IRKTableau tab = irk->tableau; 496 const PetscInt nstages = irk->nstages; 497 const PetscReal *c = tab->c; 498 DM dm, dmsave; 499 Vec *Y = irk->Y, Ydot = irk->Ydot; 500 Mat J; 501 PetscScalar *S; 502 PetscInt i, j, bs; 503 504 PetscFunctionBegin; 505 PetscCall(SNESGetDM(snes, &dm)); 506 /* irk->Ydot has already been computed in SNESTSFormFunction_IRK (SNES guarantees this) */ 507 dmsave = ts->dm; 508 ts->dm = dm; 509 PetscCall(VecGetBlockSize(Y[nstages - 1], &bs)); 510 PetscCheck(ts->equation_type <= TS_EQ_ODE_EXPLICIT, PetscObjectComm((PetscObject)ts), PETSC_ERR_SUP, "TSIRK %s does not support implicit formula", irk->method_name); /* TODO: need the mass matrix for DAE */ 511 /* Support explicit formulas only */ 512 PetscCall(VecStrideGather(ZC, (nstages - 1) * bs, Y[nstages - 1], INSERT_VALUES)); 513 PetscCall(MatKAIJGetAIJ(JC, &J)); 514 PetscCall(TSComputeIJacobian(ts, ts->ptime + ts->time_step * c[nstages - 1], Y[nstages - 1], Ydot, 0, J, J, PETSC_FALSE)); 515 PetscCall(MatKAIJGetS(JC, NULL, NULL, &S)); 516 for (i = 0; i < nstages; i++) 517 for (j = 0; j < nstages; j++) S[i + nstages * j] = tab->A_inv[i + nstages * j] / ts->time_step; 518 PetscCall(MatKAIJRestoreS(JC, &S)); 519 ts->dm = dmsave; 520 PetscFunctionReturn(PETSC_SUCCESS); 521 } 522 523 static PetscErrorCode DMCoarsenHook_TSIRK(DM fine, DM coarse, void *ctx) 524 { 525 PetscFunctionBegin; 526 PetscFunctionReturn(PETSC_SUCCESS); 527 } 528 529 static PetscErrorCode DMRestrictHook_TSIRK(DM fine, Mat restrct, Vec rscale, Mat inject, DM coarse, void *ctx) 530 { 531 TS ts = (TS)ctx; 532 Vec U, U_c; 533 534 PetscFunctionBegin; 535 PetscCall(TSIRKGetVecs(ts, fine, &U)); 536 PetscCall(TSIRKGetVecs(ts, coarse, &U_c)); 537 PetscCall(MatRestrict(restrct, U, U_c)); 538 PetscCall(VecPointwiseMult(U_c, rscale, U_c)); 539 PetscCall(TSIRKRestoreVecs(ts, fine, &U)); 540 PetscCall(TSIRKRestoreVecs(ts, coarse, &U_c)); 541 PetscFunctionReturn(PETSC_SUCCESS); 542 } 543 544 static PetscErrorCode DMSubDomainHook_TSIRK(DM dm, DM subdm, void *ctx) 545 { 546 PetscFunctionBegin; 547 PetscFunctionReturn(PETSC_SUCCESS); 548 } 549 550 static PetscErrorCode DMSubDomainRestrictHook_TSIRK(DM dm, VecScatter gscat, VecScatter lscat, DM subdm, void *ctx) 551 { 552 TS ts = (TS)ctx; 553 Vec U, U_c; 554 555 PetscFunctionBegin; 556 PetscCall(TSIRKGetVecs(ts, dm, &U)); 557 PetscCall(TSIRKGetVecs(ts, subdm, &U_c)); 558 559 PetscCall(VecScatterBegin(gscat, U, U_c, INSERT_VALUES, SCATTER_FORWARD)); 560 PetscCall(VecScatterEnd(gscat, U, U_c, INSERT_VALUES, SCATTER_FORWARD)); 561 562 PetscCall(TSIRKRestoreVecs(ts, dm, &U)); 563 PetscCall(TSIRKRestoreVecs(ts, subdm, &U_c)); 564 PetscFunctionReturn(PETSC_SUCCESS); 565 } 566 567 static PetscErrorCode TSSetUp_IRK(TS ts) 568 { 569 TS_IRK *irk = (TS_IRK *)ts->data; 570 IRKTableau tab = irk->tableau; 571 DM dm; 572 Mat J; 573 Vec R; 574 const PetscInt nstages = irk->nstages; 575 PetscInt vsize, bs; 576 577 PetscFunctionBegin; 578 if (!irk->work) PetscCall(PetscMalloc1(irk->nstages, &irk->work)); 579 if (!irk->Y) PetscCall(VecDuplicateVecs(ts->vec_sol, irk->nstages, &irk->Y)); 580 if (!irk->YdotI) PetscCall(VecDuplicateVecs(ts->vec_sol, irk->nstages, &irk->YdotI)); 581 if (!irk->Ydot) PetscCall(VecDuplicate(ts->vec_sol, &irk->Ydot)); 582 if (!irk->U) PetscCall(VecDuplicate(ts->vec_sol, &irk->U)); 583 if (!irk->U0) PetscCall(VecDuplicate(ts->vec_sol, &irk->U0)); 584 if (!irk->Z) { 585 PetscCall(VecCreate(PetscObjectComm((PetscObject)ts->vec_sol), &irk->Z)); 586 PetscCall(VecGetSize(ts->vec_sol, &vsize)); 587 PetscCall(VecSetSizes(irk->Z, PETSC_DECIDE, vsize * irk->nstages)); 588 PetscCall(VecGetBlockSize(ts->vec_sol, &bs)); 589 PetscCall(VecSetBlockSize(irk->Z, irk->nstages * bs)); 590 PetscCall(VecSetFromOptions(irk->Z)); 591 } 592 PetscCall(TSGetDM(ts, &dm)); 593 PetscCall(DMCoarsenHookAdd(dm, DMCoarsenHook_TSIRK, DMRestrictHook_TSIRK, ts)); 594 PetscCall(DMSubDomainHookAdd(dm, DMSubDomainHook_TSIRK, DMSubDomainRestrictHook_TSIRK, ts)); 595 596 PetscCall(TSGetSNES(ts, &ts->snes)); 597 PetscCall(VecDuplicate(irk->Z, &R)); 598 PetscCall(SNESSetFunction(ts->snes, R, SNESTSFormFunction, ts)); 599 PetscCall(TSGetIJacobian(ts, &J, NULL, NULL, NULL)); 600 if (!irk->TJ) { 601 /* Create the KAIJ matrix for solving the stages */ 602 PetscCall(MatCreateKAIJ(J, nstages, nstages, tab->A_inv, tab->I_s, &irk->TJ)); 603 } 604 PetscCall(SNESSetJacobian(ts->snes, irk->TJ, irk->TJ, SNESTSFormJacobian, ts)); 605 PetscCall(VecDestroy(&R)); 606 PetscFunctionReturn(PETSC_SUCCESS); 607 } 608 609 static PetscErrorCode TSSetFromOptions_IRK(TS ts, PetscOptionItems PetscOptionsObject) 610 { 611 TS_IRK *irk = (TS_IRK *)ts->data; 612 char tname[256] = TSIRKGAUSS; 613 614 PetscFunctionBegin; 615 PetscOptionsHeadBegin(PetscOptionsObject, "IRK ODE solver options"); 616 { 617 PetscBool flg1, flg2; 618 PetscCall(PetscOptionsInt("-ts_irk_nstages", "Stages of the IRK method", "TSIRKSetNumStages", irk->nstages, &irk->nstages, &flg1)); 619 PetscCall(PetscOptionsFList("-ts_irk_type", "Type of IRK method", "TSIRKSetType", TSIRKList, irk->method_name[0] ? irk->method_name : tname, tname, sizeof(tname), &flg2)); 620 if (flg1 || flg2 || !irk->method_name[0]) { /* Create the method tableau after nstages or method is set */ 621 PetscCall(TSIRKSetType(ts, tname)); 622 } 623 } 624 PetscOptionsHeadEnd(); 625 PetscFunctionReturn(PETSC_SUCCESS); 626 } 627 628 static PetscErrorCode TSView_IRK(TS ts, PetscViewer viewer) 629 { 630 TS_IRK *irk = (TS_IRK *)ts->data; 631 PetscBool isascii; 632 633 PetscFunctionBegin; 634 PetscCall(PetscObjectTypeCompare((PetscObject)viewer, PETSCVIEWERASCII, &isascii)); 635 if (isascii) { 636 IRKTableau tab = irk->tableau; 637 TSIRKType irktype; 638 char buf[512]; 639 640 PetscCall(TSIRKGetType(ts, &irktype)); 641 PetscCall(PetscViewerASCIIPrintf(viewer, " IRK type %s\n", irktype)); 642 PetscCall(PetscFormatRealArray(buf, sizeof(buf), "% 8.6f", irk->nstages, tab->c)); 643 PetscCall(PetscViewerASCIIPrintf(viewer, " Abscissa c = %s\n", buf)); 644 PetscCall(PetscViewerASCIIPrintf(viewer, "Stiffly accurate: %s\n", irk->stiffly_accurate ? "yes" : "no")); 645 PetscCall(PetscFormatRealArray(buf, sizeof(buf), "% 8.6f", PetscSqr(irk->nstages), tab->A)); 646 PetscCall(PetscViewerASCIIPrintf(viewer, " A coefficients A = %s\n", buf)); 647 } 648 PetscFunctionReturn(PETSC_SUCCESS); 649 } 650 651 static PetscErrorCode TSLoad_IRK(TS ts, PetscViewer viewer) 652 { 653 SNES snes; 654 TSAdapt adapt; 655 656 PetscFunctionBegin; 657 PetscCall(TSGetAdapt(ts, &adapt)); 658 PetscCall(TSAdaptLoad(adapt, viewer)); 659 PetscCall(TSGetSNES(ts, &snes)); 660 PetscCall(SNESLoad(snes, viewer)); 661 /* function and Jacobian context for SNES when used with TS is always ts object */ 662 PetscCall(SNESSetFunction(snes, NULL, NULL, ts)); 663 PetscCall(SNESSetJacobian(snes, NULL, NULL, NULL, ts)); 664 PetscFunctionReturn(PETSC_SUCCESS); 665 } 666 667 /*@ 668 TSIRKSetType - Set the type of `TSIRK` scheme to use 669 670 Logically Collective 671 672 Input Parameters: 673 + ts - timestepping context 674 - irktype - type of `TSIRK` scheme 675 676 Options Database Key: 677 . -ts_irk_type <gauss> - set irk type 678 679 Level: intermediate 680 681 .seealso: [](ch_ts), `TSIRKGetType()`, `TSIRK`, `TSIRKType`, `TSIRKGAUSS` 682 @*/ 683 PetscErrorCode TSIRKSetType(TS ts, TSIRKType irktype) 684 { 685 PetscFunctionBegin; 686 PetscValidHeaderSpecific(ts, TS_CLASSID, 1); 687 PetscAssertPointer(irktype, 2); 688 PetscTryMethod(ts, "TSIRKSetType_C", (TS, TSIRKType), (ts, irktype)); 689 PetscFunctionReturn(PETSC_SUCCESS); 690 } 691 692 /*@ 693 TSIRKGetType - Get the type of `TSIRK` IMEX scheme being used 694 695 Logically Collective 696 697 Input Parameter: 698 . ts - timestepping context 699 700 Output Parameter: 701 . irktype - type of `TSIRK` IMEX scheme 702 703 Level: intermediate 704 705 .seealso: [](ch_ts), `TSIRK`, `TSIRKType`, `TSIRKGAUSS` 706 @*/ 707 PetscErrorCode TSIRKGetType(TS ts, TSIRKType *irktype) 708 { 709 PetscFunctionBegin; 710 PetscValidHeaderSpecific(ts, TS_CLASSID, 1); 711 PetscUseMethod(ts, "TSIRKGetType_C", (TS, TSIRKType *), (ts, irktype)); 712 PetscFunctionReturn(PETSC_SUCCESS); 713 } 714 715 /*@ 716 TSIRKSetNumStages - Set the number of stages of `TSIRK` scheme to use 717 718 Logically Collective 719 720 Input Parameters: 721 + ts - timestepping context 722 - nstages - number of stages of `TSIRK` scheme 723 724 Options Database Key: 725 . -ts_irk_nstages <int> - set number of stages 726 727 Level: intermediate 728 729 .seealso: [](ch_ts), `TSIRKGetNumStages()`, `TSIRK` 730 @*/ 731 PetscErrorCode TSIRKSetNumStages(TS ts, PetscInt nstages) 732 { 733 PetscFunctionBegin; 734 PetscValidHeaderSpecific(ts, TS_CLASSID, 1); 735 PetscTryMethod(ts, "TSIRKSetNumStages_C", (TS, PetscInt), (ts, nstages)); 736 PetscFunctionReturn(PETSC_SUCCESS); 737 } 738 739 /*@ 740 TSIRKGetNumStages - Get the number of stages of `TSIRK` scheme 741 742 Logically Collective 743 744 Input Parameters: 745 + ts - timestepping context 746 - nstages - number of stages of `TSIRK` scheme 747 748 Level: intermediate 749 750 .seealso: [](ch_ts), `TSIRKSetNumStages()`, `TSIRK` 751 @*/ 752 PetscErrorCode TSIRKGetNumStages(TS ts, PetscInt *nstages) 753 { 754 PetscFunctionBegin; 755 PetscValidHeaderSpecific(ts, TS_CLASSID, 1); 756 PetscAssertPointer(nstages, 2); 757 PetscTryMethod(ts, "TSIRKGetNumStages_C", (TS, PetscInt *), (ts, nstages)); 758 PetscFunctionReturn(PETSC_SUCCESS); 759 } 760 761 static PetscErrorCode TSIRKGetType_IRK(TS ts, TSIRKType *irktype) 762 { 763 TS_IRK *irk = (TS_IRK *)ts->data; 764 765 PetscFunctionBegin; 766 *irktype = irk->method_name; 767 PetscFunctionReturn(PETSC_SUCCESS); 768 } 769 770 static PetscErrorCode TSIRKSetType_IRK(TS ts, TSIRKType irktype) 771 { 772 TS_IRK *irk = (TS_IRK *)ts->data; 773 PetscErrorCode (*irkcreate)(TS); 774 775 PetscFunctionBegin; 776 if (irk->method_name) { 777 PetscCall(PetscFree(irk->method_name)); 778 PetscCall(TSIRKTableauReset(ts)); 779 } 780 PetscCall(PetscFunctionListFind(TSIRKList, irktype, &irkcreate)); 781 PetscCheck(irkcreate, PetscObjectComm((PetscObject)ts), PETSC_ERR_ARG_UNKNOWN_TYPE, "Unknown TSIRK type \"%s\" given", irktype); 782 PetscCall((*irkcreate)(ts)); 783 PetscCall(PetscStrallocpy(irktype, &irk->method_name)); 784 PetscFunctionReturn(PETSC_SUCCESS); 785 } 786 787 static PetscErrorCode TSIRKSetNumStages_IRK(TS ts, PetscInt nstages) 788 { 789 TS_IRK *irk = (TS_IRK *)ts->data; 790 791 PetscFunctionBegin; 792 PetscCheck(nstages > 0, PETSC_COMM_SELF, PETSC_ERR_ARG_OUTOFRANGE, "input argument, %" PetscInt_FMT ", out of range", nstages); 793 irk->nstages = nstages; 794 PetscFunctionReturn(PETSC_SUCCESS); 795 } 796 797 static PetscErrorCode TSIRKGetNumStages_IRK(TS ts, PetscInt *nstages) 798 { 799 TS_IRK *irk = (TS_IRK *)ts->data; 800 801 PetscFunctionBegin; 802 PetscAssertPointer(nstages, 2); 803 *nstages = irk->nstages; 804 PetscFunctionReturn(PETSC_SUCCESS); 805 } 806 807 static PetscErrorCode TSDestroy_IRK(TS ts) 808 { 809 PetscFunctionBegin; 810 PetscCall(TSReset_IRK(ts)); 811 if (ts->dm) { 812 PetscCall(DMCoarsenHookRemove(ts->dm, DMCoarsenHook_TSIRK, DMRestrictHook_TSIRK, ts)); 813 PetscCall(DMSubDomainHookRemove(ts->dm, DMSubDomainHook_TSIRK, DMSubDomainRestrictHook_TSIRK, ts)); 814 } 815 PetscCall(PetscFree(ts->data)); 816 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKSetType_C", NULL)); 817 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKGetType_C", NULL)); 818 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKSetNumStages_C", NULL)); 819 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKGetNumStages_C", NULL)); 820 PetscFunctionReturn(PETSC_SUCCESS); 821 } 822 823 /*MC 824 TSIRK - ODE and DAE solver using Implicit Runge-Kutta schemes 825 826 Level: beginner 827 828 Notes: 829 `TSIRK` uses the sparse Kronecker product matrix implementation of `MATKAIJ` to achieve good arithmetic intensity. 830 831 Gauss-Legrendre methods are currently supported. These are A-stable symplectic methods with an arbitrary number of stages. The order of accuracy is 2s 832 when using s stages. The default method uses three stages and thus has an order of six. The number of stages (thus order) can be set with 833 -ts_irk_nstages or `TSIRKSetNumStages()`. 834 835 .seealso: [](ch_ts), `TSCreate()`, `TS`, `TSSetType()`, `TSIRKSetType()`, `TSIRKGetType()`, `TSIRKGAUSS`, `TSIRKRegister()`, `TSIRKSetNumStages()`, `TSType` 836 M*/ 837 PETSC_EXTERN PetscErrorCode TSCreate_IRK(TS ts) 838 { 839 TS_IRK *irk; 840 841 PetscFunctionBegin; 842 PetscCall(TSIRKInitializePackage()); 843 844 ts->ops->reset = TSReset_IRK; 845 ts->ops->destroy = TSDestroy_IRK; 846 ts->ops->view = TSView_IRK; 847 ts->ops->load = TSLoad_IRK; 848 ts->ops->setup = TSSetUp_IRK; 849 ts->ops->step = TSStep_IRK; 850 ts->ops->interpolate = TSInterpolate_IRK; 851 ts->ops->evaluatestep = TSEvaluateStep_IRK; 852 ts->ops->rollback = TSRollBack_IRK; 853 ts->ops->setfromoptions = TSSetFromOptions_IRK; 854 ts->ops->snesfunction = SNESTSFormFunction_IRK; 855 ts->ops->snesjacobian = SNESTSFormJacobian_IRK; 856 857 ts->usessnes = PETSC_TRUE; 858 859 PetscCall(PetscNew(&irk)); 860 ts->data = (void *)irk; 861 862 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKSetType_C", TSIRKSetType_IRK)); 863 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKGetType_C", TSIRKGetType_IRK)); 864 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKSetNumStages_C", TSIRKSetNumStages_IRK)); 865 PetscCall(PetscObjectComposeFunction((PetscObject)ts, "TSIRKGetNumStages_C", TSIRKGetNumStages_IRK)); 866 /* 3-stage IRK_Gauss is the default */ 867 PetscCall(PetscNew(&irk->tableau)); 868 irk->nstages = 3; 869 PetscCall(TSIRKSetType(ts, TSIRKDefault)); 870 PetscFunctionReturn(PETSC_SUCCESS); 871 } 872