17cb94ee6SHong Zhang /* 2db268bfaSHong Zhang Provides a PETSc interface to SUNDIALS/CVODE solver. 37cb94ee6SHong Zhang The interface to PVODE (old version of CVODE) was originally contributed 47cb94ee6SHong Zhang by Liyang Xu. It has been redone by Hong Zhang and Dinesh Kaushik. 528adb3f7SHong Zhang 628adb3f7SHong Zhang Reference: sundials-2.4.0/examples/cvode/parallel/cvDiurnal_kry_p.c 77cb94ee6SHong Zhang */ 856a740aaSHong Zhang #include "sundials.h" /*I "petscts.h" I*/ 97cb94ee6SHong Zhang 107cb94ee6SHong Zhang /* 117cb94ee6SHong Zhang TSPrecond_Sundials - function that we provide to SUNDIALS to 127cb94ee6SHong Zhang evaluate the preconditioner. 137cb94ee6SHong Zhang */ 147cb94ee6SHong Zhang #undef __FUNCT__ 157cb94ee6SHong Zhang #define __FUNCT__ "TSPrecond_Sundials" 167cb94ee6SHong Zhang PetscErrorCode TSPrecond_Sundials(realtype tn,N_Vector y,N_Vector fy, 177cb94ee6SHong Zhang booleantype jok,booleantype *jcurPtr, 187cb94ee6SHong Zhang realtype _gamma,void *P_data, 197cb94ee6SHong Zhang N_Vector vtemp1,N_Vector vtemp2,N_Vector vtemp3) 207cb94ee6SHong Zhang { 217cb94ee6SHong Zhang TS ts = (TS) P_data; 227cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 237cb94ee6SHong Zhang PC pc = cvode->pc; 247cb94ee6SHong Zhang PetscErrorCode ierr; 257cb94ee6SHong Zhang Mat Jac = ts->B; 267cb94ee6SHong Zhang Vec yy = cvode->w1; 277cb94ee6SHong Zhang PetscScalar one = 1.0,gm; 287cb94ee6SHong Zhang MatStructure str = DIFFERENT_NONZERO_PATTERN; 297cb94ee6SHong Zhang PetscScalar *y_data; 307cb94ee6SHong Zhang 317cb94ee6SHong Zhang PetscFunctionBegin; 327cb94ee6SHong Zhang /* This allows us to construct preconditioners in-place if we like */ 337cb94ee6SHong Zhang ierr = MatSetUnfactored(Jac);CHKERRQ(ierr); 347cb94ee6SHong Zhang 357cb94ee6SHong Zhang /* jok - TRUE means reuse current Jacobian else recompute Jacobian */ 367cb94ee6SHong Zhang if (jok) { 377cb94ee6SHong Zhang ierr = MatCopy(cvode->pmat,Jac,str);CHKERRQ(ierr); 387cb94ee6SHong Zhang *jcurPtr = FALSE; 397cb94ee6SHong Zhang } else { 407cb94ee6SHong Zhang /* make PETSc vector yy point to SUNDIALS vector y */ 417cb94ee6SHong Zhang y_data = (PetscScalar *) N_VGetArrayPointer(y); 427cb94ee6SHong Zhang ierr = VecPlaceArray(yy,y_data); CHKERRQ(ierr); 434ac7836bSHong Zhang 447cb94ee6SHong Zhang /* compute the Jacobian */ 457cb94ee6SHong Zhang ierr = TSComputeRHSJacobian(ts,ts->ptime,yy,&Jac,&Jac,&str);CHKERRQ(ierr); 467cb94ee6SHong Zhang ierr = VecResetArray(yy); CHKERRQ(ierr); 474ac7836bSHong Zhang 487cb94ee6SHong Zhang /* copy the Jacobian matrix */ 497cb94ee6SHong Zhang if (!cvode->pmat) { 507cb94ee6SHong Zhang ierr = MatDuplicate(Jac,MAT_COPY_VALUES,&cvode->pmat);CHKERRQ(ierr); 517cb94ee6SHong Zhang ierr = PetscLogObjectParent(ts,cvode->pmat);CHKERRQ(ierr); 522c823083SHong Zhang } else { 537cb94ee6SHong Zhang ierr = MatCopy(Jac,cvode->pmat,str);CHKERRQ(ierr); 547cb94ee6SHong Zhang } 557cb94ee6SHong Zhang *jcurPtr = TRUE; 567cb94ee6SHong Zhang } 577cb94ee6SHong Zhang 587cb94ee6SHong Zhang /* construct I-gamma*Jac */ 597cb94ee6SHong Zhang gm = -_gamma; 607cb94ee6SHong Zhang ierr = MatScale(Jac,gm);CHKERRQ(ierr); 617cb94ee6SHong Zhang ierr = MatShift(Jac,one);CHKERRQ(ierr); 627cb94ee6SHong Zhang 637cb94ee6SHong Zhang ierr = PCSetOperators(pc,Jac,Jac,str);CHKERRQ(ierr); 647cb94ee6SHong Zhang PetscFunctionReturn(0); 657cb94ee6SHong Zhang } 667cb94ee6SHong Zhang 677cb94ee6SHong Zhang /* 687cb94ee6SHong Zhang TSPSolve_Sundials - routine that we provide to Sundials that applies the preconditioner. 697cb94ee6SHong Zhang */ 707cb94ee6SHong Zhang #undef __FUNCT__ 717cb94ee6SHong Zhang #define __FUNCT__ "TSPSolve_Sundials" 724ac7836bSHong Zhang PetscErrorCode TSPSolve_Sundials(realtype tn,N_Vector y,N_Vector fy,N_Vector r,N_Vector z, 734ac7836bSHong Zhang realtype _gamma,realtype delta,int lr,void *P_data,N_Vector vtemp) 747cb94ee6SHong Zhang { 757cb94ee6SHong Zhang TS ts = (TS) P_data; 767cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 777cb94ee6SHong Zhang PC pc = cvode->pc; 787cb94ee6SHong Zhang Vec rr = cvode->w1,zz = cvode->w2; 797cb94ee6SHong Zhang PetscErrorCode ierr; 807cb94ee6SHong Zhang PetscScalar *r_data,*z_data; 817cb94ee6SHong Zhang 827cb94ee6SHong Zhang PetscFunctionBegin; 837cb94ee6SHong Zhang /* Make the PETSc work vectors rr and zz point to the arrays in the SUNDIALS vectors r and z respectively*/ 847cb94ee6SHong Zhang r_data = (PetscScalar *) N_VGetArrayPointer(r); 857cb94ee6SHong Zhang z_data = (PetscScalar *) N_VGetArrayPointer(z); 867cb94ee6SHong Zhang ierr = VecPlaceArray(rr,r_data); CHKERRQ(ierr); 877cb94ee6SHong Zhang ierr = VecPlaceArray(zz,z_data); CHKERRQ(ierr); 884ac7836bSHong Zhang 897cb94ee6SHong Zhang /* Solve the Px=r and put the result in zz */ 907cb94ee6SHong Zhang ierr = PCApply(pc,rr,zz); CHKERRQ(ierr); 917cb94ee6SHong Zhang ierr = VecResetArray(rr); CHKERRQ(ierr); 927cb94ee6SHong Zhang ierr = VecResetArray(zz); CHKERRQ(ierr); 937cb94ee6SHong Zhang PetscFunctionReturn(0); 947cb94ee6SHong Zhang } 957cb94ee6SHong Zhang 967cb94ee6SHong Zhang /* 977cb94ee6SHong Zhang TSFunction_Sundials - routine that we provide to Sundials that applies the right hand side. 987cb94ee6SHong Zhang */ 997cb94ee6SHong Zhang #undef __FUNCT__ 1007cb94ee6SHong Zhang #define __FUNCT__ "TSFunction_Sundials" 1014ac7836bSHong Zhang int TSFunction_Sundials(realtype t,N_Vector y,N_Vector ydot,void *ctx) 1027cb94ee6SHong Zhang { 1037cb94ee6SHong Zhang TS ts = (TS) ctx; 1047adad957SLisandro Dalcin MPI_Comm comm = ((PetscObject)ts)->comm; 1057cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 1067cb94ee6SHong Zhang Vec yy = cvode->w1,yyd = cvode->w2; 1077cb94ee6SHong Zhang PetscScalar *y_data,*ydot_data; 1087cb94ee6SHong Zhang PetscErrorCode ierr; 1097cb94ee6SHong Zhang 1107cb94ee6SHong Zhang PetscFunctionBegin; 1115ff03cf7SDinesh Kaushik /* Make the PETSc work vectors yy and yyd point to the arrays in the SUNDIALS vectors y and ydot respectively*/ 1127cb94ee6SHong Zhang y_data = (PetscScalar *) N_VGetArrayPointer(y); 1137cb94ee6SHong Zhang ydot_data = (PetscScalar *) N_VGetArrayPointer(ydot); 1144ac7836bSHong Zhang ierr = VecPlaceArray(yy,y_data);CHKERRABORT(comm,ierr); 1154ac7836bSHong Zhang ierr = VecPlaceArray(yyd,ydot_data); CHKERRABORT(comm,ierr); 1164ac7836bSHong Zhang 1177cb94ee6SHong Zhang /* now compute the right hand side function */ 1187cb94ee6SHong Zhang ierr = TSComputeRHSFunction(ts,t,yy,yyd); CHKERRABORT(comm,ierr); 1197cb94ee6SHong Zhang ierr = VecResetArray(yy); CHKERRABORT(comm,ierr); 1207cb94ee6SHong Zhang ierr = VecResetArray(yyd); CHKERRABORT(comm,ierr); 1214ac7836bSHong Zhang PetscFunctionReturn(0); 1227cb94ee6SHong Zhang } 1237cb94ee6SHong Zhang 1247cb94ee6SHong Zhang /* 1257cb94ee6SHong Zhang TSStep_Sundials_Nonlinear - Calls Sundials to integrate the ODE. 1267cb94ee6SHong Zhang */ 1277cb94ee6SHong Zhang #undef __FUNCT__ 1287cb94ee6SHong Zhang #define __FUNCT__ "TSStep_Sundials_Nonlinear" 1297cb94ee6SHong Zhang PetscErrorCode TSStep_Sundials_Nonlinear(TS ts,int *steps,double *time) 1307cb94ee6SHong Zhang { 1317cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 1327cb94ee6SHong Zhang Vec sol = ts->vec_sol; 1337cb94ee6SHong Zhang PetscErrorCode ierr; 134186e87acSLisandro Dalcin PetscInt i,flag; 1359f94935aSHong Zhang long int its,nsteps; 1367cb94ee6SHong Zhang realtype t,tout; 1377cb94ee6SHong Zhang PetscScalar *y_data; 1387cb94ee6SHong Zhang void *mem; 1397cb94ee6SHong Zhang 1407cb94ee6SHong Zhang PetscFunctionBegin; 14116016685SHong Zhang mem = cvode->mem; 1427cb94ee6SHong Zhang tout = ts->max_time; 1437cb94ee6SHong Zhang ierr = VecGetArray(ts->vec_sol,&y_data);CHKERRQ(ierr); 1447cb94ee6SHong Zhang N_VSetArrayPointer((realtype *)y_data,cvode->y); 1457cb94ee6SHong Zhang ierr = VecRestoreArray(ts->vec_sol,PETSC_NULL);CHKERRQ(ierr); 146186e87acSLisandro Dalcin 147186e87acSLisandro Dalcin for (i = 0; i < ts->max_steps; i++) { 1487cb94ee6SHong Zhang if (ts->ptime >= ts->max_time) break; 1493f2090d5SJed Brown ierr = TSPreStep(ts);CHKERRQ(ierr); 150186e87acSLisandro Dalcin 1512bfc04deSHong Zhang if (cvode->monitorstep) { 15228adb3f7SHong Zhang flag = CVode(mem,tout,cvode->y,&t,CV_ONE_STEP); 1532bfc04deSHong Zhang } else { 1542bfc04deSHong Zhang flag = CVode(mem,tout,cvode->y,&t,CV_NORMAL); 1552bfc04deSHong Zhang } 1569f94935aSHong Zhang 1579f94935aSHong Zhang if (flag){ /* display error message */ 1589f94935aSHong Zhang switch (flag){ 1599f94935aSHong Zhang case CV_ILL_INPUT: 1609f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_ILL_INPUT"); 1619f94935aSHong Zhang break; 1629f94935aSHong Zhang case CV_TOO_CLOSE: 1639f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_TOO_CLOSE"); 1649f94935aSHong Zhang break; 1653c7fefeeSJed Brown case CV_TOO_MUCH_WORK: { 1669f94935aSHong Zhang PetscReal tcur; 1679f94935aSHong Zhang ierr = CVodeGetNumSteps(mem,&nsteps);CHKERRQ(ierr); 1689f94935aSHong Zhang ierr = CVodeGetCurrentTime(mem,&tcur);CHKERRQ(ierr); 1699f94935aSHong Zhang SETERRQ3(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_TOO_MUCH_WORK. At t=%G, nsteps %D exceeds mxstep %D. Increase '-ts_max_steps <>' or modify TSSetDuration()",tcur,nsteps,ts->max_steps); 1703c7fefeeSJed Brown } break; 1719f94935aSHong Zhang case CV_TOO_MUCH_ACC: 1729f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_TOO_MUCH_ACC"); 1739f94935aSHong Zhang break; 1749f94935aSHong Zhang case CV_ERR_FAILURE: 1759f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_ERR_FAILURE"); 1769f94935aSHong Zhang break; 1779f94935aSHong Zhang case CV_CONV_FAILURE: 1789f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_CONV_FAILURE"); 1799f94935aSHong Zhang break; 1809f94935aSHong Zhang case CV_LINIT_FAIL: 1819f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_LINIT_FAIL"); 1829f94935aSHong Zhang break; 1839f94935aSHong Zhang case CV_LSETUP_FAIL: 1849f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_LSETUP_FAIL"); 1859f94935aSHong Zhang break; 1869f94935aSHong Zhang case CV_LSOLVE_FAIL: 1879f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_LSOLVE_FAIL"); 1889f94935aSHong Zhang break; 1899f94935aSHong Zhang case CV_RHSFUNC_FAIL: 1909f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_RHSFUNC_FAIL"); 1919f94935aSHong Zhang break; 1929f94935aSHong Zhang case CV_FIRST_RHSFUNC_ERR: 1939f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_FIRST_RHSFUNC_ERR"); 1949f94935aSHong Zhang break; 1959f94935aSHong Zhang case CV_REPTD_RHSFUNC_ERR: 1969f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_REPTD_RHSFUNC_ERR"); 1979f94935aSHong Zhang break; 1989f94935aSHong Zhang case CV_UNREC_RHSFUNC_ERR: 1999f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_UNREC_RHSFUNC_ERR"); 2009f94935aSHong Zhang break; 2019f94935aSHong Zhang case CV_RTFUNC_FAIL: 2029f94935aSHong Zhang SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, CV_RTFUNC_FAIL"); 2039f94935aSHong Zhang break; 2049f94935aSHong Zhang default: 2059f94935aSHong Zhang SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVode() fails, flag %d",flag); 2069f94935aSHong Zhang } 2079f94935aSHong Zhang } 2089f94935aSHong Zhang 2097cb94ee6SHong Zhang if (t > ts->max_time && cvode->exact_final_time) { 2107cb94ee6SHong Zhang /* interpolate to final requested time */ 2117cb94ee6SHong Zhang ierr = CVodeGetDky(mem,tout,0,cvode->y);CHKERRQ(ierr); 2127cb94ee6SHong Zhang t = tout; 2137cb94ee6SHong Zhang } 2147cb94ee6SHong Zhang 2157cb94ee6SHong Zhang /* copy the solution from cvode->y to cvode->update and sol */ 2167cb94ee6SHong Zhang ierr = VecPlaceArray(cvode->w1,y_data); CHKERRQ(ierr); 2177cb94ee6SHong Zhang ierr = VecCopy(cvode->w1,cvode->update);CHKERRQ(ierr); 2187cb94ee6SHong Zhang ierr = VecResetArray(cvode->w1); CHKERRQ(ierr); 2197cb94ee6SHong Zhang ierr = VecCopy(cvode->update,sol);CHKERRQ(ierr); 2207cb94ee6SHong Zhang ierr = CVodeGetNumNonlinSolvIters(mem,&its);CHKERRQ(ierr); 2214ac7836bSHong Zhang ierr = CVSpilsGetNumLinIters(mem, &its); 222186e87acSLisandro Dalcin ts->nonlinear_its = its; ts->linear_its = its; 223186e87acSLisandro Dalcin 224186e87acSLisandro Dalcin ts->time_step = t - ts->ptime; 225186e87acSLisandro Dalcin ts->ptime = t; 2267cb94ee6SHong Zhang ts->steps++; 227186e87acSLisandro Dalcin 2283f2090d5SJed Brown ierr = TSPostStep(ts);CHKERRQ(ierr); 2297cb94ee6SHong Zhang ierr = TSMonitor(ts,ts->steps,t,sol);CHKERRQ(ierr); 2307cb94ee6SHong Zhang } 2319f94935aSHong Zhang ierr = CVodeGetNumSteps(mem,&nsteps);CHKERRQ(ierr); 232186e87acSLisandro Dalcin 2339f94935aSHong Zhang *steps = nsteps; 2347cb94ee6SHong Zhang *time = t; 2357cb94ee6SHong Zhang PetscFunctionReturn(0); 2367cb94ee6SHong Zhang } 2377cb94ee6SHong Zhang 2387cb94ee6SHong Zhang #undef __FUNCT__ 239277b19d0SLisandro Dalcin #define __FUNCT__ "TSReset_Sundials" 240277b19d0SLisandro Dalcin PetscErrorCode TSReset_Sundials(TS ts) 241277b19d0SLisandro Dalcin { 242277b19d0SLisandro Dalcin TS_Sundials *cvode = (TS_Sundials*)ts->data; 243277b19d0SLisandro Dalcin PetscErrorCode ierr; 244277b19d0SLisandro Dalcin 245277b19d0SLisandro Dalcin PetscFunctionBegin; 246277b19d0SLisandro Dalcin if (cvode->pc) {ierr = PCReset(cvode->pc);CHKERRQ(ierr);} 247*d155d410SJed Brown ierr = MatDestroy(&cvode->pmat); 248*d155d410SJed Brown ierr = VecDestroy(&cvode->update); 249*d155d410SJed Brown ierr = VecDestroy(&cvode->func); 250*d155d410SJed Brown ierr = VecDestroy(&cvode->rhs); 251*d155d410SJed Brown ierr = VecDestroy(&cvode->w1); 252*d155d410SJed Brown ierr = VecDestroy(&cvode->w2); 253277b19d0SLisandro Dalcin if (cvode->mem) {CVodeFree(&cvode->mem);} 254277b19d0SLisandro Dalcin PetscFunctionReturn(0); 255277b19d0SLisandro Dalcin } 256277b19d0SLisandro Dalcin 257277b19d0SLisandro Dalcin #undef __FUNCT__ 2587cb94ee6SHong Zhang #define __FUNCT__ "TSDestroy_Sundials" 2597cb94ee6SHong Zhang PetscErrorCode TSDestroy_Sundials(TS ts) 2607cb94ee6SHong Zhang { 2617cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 2627cb94ee6SHong Zhang PetscErrorCode ierr; 2637cb94ee6SHong Zhang 2647cb94ee6SHong Zhang PetscFunctionBegin; 265277b19d0SLisandro Dalcin ierr = TSReset_Sundials(ts);CHKERRQ(ierr); 266*d155d410SJed Brown ierr = PCDestroy(&cvode->pc);CHKERRQ(ierr); 267a07356b8SSatish Balay ierr = MPI_Comm_free(&(cvode->comm_sundials));CHKERRQ(ierr); 268277b19d0SLisandro Dalcin ierr = PetscFree(ts->data);CHKERRQ(ierr); 2697cb94ee6SHong Zhang PetscFunctionReturn(0); 2707cb94ee6SHong Zhang } 2717cb94ee6SHong Zhang 2727cb94ee6SHong Zhang #undef __FUNCT__ 2737cb94ee6SHong Zhang #define __FUNCT__ "TSSetUp_Sundials_Nonlinear" 2747cb94ee6SHong Zhang PetscErrorCode TSSetUp_Sundials_Nonlinear(TS ts) 2757cb94ee6SHong Zhang { 2767cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 2777cb94ee6SHong Zhang PetscErrorCode ierr; 27816016685SHong Zhang PetscInt glosize,locsize,i,flag; 2797cb94ee6SHong Zhang PetscScalar *y_data,*parray; 28016016685SHong Zhang void *mem; 28116016685SHong Zhang const PCType pctype; 282ace3abfcSBarry Smith PetscBool pcnone; 28316016685SHong Zhang Vec sol = ts->vec_sol; 2847cb94ee6SHong Zhang 2857cb94ee6SHong Zhang PetscFunctionBegin; 2867cb94ee6SHong Zhang ierr = PCSetFromOptions(cvode->pc);CHKERRQ(ierr); 2879f94935aSHong Zhang 2887cb94ee6SHong Zhang /* get the vector size */ 2897cb94ee6SHong Zhang ierr = VecGetSize(ts->vec_sol,&glosize);CHKERRQ(ierr); 2907cb94ee6SHong Zhang ierr = VecGetLocalSize(ts->vec_sol,&locsize);CHKERRQ(ierr); 2917cb94ee6SHong Zhang 2927cb94ee6SHong Zhang /* allocate the memory for N_Vec y */ 293a07356b8SSatish Balay cvode->y = N_VNew_Parallel(cvode->comm_sundials,locsize,glosize); 294e32f2f54SBarry Smith if (!cvode->y) SETERRQ(PETSC_COMM_SELF,1,"cvode->y is not allocated"); 2957cb94ee6SHong Zhang 29628adb3f7SHong Zhang /* initialize N_Vec y: copy ts->vec_sol to cvode->y */ 2977cb94ee6SHong Zhang ierr = VecGetArray(ts->vec_sol,&parray);CHKERRQ(ierr); 2987cb94ee6SHong Zhang y_data = (PetscScalar *) N_VGetArrayPointer(cvode->y); 2997cb94ee6SHong Zhang for (i = 0; i < locsize; i++) y_data[i] = parray[i]; 3007cb94ee6SHong Zhang /*ierr = PetscMemcpy(y_data,parray,locsize*sizeof(PETSC_SCALAR)); CHKERRQ(ierr);*/ 3017cb94ee6SHong Zhang ierr = VecRestoreArray(ts->vec_sol,PETSC_NULL);CHKERRQ(ierr); 3027cb94ee6SHong Zhang ierr = VecDuplicate(ts->vec_sol,&cvode->update);CHKERRQ(ierr); 3037cb94ee6SHong Zhang ierr = VecDuplicate(ts->vec_sol,&cvode->func);CHKERRQ(ierr); 3047cb94ee6SHong Zhang ierr = PetscLogObjectParent(ts,cvode->update);CHKERRQ(ierr); 3057cb94ee6SHong Zhang ierr = PetscLogObjectParent(ts,cvode->func);CHKERRQ(ierr); 3067cb94ee6SHong Zhang 3077cb94ee6SHong Zhang /* 3087cb94ee6SHong Zhang Create work vectors for the TSPSolve_Sundials() routine. Note these are 3097cb94ee6SHong Zhang allocated with zero space arrays because the actual array space is provided 3107cb94ee6SHong Zhang by Sundials and set using VecPlaceArray(). 3117cb94ee6SHong Zhang */ 3127adad957SLisandro Dalcin ierr = VecCreateMPIWithArray(((PetscObject)ts)->comm,locsize,PETSC_DECIDE,0,&cvode->w1);CHKERRQ(ierr); 3137adad957SLisandro Dalcin ierr = VecCreateMPIWithArray(((PetscObject)ts)->comm,locsize,PETSC_DECIDE,0,&cvode->w2);CHKERRQ(ierr); 3147cb94ee6SHong Zhang ierr = PetscLogObjectParent(ts,cvode->w1);CHKERRQ(ierr); 3157cb94ee6SHong Zhang ierr = PetscLogObjectParent(ts,cvode->w2);CHKERRQ(ierr); 31616016685SHong Zhang 31716016685SHong Zhang /* Call CVodeCreate to create the solver memory and the use of a Newton iteration */ 31816016685SHong Zhang mem = CVodeCreate(cvode->cvode_type, CV_NEWTON); 319e32f2f54SBarry Smith if (!mem) SETERRQ(PETSC_COMM_SELF,PETSC_ERR_MEM,"CVodeCreate() fails"); 32016016685SHong Zhang cvode->mem = mem; 32116016685SHong Zhang 32216016685SHong Zhang /* Set the pointer to user-defined data */ 32316016685SHong Zhang flag = CVodeSetUserData(mem, ts); 324e32f2f54SBarry Smith if (flag) SETERRQ(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVodeSetUserData() fails"); 32516016685SHong Zhang 326fc6b9e64SJed Brown /* Sundials may choose to use a smaller initial step, but will never use a larger step. */ 327fc6b9e64SJed Brown flag = CVodeSetInitStep(mem,(realtype)ts->initial_time_step); 328fc6b9e64SJed Brown if (flag) SETERRQ(((PetscObject)ts)->comm,PETSC_ERR_LIB,"CVodeSetInitStep() failed"); 329f1cd61daSJed Brown if (cvode->mindt > 0) { 330f1cd61daSJed Brown flag = CVodeSetMinStep(mem,(realtype)cvode->mindt); 3319f94935aSHong Zhang if (flag){ 3329f94935aSHong Zhang if (flag == CV_MEM_NULL){ 3339f94935aSHong Zhang SETERRQ(((PetscObject)ts)->comm,PETSC_ERR_LIB,"CVodeSetMinStep() failed, cvode_mem pointer is NULL"); 3349f94935aSHong Zhang } else if (flag == CV_ILL_INPUT){ 3359f94935aSHong Zhang SETERRQ(((PetscObject)ts)->comm,PETSC_ERR_LIB,"CVodeSetMinStep() failed, hmin is nonpositive or it exceeds the maximum allowable step size"); 3369f94935aSHong Zhang } else { 3379f94935aSHong Zhang SETERRQ(((PetscObject)ts)->comm,PETSC_ERR_LIB,"CVodeSetMinStep() failed"); 3389f94935aSHong Zhang } 3399f94935aSHong Zhang } 340f1cd61daSJed Brown } 341f1cd61daSJed Brown if (cvode->maxdt > 0) { 342f1cd61daSJed Brown flag = CVodeSetMaxStep(mem,(realtype)cvode->maxdt); 343f1cd61daSJed Brown if (flag) SETERRQ(((PetscObject)ts)->comm,PETSC_ERR_LIB,"CVodeSetMaxStep() failed"); 344f1cd61daSJed Brown } 345f1cd61daSJed Brown 34616016685SHong Zhang /* Call CVodeInit to initialize the integrator memory and specify the 34716016685SHong Zhang * user's right hand side function in u'=f(t,u), the inital time T0, and 34816016685SHong Zhang * the initial dependent variable vector cvode->y */ 34916016685SHong Zhang flag = CVodeInit(mem,TSFunction_Sundials,ts->ptime,cvode->y); 35016016685SHong Zhang if (flag){ 351e32f2f54SBarry Smith SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVodeInit() fails, flag %d",flag); 35216016685SHong Zhang } 35316016685SHong Zhang 3549f94935aSHong Zhang /* specifies scalar relative and absolute tolerances */ 35516016685SHong Zhang flag = CVodeSStolerances(mem,cvode->reltol,cvode->abstol); 35616016685SHong Zhang if (flag){ 357e32f2f54SBarry Smith SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVodeSStolerances() fails, flag %d",flag); 35816016685SHong Zhang } 35916016685SHong Zhang 3609f94935aSHong Zhang /* Specify max num of steps to be taken by cvode in its attempt to reach the next output time */ 3619f94935aSHong Zhang flag = CVodeSetMaxNumSteps(mem,ts->max_steps); 36216016685SHong Zhang ierr = TSMonitor(ts,ts->steps,ts->ptime,sol);CHKERRQ(ierr); 36316016685SHong Zhang 36416016685SHong Zhang /* call CVSpgmr to use GMRES as the linear solver. */ 36516016685SHong Zhang /* setup the ode integrator with the given preconditioner */ 36616016685SHong Zhang ierr = PCGetType(cvode->pc,&pctype);CHKERRQ(ierr); 36716016685SHong Zhang ierr = PetscTypeCompare((PetscObject)cvode->pc,PCNONE,&pcnone);CHKERRQ(ierr); 36816016685SHong Zhang if (pcnone){ 36916016685SHong Zhang flag = CVSpgmr(mem,PREC_NONE,0); 370e32f2f54SBarry Smith if (flag) SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVSpgmr() fails, flag %d",flag); 37116016685SHong Zhang } else { 37216016685SHong Zhang flag = CVSpgmr(mem,PREC_LEFT,0); 373e32f2f54SBarry Smith if (flag) SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVSpgmr() fails, flag %d",flag); 37416016685SHong Zhang 37516016685SHong Zhang /* Set preconditioner and solve routines Precond and PSolve, 37616016685SHong Zhang and the pointer to the user-defined block data */ 37716016685SHong Zhang flag = CVSpilsSetPreconditioner(mem,TSPrecond_Sundials,TSPSolve_Sundials); 378e32f2f54SBarry Smith if (flag) SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVSpilsSetPreconditioner() fails, flag %d", flag); 37916016685SHong Zhang } 38016016685SHong Zhang 38116016685SHong Zhang flag = CVSpilsSetGSType(mem, MODIFIED_GS); 382e32f2f54SBarry Smith if (flag) SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_LIB,"CVSpgmrSetGSType() fails, flag %d",flag); 3837cb94ee6SHong Zhang PetscFunctionReturn(0); 3847cb94ee6SHong Zhang } 3857cb94ee6SHong Zhang 3866fadb2cdSHong Zhang /* type of CVODE linear multistep method */ 387dfcd32c8SHong Zhang const char *TSSundialsLmmTypes[] = {"","adams","bdf","TSSundialsLmmType","SUNDIALS_",0}; 3886fadb2cdSHong Zhang /* type of G-S orthogonalization used by CVODE linear solver */ 389dfcd32c8SHong Zhang const char *TSSundialsGramSchmidtTypes[] = {"","modified","classical","TSSundialsGramSchmidtType","SUNDIALS_",0}; 390a04cf4d8SBarry Smith 3917cb94ee6SHong Zhang #undef __FUNCT__ 3927cb94ee6SHong Zhang #define __FUNCT__ "TSSetFromOptions_Sundials_Nonlinear" 3937cb94ee6SHong Zhang PetscErrorCode TSSetFromOptions_Sundials_Nonlinear(TS ts) 3947cb94ee6SHong Zhang { 3957cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 3967cb94ee6SHong Zhang PetscErrorCode ierr; 3977cb94ee6SHong Zhang int indx; 398ace3abfcSBarry Smith PetscBool flag; 3997cb94ee6SHong Zhang 4007cb94ee6SHong Zhang PetscFunctionBegin; 4017cb94ee6SHong Zhang ierr = PetscOptionsHead("SUNDIALS ODE solver options");CHKERRQ(ierr); 4026fadb2cdSHong Zhang ierr = PetscOptionsEList("-ts_sundials_type","Scheme","TSSundialsSetType",TSSundialsLmmTypes,3,TSSundialsLmmTypes[cvode->cvode_type],&indx,&flag);CHKERRQ(ierr); 4037cb94ee6SHong Zhang if (flag) { 4046fadb2cdSHong Zhang ierr = TSSundialsSetType(ts,(TSSundialsLmmType)indx);CHKERRQ(ierr); 4057cb94ee6SHong Zhang } 4066fadb2cdSHong Zhang ierr = PetscOptionsEList("-ts_sundials_gramschmidt_type","Type of orthogonalization","TSSundialsSetGramSchmidtType",TSSundialsGramSchmidtTypes,3,TSSundialsGramSchmidtTypes[cvode->gtype],&indx,&flag);CHKERRQ(ierr); 4077cb94ee6SHong Zhang if (flag) { 4087cb94ee6SHong Zhang ierr = TSSundialsSetGramSchmidtType(ts,(TSSundialsGramSchmidtType)indx);CHKERRQ(ierr); 4097cb94ee6SHong Zhang } 4107cb94ee6SHong Zhang ierr = PetscOptionsReal("-ts_sundials_atol","Absolute tolerance for convergence","TSSundialsSetTolerance",cvode->abstol,&cvode->abstol,PETSC_NULL);CHKERRQ(ierr); 4117cb94ee6SHong Zhang ierr = PetscOptionsReal("-ts_sundials_rtol","Relative tolerance for convergence","TSSundialsSetTolerance",cvode->reltol,&cvode->reltol,PETSC_NULL);CHKERRQ(ierr); 412f1cd61daSJed Brown ierr = PetscOptionsReal("-ts_sundials_mindt","Minimum step size","TSSundialsSetMinTimeStep",cvode->mindt,&cvode->mindt,PETSC_NULL);CHKERRQ(ierr); 413f1cd61daSJed Brown ierr = PetscOptionsReal("-ts_sundials_maxdt","Maximum step size","TSSundialsSetMaxTimeStep",cvode->maxdt,&cvode->maxdt,PETSC_NULL);CHKERRQ(ierr); 4147cb94ee6SHong Zhang ierr = PetscOptionsReal("-ts_sundials_linear_tolerance","Convergence tolerance for linear solve","TSSundialsSetLinearTolerance",cvode->linear_tol,&cvode->linear_tol,&flag);CHKERRQ(ierr); 4157cb94ee6SHong Zhang ierr = PetscOptionsInt("-ts_sundials_gmres_restart","Number of GMRES orthogonalization directions","TSSundialsSetGMRESRestart",cvode->restart,&cvode->restart,&flag);CHKERRQ(ierr); 416acfcf0e5SJed Brown ierr = PetscOptionsBool("-ts_sundials_exact_final_time","Interpolate output to stop exactly at the final time","TSSundialsSetExactFinalTime",cvode->exact_final_time,&cvode->exact_final_time,PETSC_NULL);CHKERRQ(ierr); 417acfcf0e5SJed Brown ierr = PetscOptionsBool("-ts_sundials_monitor_steps","Monitor SUNDIALS internel steps","TSSundialsMonitorInternalSteps",cvode->monitorstep,&cvode->monitorstep,PETSC_NULL);CHKERRQ(ierr); 4187cb94ee6SHong Zhang ierr = PetscOptionsTail();CHKERRQ(ierr); 4197cb94ee6SHong Zhang PetscFunctionReturn(0); 4207cb94ee6SHong Zhang } 4217cb94ee6SHong Zhang 4227cb94ee6SHong Zhang #undef __FUNCT__ 4237cb94ee6SHong Zhang #define __FUNCT__ "TSView_Sundials" 4247cb94ee6SHong Zhang PetscErrorCode TSView_Sundials(TS ts,PetscViewer viewer) 4257cb94ee6SHong Zhang { 4267cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 4277cb94ee6SHong Zhang PetscErrorCode ierr; 4287cb94ee6SHong Zhang char *type; 4297cb94ee6SHong Zhang char atype[] = "Adams"; 4307cb94ee6SHong Zhang char btype[] = "BDF: backward differentiation formula"; 431ace3abfcSBarry Smith PetscBool iascii,isstring; 4322c823083SHong Zhang long int nsteps,its,nfevals,nlinsetups,nfails,itmp; 4332c823083SHong Zhang PetscInt qlast,qcur; 4345d47aee6SHong Zhang PetscReal hinused,hlast,hcur,tcur,tolsfac; 4357cb94ee6SHong Zhang 4367cb94ee6SHong Zhang PetscFunctionBegin; 4377cb94ee6SHong Zhang if (cvode->cvode_type == SUNDIALS_ADAMS) {type = atype;} 4387cb94ee6SHong Zhang else {type = btype;} 4397cb94ee6SHong Zhang 4402692d6eeSBarry Smith ierr = PetscTypeCompare((PetscObject)viewer,PETSCVIEWERASCII,&iascii);CHKERRQ(ierr); 4412692d6eeSBarry Smith ierr = PetscTypeCompare((PetscObject)viewer,PETSCVIEWERSTRING,&isstring);CHKERRQ(ierr); 4427cb94ee6SHong Zhang if (iascii) { 4437cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials integrater does not use SNES!\n");CHKERRQ(ierr); 4447cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials integrater type %s\n",type);CHKERRQ(ierr); 4457cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials abs tol %g rel tol %g\n",cvode->abstol,cvode->reltol);CHKERRQ(ierr); 4467cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials linear solver tolerance factor %g\n",cvode->linear_tol);CHKERRQ(ierr); 4477cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials GMRES max iterations (same as restart in SUNDIALS) %D\n",cvode->restart);CHKERRQ(ierr); 4487cb94ee6SHong Zhang if (cvode->gtype == SUNDIALS_MODIFIED_GS) { 4497cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials using modified Gram-Schmidt for orthogonalization in GMRES\n");CHKERRQ(ierr); 4507cb94ee6SHong Zhang } else { 4517cb94ee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials using unmodified (classical) Gram-Schmidt for orthogonalization in GMRES\n");CHKERRQ(ierr); 4527cb94ee6SHong Zhang } 453f1cd61daSJed Brown if (cvode->mindt > 0) {ierr = PetscViewerASCIIPrintf(viewer,"Sundials minimum time step %g\n",cvode->mindt);CHKERRQ(ierr);} 454f1cd61daSJed Brown if (cvode->maxdt > 0) {ierr = PetscViewerASCIIPrintf(viewer,"Sundials maximum time step %g\n",cvode->maxdt);CHKERRQ(ierr);} 4552c823083SHong Zhang 4565d47aee6SHong Zhang /* Outputs from CVODE, CVSPILS */ 4575d47aee6SHong Zhang ierr = CVodeGetTolScaleFactor(cvode->mem,&tolsfac);CHKERRQ(ierr); 4585d47aee6SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials suggested factor for tolerance scaling %g\n",tolsfac);CHKERRQ(ierr); 4592c823083SHong Zhang ierr = CVodeGetIntegratorStats(cvode->mem,&nsteps,&nfevals, 4602c823083SHong Zhang &nlinsetups,&nfails,&qlast,&qcur, 4612c823083SHong Zhang &hinused,&hlast,&hcur,&tcur);CHKERRQ(ierr); 4622c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials cumulative number of internal steps %D\n",nsteps);CHKERRQ(ierr); 4632c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of calls to rhs function %D\n",nfevals);CHKERRQ(ierr); 4642c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of calls to linear solver setup function %D\n",nlinsetups);CHKERRQ(ierr); 4652c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of error test failures %D\n",nfails);CHKERRQ(ierr); 4662c823083SHong Zhang 4672c823083SHong Zhang ierr = CVodeGetNonlinSolvStats(cvode->mem,&its,&nfails);CHKERRQ(ierr); 4682c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of nonlinear solver iterations %D\n",its);CHKERRQ(ierr); 4692c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of nonlinear convergence failure %D\n",nfails);CHKERRQ(ierr); 4702c823083SHong Zhang 4712c823083SHong Zhang ierr = CVSpilsGetNumLinIters(cvode->mem, &its);CHKERRQ(ierr); /* its = no. of calls to TSPrecond_Sundials() */ 4722c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of linear iterations %D\n",its);CHKERRQ(ierr); 4732c823083SHong Zhang ierr = CVSpilsGetNumConvFails(cvode->mem,&itmp);CHKERRQ(ierr); 4742c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of linear convergence failures %D\n",itmp);CHKERRQ(ierr); 4752c823083SHong Zhang ierr = CVSpilsGetNumPrecEvals(cvode->mem,&itmp);CHKERRQ(ierr); 4762c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of preconditioner evaluations %D\n",itmp);CHKERRQ(ierr); 4772c823083SHong Zhang ierr = CVSpilsGetNumPrecSolves(cvode->mem,&itmp);CHKERRQ(ierr); 4782c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of preconditioner solves %D\n",itmp);CHKERRQ(ierr); 4792c823083SHong Zhang ierr = CVSpilsGetNumJtimesEvals(cvode->mem,&itmp);CHKERRQ(ierr); 4802c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of Jacobian-vector product evaluations %D\n",itmp);CHKERRQ(ierr); 4812c823083SHong Zhang ierr = CVSpilsGetNumRhsEvals(cvode->mem,&itmp);CHKERRQ(ierr); 4822c823083SHong Zhang ierr = PetscViewerASCIIPrintf(viewer,"Sundials no. of rhs calls for finite diff. Jacobian-vector evals %D\n",itmp);CHKERRQ(ierr); 4837cb94ee6SHong Zhang } else if (isstring) { 4847cb94ee6SHong Zhang ierr = PetscViewerStringSPrintf(viewer,"Sundials type %s",type);CHKERRQ(ierr); 4857cb94ee6SHong Zhang } else { 486e32f2f54SBarry Smith SETERRQ1(PETSC_COMM_SELF,PETSC_ERR_SUP,"Viewer type %s not supported by TS Sundials",((PetscObject)viewer)->type_name); 4877cb94ee6SHong Zhang } 4887cb94ee6SHong Zhang ierr = PetscViewerASCIIPushTab(viewer);CHKERRQ(ierr); 4897cb94ee6SHong Zhang ierr = PCView(cvode->pc,viewer);CHKERRQ(ierr); 4907cb94ee6SHong Zhang ierr = PetscViewerASCIIPopTab(viewer);CHKERRQ(ierr); 4917cb94ee6SHong Zhang PetscFunctionReturn(0); 4927cb94ee6SHong Zhang } 4937cb94ee6SHong Zhang 4947cb94ee6SHong Zhang 4957cb94ee6SHong Zhang /* --------------------------------------------------------------------------*/ 4967cb94ee6SHong Zhang EXTERN_C_BEGIN 4977cb94ee6SHong Zhang #undef __FUNCT__ 4987cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetType_Sundials" 4997087cfbeSBarry Smith PetscErrorCode TSSundialsSetType_Sundials(TS ts,TSSundialsLmmType type) 5007cb94ee6SHong Zhang { 5017cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 5027cb94ee6SHong Zhang 5037cb94ee6SHong Zhang PetscFunctionBegin; 5047cb94ee6SHong Zhang cvode->cvode_type = type; 5057cb94ee6SHong Zhang PetscFunctionReturn(0); 5067cb94ee6SHong Zhang } 5077cb94ee6SHong Zhang EXTERN_C_END 5087cb94ee6SHong Zhang 5097cb94ee6SHong Zhang EXTERN_C_BEGIN 5107cb94ee6SHong Zhang #undef __FUNCT__ 5117cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetGMRESRestart_Sundials" 5127087cfbeSBarry Smith PetscErrorCode TSSundialsSetGMRESRestart_Sundials(TS ts,int restart) 5137cb94ee6SHong Zhang { 5147cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 5157cb94ee6SHong Zhang 5167cb94ee6SHong Zhang PetscFunctionBegin; 5177cb94ee6SHong Zhang cvode->restart = restart; 5187cb94ee6SHong Zhang PetscFunctionReturn(0); 5197cb94ee6SHong Zhang } 5207cb94ee6SHong Zhang EXTERN_C_END 5217cb94ee6SHong Zhang 5227cb94ee6SHong Zhang EXTERN_C_BEGIN 5237cb94ee6SHong Zhang #undef __FUNCT__ 5247cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetLinearTolerance_Sundials" 5257087cfbeSBarry Smith PetscErrorCode TSSundialsSetLinearTolerance_Sundials(TS ts,double tol) 5267cb94ee6SHong Zhang { 5277cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 5287cb94ee6SHong Zhang 5297cb94ee6SHong Zhang PetscFunctionBegin; 5307cb94ee6SHong Zhang cvode->linear_tol = tol; 5317cb94ee6SHong Zhang PetscFunctionReturn(0); 5327cb94ee6SHong Zhang } 5337cb94ee6SHong Zhang EXTERN_C_END 5347cb94ee6SHong Zhang 5357cb94ee6SHong Zhang EXTERN_C_BEGIN 5367cb94ee6SHong Zhang #undef __FUNCT__ 5377cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetGramSchmidtType_Sundials" 5387087cfbeSBarry Smith PetscErrorCode TSSundialsSetGramSchmidtType_Sundials(TS ts,TSSundialsGramSchmidtType type) 5397cb94ee6SHong Zhang { 5407cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 5417cb94ee6SHong Zhang 5427cb94ee6SHong Zhang PetscFunctionBegin; 5437cb94ee6SHong Zhang cvode->gtype = type; 5447cb94ee6SHong Zhang PetscFunctionReturn(0); 5457cb94ee6SHong Zhang } 5467cb94ee6SHong Zhang EXTERN_C_END 5477cb94ee6SHong Zhang 5487cb94ee6SHong Zhang EXTERN_C_BEGIN 5497cb94ee6SHong Zhang #undef __FUNCT__ 5507cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetTolerance_Sundials" 5517087cfbeSBarry Smith PetscErrorCode TSSundialsSetTolerance_Sundials(TS ts,double aabs,double rel) 5527cb94ee6SHong Zhang { 5537cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 5547cb94ee6SHong Zhang 5557cb94ee6SHong Zhang PetscFunctionBegin; 5567cb94ee6SHong Zhang if (aabs != PETSC_DECIDE) cvode->abstol = aabs; 5577cb94ee6SHong Zhang if (rel != PETSC_DECIDE) cvode->reltol = rel; 5587cb94ee6SHong Zhang PetscFunctionReturn(0); 5597cb94ee6SHong Zhang } 5607cb94ee6SHong Zhang EXTERN_C_END 5617cb94ee6SHong Zhang 5627cb94ee6SHong Zhang EXTERN_C_BEGIN 5637cb94ee6SHong Zhang #undef __FUNCT__ 564f1cd61daSJed Brown #define __FUNCT__ "TSSundialsSetMinTimeStep_Sundials" 5657087cfbeSBarry Smith PetscErrorCode TSSundialsSetMinTimeStep_Sundials(TS ts,PetscReal mindt) 566f1cd61daSJed Brown { 567f1cd61daSJed Brown TS_Sundials *cvode = (TS_Sundials*)ts->data; 568f1cd61daSJed Brown 569f1cd61daSJed Brown PetscFunctionBegin; 570f1cd61daSJed Brown cvode->mindt = mindt; 571f1cd61daSJed Brown PetscFunctionReturn(0); 572f1cd61daSJed Brown } 573f1cd61daSJed Brown EXTERN_C_END 574f1cd61daSJed Brown 575f1cd61daSJed Brown EXTERN_C_BEGIN 576f1cd61daSJed Brown #undef __FUNCT__ 577f1cd61daSJed Brown #define __FUNCT__ "TSSundialsSetMaxTimeStep_Sundials" 5787087cfbeSBarry Smith PetscErrorCode TSSundialsSetMaxTimeStep_Sundials(TS ts,PetscReal maxdt) 579f1cd61daSJed Brown { 580f1cd61daSJed Brown TS_Sundials *cvode = (TS_Sundials*)ts->data; 581f1cd61daSJed Brown 582f1cd61daSJed Brown PetscFunctionBegin; 583f1cd61daSJed Brown cvode->maxdt = maxdt; 584f1cd61daSJed Brown PetscFunctionReturn(0); 585f1cd61daSJed Brown } 586f1cd61daSJed Brown EXTERN_C_END 587f1cd61daSJed Brown 588f1cd61daSJed Brown EXTERN_C_BEGIN 589f1cd61daSJed Brown #undef __FUNCT__ 5907cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsGetPC_Sundials" 5917087cfbeSBarry Smith PetscErrorCode TSSundialsGetPC_Sundials(TS ts,PC *pc) 5927cb94ee6SHong Zhang { 5937cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 5947cb94ee6SHong Zhang 5957cb94ee6SHong Zhang PetscFunctionBegin; 5967cb94ee6SHong Zhang *pc = cvode->pc; 5977cb94ee6SHong Zhang PetscFunctionReturn(0); 5987cb94ee6SHong Zhang } 5997cb94ee6SHong Zhang EXTERN_C_END 6007cb94ee6SHong Zhang 6017cb94ee6SHong Zhang EXTERN_C_BEGIN 6027cb94ee6SHong Zhang #undef __FUNCT__ 6037cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsGetIterations_Sundials" 6047087cfbeSBarry Smith PetscErrorCode TSSundialsGetIterations_Sundials(TS ts,int *nonlin,int *lin) 6057cb94ee6SHong Zhang { 6067cb94ee6SHong Zhang PetscFunctionBegin; 6072c823083SHong Zhang if (nonlin) *nonlin = ts->nonlinear_its; 6082c823083SHong Zhang if (lin) *lin = ts->linear_its; 6097cb94ee6SHong Zhang PetscFunctionReturn(0); 6107cb94ee6SHong Zhang } 6117cb94ee6SHong Zhang EXTERN_C_END 6127cb94ee6SHong Zhang 6137cb94ee6SHong Zhang EXTERN_C_BEGIN 6147cb94ee6SHong Zhang #undef __FUNCT__ 6157cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetExactFinalTime_Sundials" 6167087cfbeSBarry Smith PetscErrorCode TSSundialsSetExactFinalTime_Sundials(TS ts,PetscBool s) 6177cb94ee6SHong Zhang { 6187cb94ee6SHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 6197cb94ee6SHong Zhang 6207cb94ee6SHong Zhang PetscFunctionBegin; 6217cb94ee6SHong Zhang cvode->exact_final_time = s; 6227cb94ee6SHong Zhang PetscFunctionReturn(0); 6237cb94ee6SHong Zhang } 6247cb94ee6SHong Zhang EXTERN_C_END 6252bfc04deSHong Zhang 6262bfc04deSHong Zhang EXTERN_C_BEGIN 6272bfc04deSHong Zhang #undef __FUNCT__ 6282bfc04deSHong Zhang #define __FUNCT__ "TSSundialsMonitorInternalSteps_Sundials" 6297087cfbeSBarry Smith PetscErrorCode TSSundialsMonitorInternalSteps_Sundials(TS ts,PetscBool s) 6302bfc04deSHong Zhang { 6312bfc04deSHong Zhang TS_Sundials *cvode = (TS_Sundials*)ts->data; 6322bfc04deSHong Zhang 6332bfc04deSHong Zhang PetscFunctionBegin; 6342bfc04deSHong Zhang cvode->monitorstep = s; 6352bfc04deSHong Zhang PetscFunctionReturn(0); 6362bfc04deSHong Zhang } 6372bfc04deSHong Zhang EXTERN_C_END 6387cb94ee6SHong Zhang /* -------------------------------------------------------------------------------------------*/ 6397cb94ee6SHong Zhang 6407cb94ee6SHong Zhang #undef __FUNCT__ 6417cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsGetIterations" 6427cb94ee6SHong Zhang /*@C 6437cb94ee6SHong Zhang TSSundialsGetIterations - Gets the number of nonlinear and linear iterations used so far by Sundials. 6447cb94ee6SHong Zhang 6457cb94ee6SHong Zhang Not Collective 6467cb94ee6SHong Zhang 6477cb94ee6SHong Zhang Input parameters: 6487cb94ee6SHong Zhang . ts - the time-step context 6497cb94ee6SHong Zhang 6507cb94ee6SHong Zhang Output Parameters: 6517cb94ee6SHong Zhang + nonlin - number of nonlinear iterations 6527cb94ee6SHong Zhang - lin - number of linear iterations 6537cb94ee6SHong Zhang 6547cb94ee6SHong Zhang Level: advanced 6557cb94ee6SHong Zhang 6567cb94ee6SHong Zhang Notes: 6577cb94ee6SHong Zhang These return the number since the creation of the TS object 6587cb94ee6SHong Zhang 6597cb94ee6SHong Zhang .keywords: non-linear iterations, linear iterations 6607cb94ee6SHong Zhang 6617cb94ee6SHong Zhang .seealso: TSSundialsSetType(), TSSundialsSetGMRESRestart(), 6627cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 6637cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 664f1cd61daSJed Brown TSSundialsSetLinearTolerance(), TSSundialsGetPC(), TSSundialsSetExactFinalTime() 6657cb94ee6SHong Zhang 6667cb94ee6SHong Zhang @*/ 6677087cfbeSBarry Smith PetscErrorCode TSSundialsGetIterations(TS ts,int *nonlin,int *lin) 6687cb94ee6SHong Zhang { 6694ac538c5SBarry Smith PetscErrorCode ierr; 6707cb94ee6SHong Zhang 6717cb94ee6SHong Zhang PetscFunctionBegin; 6724ac538c5SBarry Smith ierr = PetscUseMethod(ts,"TSSundialsGetIterations_C",(TS,int*,int*),(ts,nonlin,lin));CHKERRQ(ierr); 6737cb94ee6SHong Zhang PetscFunctionReturn(0); 6747cb94ee6SHong Zhang } 6757cb94ee6SHong Zhang 6767cb94ee6SHong Zhang #undef __FUNCT__ 6777cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetType" 6787cb94ee6SHong Zhang /*@ 6797cb94ee6SHong Zhang TSSundialsSetType - Sets the method that Sundials will use for integration. 6807cb94ee6SHong Zhang 6813f9fe445SBarry Smith Logically Collective on TS 6827cb94ee6SHong Zhang 6837cb94ee6SHong Zhang Input parameters: 6847cb94ee6SHong Zhang + ts - the time-step context 6857cb94ee6SHong Zhang - type - one of SUNDIALS_ADAMS or SUNDIALS_BDF 6867cb94ee6SHong Zhang 6877cb94ee6SHong Zhang Level: intermediate 6887cb94ee6SHong Zhang 6897cb94ee6SHong Zhang .keywords: Adams, backward differentiation formula 6907cb94ee6SHong Zhang 6917cb94ee6SHong Zhang .seealso: TSSundialsGetIterations(), TSSundialsSetGMRESRestart(), 6927cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 6937cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 6947cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC(), 6957cb94ee6SHong Zhang TSSundialsSetExactFinalTime() 6967cb94ee6SHong Zhang @*/ 6977087cfbeSBarry Smith PetscErrorCode TSSundialsSetType(TS ts,TSSundialsLmmType type) 6987cb94ee6SHong Zhang { 6994ac538c5SBarry Smith PetscErrorCode ierr; 7007cb94ee6SHong Zhang 7017cb94ee6SHong Zhang PetscFunctionBegin; 7024ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetType_C",(TS,TSSundialsLmmType),(ts,type));CHKERRQ(ierr); 7037cb94ee6SHong Zhang PetscFunctionReturn(0); 7047cb94ee6SHong Zhang } 7057cb94ee6SHong Zhang 7067cb94ee6SHong Zhang #undef __FUNCT__ 7077cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetGMRESRestart" 7087cb94ee6SHong Zhang /*@ 7097cb94ee6SHong Zhang TSSundialsSetGMRESRestart - Sets the dimension of the Krylov space used by 7107cb94ee6SHong Zhang GMRES in the linear solver in SUNDIALS. SUNDIALS DOES NOT use restarted GMRES so 7117cb94ee6SHong Zhang this is ALSO the maximum number of GMRES steps that will be used. 7127cb94ee6SHong Zhang 7133f9fe445SBarry Smith Logically Collective on TS 7147cb94ee6SHong Zhang 7157cb94ee6SHong Zhang Input parameters: 7167cb94ee6SHong Zhang + ts - the time-step context 7177cb94ee6SHong Zhang - restart - number of direction vectors (the restart size). 7187cb94ee6SHong Zhang 7197cb94ee6SHong Zhang Level: advanced 7207cb94ee6SHong Zhang 7217cb94ee6SHong Zhang .keywords: GMRES, restart 7227cb94ee6SHong Zhang 7237cb94ee6SHong Zhang .seealso: TSSundialsGetIterations(), TSSundialsSetType(), 7247cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 7257cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 7267cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC(), 7277cb94ee6SHong Zhang TSSundialsSetExactFinalTime() 7287cb94ee6SHong Zhang 7297cb94ee6SHong Zhang @*/ 7307087cfbeSBarry Smith PetscErrorCode TSSundialsSetGMRESRestart(TS ts,int restart) 7317cb94ee6SHong Zhang { 7324ac538c5SBarry Smith PetscErrorCode ierr; 7337cb94ee6SHong Zhang 7347cb94ee6SHong Zhang PetscFunctionBegin; 735c5eb9154SBarry Smith PetscValidLogicalCollectiveInt(ts,restart,2); 7364ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetGMRESRestart_C",(TS,int),(ts,restart));CHKERRQ(ierr); 7377cb94ee6SHong Zhang PetscFunctionReturn(0); 7387cb94ee6SHong Zhang } 7397cb94ee6SHong Zhang 7407cb94ee6SHong Zhang #undef __FUNCT__ 7417cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetLinearTolerance" 7427cb94ee6SHong Zhang /*@ 7437cb94ee6SHong Zhang TSSundialsSetLinearTolerance - Sets the tolerance used to solve the linear 7447cb94ee6SHong Zhang system by SUNDIALS. 7457cb94ee6SHong Zhang 7463f9fe445SBarry Smith Logically Collective on TS 7477cb94ee6SHong Zhang 7487cb94ee6SHong Zhang Input parameters: 7497cb94ee6SHong Zhang + ts - the time-step context 7507cb94ee6SHong Zhang - tol - the factor by which the tolerance on the nonlinear solver is 7517cb94ee6SHong Zhang multiplied to get the tolerance on the linear solver, .05 by default. 7527cb94ee6SHong Zhang 7537cb94ee6SHong Zhang Level: advanced 7547cb94ee6SHong Zhang 7557cb94ee6SHong Zhang .keywords: GMRES, linear convergence tolerance, SUNDIALS 7567cb94ee6SHong Zhang 7577cb94ee6SHong Zhang .seealso: TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 7587cb94ee6SHong Zhang TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 7597cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 7607cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC(), 7617cb94ee6SHong Zhang TSSundialsSetExactFinalTime() 7627cb94ee6SHong Zhang 7637cb94ee6SHong Zhang @*/ 7647087cfbeSBarry Smith PetscErrorCode TSSundialsSetLinearTolerance(TS ts,double tol) 7657cb94ee6SHong Zhang { 7664ac538c5SBarry Smith PetscErrorCode ierr; 7677cb94ee6SHong Zhang 7687cb94ee6SHong Zhang PetscFunctionBegin; 769c5eb9154SBarry Smith PetscValidLogicalCollectiveReal(ts,tol,2); 7704ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetLinearTolerance_C",(TS,double),(ts,tol));CHKERRQ(ierr); 7717cb94ee6SHong Zhang PetscFunctionReturn(0); 7727cb94ee6SHong Zhang } 7737cb94ee6SHong Zhang 7747cb94ee6SHong Zhang #undef __FUNCT__ 7757cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetGramSchmidtType" 7767cb94ee6SHong Zhang /*@ 7777cb94ee6SHong Zhang TSSundialsSetGramSchmidtType - Sets type of orthogonalization used 7787cb94ee6SHong Zhang in GMRES method by SUNDIALS linear solver. 7797cb94ee6SHong Zhang 7803f9fe445SBarry Smith Logically Collective on TS 7817cb94ee6SHong Zhang 7827cb94ee6SHong Zhang Input parameters: 7837cb94ee6SHong Zhang + ts - the time-step context 7847cb94ee6SHong Zhang - type - either SUNDIALS_MODIFIED_GS or SUNDIALS_CLASSICAL_GS 7857cb94ee6SHong Zhang 7867cb94ee6SHong Zhang Level: advanced 7877cb94ee6SHong Zhang 7887cb94ee6SHong Zhang .keywords: Sundials, orthogonalization 7897cb94ee6SHong Zhang 7907cb94ee6SHong Zhang .seealso: TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 7917cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), 7927cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 7937cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC(), 7947cb94ee6SHong Zhang TSSundialsSetExactFinalTime() 7957cb94ee6SHong Zhang 7967cb94ee6SHong Zhang @*/ 7977087cfbeSBarry Smith PetscErrorCode TSSundialsSetGramSchmidtType(TS ts,TSSundialsGramSchmidtType type) 7987cb94ee6SHong Zhang { 7994ac538c5SBarry Smith PetscErrorCode ierr; 8007cb94ee6SHong Zhang 8017cb94ee6SHong Zhang PetscFunctionBegin; 8024ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetGramSchmidtType_C",(TS,TSSundialsGramSchmidtType),(ts,type));CHKERRQ(ierr); 8037cb94ee6SHong Zhang PetscFunctionReturn(0); 8047cb94ee6SHong Zhang } 8057cb94ee6SHong Zhang 8067cb94ee6SHong Zhang #undef __FUNCT__ 8077cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetTolerance" 8087cb94ee6SHong Zhang /*@ 8097cb94ee6SHong Zhang TSSundialsSetTolerance - Sets the absolute and relative tolerance used by 8107cb94ee6SHong Zhang Sundials for error control. 8117cb94ee6SHong Zhang 8123f9fe445SBarry Smith Logically Collective on TS 8137cb94ee6SHong Zhang 8147cb94ee6SHong Zhang Input parameters: 8157cb94ee6SHong Zhang + ts - the time-step context 8167cb94ee6SHong Zhang . aabs - the absolute tolerance 8177cb94ee6SHong Zhang - rel - the relative tolerance 8187cb94ee6SHong Zhang 8197cb94ee6SHong Zhang See the Cvode/Sundials users manual for exact details on these parameters. Essentially 8207cb94ee6SHong Zhang these regulate the size of the error for a SINGLE timestep. 8217cb94ee6SHong Zhang 8227cb94ee6SHong Zhang Level: intermediate 8237cb94ee6SHong Zhang 8247cb94ee6SHong Zhang .keywords: Sundials, tolerance 8257cb94ee6SHong Zhang 8267cb94ee6SHong Zhang .seealso: TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 8277cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), 8287cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 8297cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC(), 8307cb94ee6SHong Zhang TSSundialsSetExactFinalTime() 8317cb94ee6SHong Zhang 8327cb94ee6SHong Zhang @*/ 8337087cfbeSBarry Smith PetscErrorCode TSSundialsSetTolerance(TS ts,double aabs,double rel) 8347cb94ee6SHong Zhang { 8354ac538c5SBarry Smith PetscErrorCode ierr; 8367cb94ee6SHong Zhang 8377cb94ee6SHong Zhang PetscFunctionBegin; 8384ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetTolerance_C",(TS,double,double),(ts,aabs,rel));CHKERRQ(ierr); 8397cb94ee6SHong Zhang PetscFunctionReturn(0); 8407cb94ee6SHong Zhang } 8417cb94ee6SHong Zhang 8427cb94ee6SHong Zhang #undef __FUNCT__ 8437cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsGetPC" 8447cb94ee6SHong Zhang /*@ 8457cb94ee6SHong Zhang TSSundialsGetPC - Extract the PC context from a time-step context for Sundials. 8467cb94ee6SHong Zhang 8477cb94ee6SHong Zhang Input Parameter: 8487cb94ee6SHong Zhang . ts - the time-step context 8497cb94ee6SHong Zhang 8507cb94ee6SHong Zhang Output Parameter: 8517cb94ee6SHong Zhang . pc - the preconditioner context 8527cb94ee6SHong Zhang 8537cb94ee6SHong Zhang Level: advanced 8547cb94ee6SHong Zhang 8557cb94ee6SHong Zhang .seealso: TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 8567cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 8577cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 8587cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance() 8597cb94ee6SHong Zhang @*/ 8607087cfbeSBarry Smith PetscErrorCode TSSundialsGetPC(TS ts,PC *pc) 8617cb94ee6SHong Zhang { 8624ac538c5SBarry Smith PetscErrorCode ierr; 8637cb94ee6SHong Zhang 8647cb94ee6SHong Zhang PetscFunctionBegin; 8654ac538c5SBarry Smith ierr = PetscUseMethod(ts,"TSSundialsGetPC_C",(TS,PC *),(ts,pc));CHKERRQ(ierr); 8667cb94ee6SHong Zhang PetscFunctionReturn(0); 8677cb94ee6SHong Zhang } 8687cb94ee6SHong Zhang 8697cb94ee6SHong Zhang #undef __FUNCT__ 8707cb94ee6SHong Zhang #define __FUNCT__ "TSSundialsSetExactFinalTime" 8717cb94ee6SHong Zhang /*@ 8727cb94ee6SHong Zhang TSSundialsSetExactFinalTime - Determines if Sundials interpolates solution to the 8737cb94ee6SHong Zhang exact final time requested by the user or just returns it at the final time 8747cb94ee6SHong Zhang it computed. (Defaults to true). 8757cb94ee6SHong Zhang 8767cb94ee6SHong Zhang Input Parameter: 8777cb94ee6SHong Zhang + ts - the time-step context 8787cb94ee6SHong Zhang - ft - PETSC_TRUE if interpolates, else PETSC_FALSE 8797cb94ee6SHong Zhang 8807cb94ee6SHong Zhang Level: beginner 8817cb94ee6SHong Zhang 8827cb94ee6SHong Zhang .seealso:TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 8837cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 8847cb94ee6SHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 8857cb94ee6SHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC() 8867cb94ee6SHong Zhang @*/ 8877087cfbeSBarry Smith PetscErrorCode TSSundialsSetExactFinalTime(TS ts,PetscBool ft) 8887cb94ee6SHong Zhang { 8894ac538c5SBarry Smith PetscErrorCode ierr; 8907cb94ee6SHong Zhang 8917cb94ee6SHong Zhang PetscFunctionBegin; 8924ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetExactFinalTime_C",(TS,PetscBool),(ts,ft));CHKERRQ(ierr); 8937cb94ee6SHong Zhang PetscFunctionReturn(0); 8947cb94ee6SHong Zhang } 8957cb94ee6SHong Zhang 8962bfc04deSHong Zhang #undef __FUNCT__ 897f1cd61daSJed Brown #define __FUNCT__ "TSSundialsSetMinTimeStep" 898f1cd61daSJed Brown /*@ 899f1cd61daSJed Brown TSSundialsSetMinTimeStep - Smallest time step to be chosen by the adaptive controller. 900f1cd61daSJed Brown 901f1cd61daSJed Brown Input Parameter: 902f1cd61daSJed Brown + ts - the time-step context 903f1cd61daSJed Brown - mindt - lowest time step if positive, negative to deactivate 904f1cd61daSJed Brown 905fc6b9e64SJed Brown Note: 906fc6b9e64SJed Brown Sundials will error if it is not possible to keep the estimated truncation error below 907fc6b9e64SJed Brown the tolerance set with TSSundialsSetTolerance() without going below this step size. 908fc6b9e64SJed Brown 909f1cd61daSJed Brown Level: beginner 910f1cd61daSJed Brown 911f1cd61daSJed Brown .seealso: TSSundialsSetType(), TSSundialsSetTolerance(), 912f1cd61daSJed Brown @*/ 9137087cfbeSBarry Smith PetscErrorCode TSSundialsSetMinTimeStep(TS ts,PetscReal mindt) 914f1cd61daSJed Brown { 9154ac538c5SBarry Smith PetscErrorCode ierr; 916f1cd61daSJed Brown 917f1cd61daSJed Brown PetscFunctionBegin; 9184ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetMinTimeStep_C",(TS,PetscReal),(ts,mindt));CHKERRQ(ierr); 919f1cd61daSJed Brown PetscFunctionReturn(0); 920f1cd61daSJed Brown } 921f1cd61daSJed Brown 922f1cd61daSJed Brown #undef __FUNCT__ 923f1cd61daSJed Brown #define __FUNCT__ "TSSundialsSetMaxTimeStep" 924f1cd61daSJed Brown /*@ 925f1cd61daSJed Brown TSSundialsSetMaxTimeStep - Largest time step to be chosen by the adaptive controller. 926f1cd61daSJed Brown 927f1cd61daSJed Brown Input Parameter: 928f1cd61daSJed Brown + ts - the time-step context 929f1cd61daSJed Brown - maxdt - lowest time step if positive, negative to deactivate 930f1cd61daSJed Brown 931f1cd61daSJed Brown Level: beginner 932f1cd61daSJed Brown 933f1cd61daSJed Brown .seealso: TSSundialsSetType(), TSSundialsSetTolerance(), 934f1cd61daSJed Brown @*/ 9357087cfbeSBarry Smith PetscErrorCode TSSundialsSetMaxTimeStep(TS ts,PetscReal maxdt) 936f1cd61daSJed Brown { 9374ac538c5SBarry Smith PetscErrorCode ierr; 938f1cd61daSJed Brown 939f1cd61daSJed Brown PetscFunctionBegin; 9404ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsSetMaxTimeStep_C",(TS,PetscReal),(ts,maxdt));CHKERRQ(ierr); 941f1cd61daSJed Brown PetscFunctionReturn(0); 942f1cd61daSJed Brown } 943f1cd61daSJed Brown 944f1cd61daSJed Brown #undef __FUNCT__ 9452bfc04deSHong Zhang #define __FUNCT__ "TSSundialsMonitorInternalSteps" 9462bfc04deSHong Zhang /*@ 9472bfc04deSHong Zhang TSSundialsMonitorInternalSteps - Monitor Sundials internal steps (Defaults to false). 9482bfc04deSHong Zhang 9492bfc04deSHong Zhang Input Parameter: 9502bfc04deSHong Zhang + ts - the time-step context 9512bfc04deSHong Zhang - ft - PETSC_TRUE if monitor, else PETSC_FALSE 9522bfc04deSHong Zhang 9532bfc04deSHong Zhang Level: beginner 9542bfc04deSHong Zhang 9552bfc04deSHong Zhang .seealso:TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 9562bfc04deSHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), 9572bfc04deSHong Zhang TSSundialsGetIterations(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), 9582bfc04deSHong Zhang TSSundialsSetLinearTolerance(), TSSundialsSetTolerance(), TSSundialsGetPC() 9592bfc04deSHong Zhang @*/ 9607087cfbeSBarry Smith PetscErrorCode TSSundialsMonitorInternalSteps(TS ts,PetscBool ft) 9612bfc04deSHong Zhang { 9624ac538c5SBarry Smith PetscErrorCode ierr; 9632bfc04deSHong Zhang 9642bfc04deSHong Zhang PetscFunctionBegin; 9654ac538c5SBarry Smith ierr = PetscTryMethod(ts,"TSSundialsMonitorInternalSteps_C",(TS,PetscBool),(ts,ft));CHKERRQ(ierr); 9662bfc04deSHong Zhang PetscFunctionReturn(0); 9672bfc04deSHong Zhang } 9687cb94ee6SHong Zhang /* -------------------------------------------------------------------------------------------*/ 9697cb94ee6SHong Zhang /*MC 97096f5712cSJed Brown TSSUNDIALS - ODE solver using the LLNL CVODE/SUNDIALS package (now called SUNDIALS) 9717cb94ee6SHong Zhang 9727cb94ee6SHong Zhang Options Database: 9737cb94ee6SHong Zhang + -ts_sundials_type <bdf,adams> 9747cb94ee6SHong Zhang . -ts_sundials_gramschmidt_type <modified, classical> - type of orthogonalization inside GMRES 9757cb94ee6SHong Zhang . -ts_sundials_atol <tol> - Absolute tolerance for convergence 9767cb94ee6SHong Zhang . -ts_sundials_rtol <tol> - Relative tolerance for convergence 9777cb94ee6SHong Zhang . -ts_sundials_linear_tolerance <tol> 9787cb94ee6SHong Zhang . -ts_sundials_gmres_restart <restart> - Number of GMRES orthogonalization directions 97916016685SHong Zhang . -ts_sundials_exact_final_time - Interpolate output to stop exactly at the final time 98016016685SHong Zhang - -ts_sundials_monitor_steps - Monitor SUNDIALS internel steps 98116016685SHong Zhang 9827cb94ee6SHong Zhang 9837cb94ee6SHong Zhang Notes: This uses its own nonlinear solver and Krylov method so PETSc SNES and KSP options do not apply 9847cb94ee6SHong Zhang only PETSc PC options 9857cb94ee6SHong Zhang 9867cb94ee6SHong Zhang Level: beginner 9877cb94ee6SHong Zhang 9887cb94ee6SHong Zhang .seealso: TSCreate(), TS, TSSetType(), TSSundialsSetType(), TSSundialsSetGMRESRestart(), TSSundialsSetLinearTolerance(), 9897cb94ee6SHong Zhang TSSundialsSetGramSchmidtType(), TSSundialsSetTolerance(), TSSundialsGetPC(), TSSundialsGetIterations(), TSSundialsSetExactFinalTime() 9907cb94ee6SHong Zhang 9917cb94ee6SHong Zhang M*/ 9927cb94ee6SHong Zhang EXTERN_C_BEGIN 9937cb94ee6SHong Zhang #undef __FUNCT__ 9947cb94ee6SHong Zhang #define __FUNCT__ "TSCreate_Sundials" 9957087cfbeSBarry Smith PetscErrorCode TSCreate_Sundials(TS ts) 9967cb94ee6SHong Zhang { 9977cb94ee6SHong Zhang TS_Sundials *cvode; 9987cb94ee6SHong Zhang PetscErrorCode ierr; 9997cb94ee6SHong Zhang 10007cb94ee6SHong Zhang PetscFunctionBegin; 100117186662SBarry Smith if (ts->problem_type != TS_NONLINEAR) SETERRQ(PETSC_COMM_SELF,PETSC_ERR_SUP,"Only support for nonlinear problems"); 1002277b19d0SLisandro Dalcin ts->ops->reset = TSReset_Sundials; 100328adb3f7SHong Zhang ts->ops->destroy = TSDestroy_Sundials; 100428adb3f7SHong Zhang ts->ops->view = TSView_Sundials; 10057cb94ee6SHong Zhang ts->ops->setup = TSSetUp_Sundials_Nonlinear; 10067cb94ee6SHong Zhang ts->ops->step = TSStep_Sundials_Nonlinear; 10077cb94ee6SHong Zhang ts->ops->setfromoptions = TSSetFromOptions_Sundials_Nonlinear; 10087cb94ee6SHong Zhang 100938f2d2fdSLisandro Dalcin ierr = PetscNewLog(ts,TS_Sundials,&cvode);CHKERRQ(ierr); 10107adad957SLisandro Dalcin ierr = PCCreate(((PetscObject)ts)->comm,&cvode->pc);CHKERRQ(ierr); 10117cb94ee6SHong Zhang ierr = PetscLogObjectParent(ts,cvode->pc);CHKERRQ(ierr); 10127cb94ee6SHong Zhang ts->data = (void*)cvode; 10136fadb2cdSHong Zhang cvode->cvode_type = SUNDIALS_BDF; 10146fadb2cdSHong Zhang cvode->gtype = SUNDIALS_CLASSICAL_GS; 10157cb94ee6SHong Zhang cvode->restart = 5; 10167cb94ee6SHong Zhang cvode->linear_tol = .05; 10177cb94ee6SHong Zhang 10182bfc04deSHong Zhang cvode->exact_final_time = PETSC_TRUE; 10192bfc04deSHong Zhang cvode->monitorstep = PETSC_FALSE; 10207cb94ee6SHong Zhang 1021a07356b8SSatish Balay ierr = MPI_Comm_dup(((PetscObject)ts)->comm,&(cvode->comm_sundials));CHKERRQ(ierr); 1022f1cd61daSJed Brown 1023f1cd61daSJed Brown cvode->mindt = -1.; 1024f1cd61daSJed Brown cvode->maxdt = -1.; 1025f1cd61daSJed Brown 10267cb94ee6SHong Zhang /* set tolerance for Sundials */ 10277cb94ee6SHong Zhang cvode->reltol = 1e-6; 10282c823083SHong Zhang cvode->abstol = 1e-6; 10297cb94ee6SHong Zhang 10307cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetType_C","TSSundialsSetType_Sundials", 10317cb94ee6SHong Zhang TSSundialsSetType_Sundials);CHKERRQ(ierr); 10327cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetGMRESRestart_C", 10337cb94ee6SHong Zhang "TSSundialsSetGMRESRestart_Sundials", 10347cb94ee6SHong Zhang TSSundialsSetGMRESRestart_Sundials);CHKERRQ(ierr); 10357cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetLinearTolerance_C", 10367cb94ee6SHong Zhang "TSSundialsSetLinearTolerance_Sundials", 10377cb94ee6SHong Zhang TSSundialsSetLinearTolerance_Sundials);CHKERRQ(ierr); 10387cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetGramSchmidtType_C", 10397cb94ee6SHong Zhang "TSSundialsSetGramSchmidtType_Sundials", 10407cb94ee6SHong Zhang TSSundialsSetGramSchmidtType_Sundials);CHKERRQ(ierr); 10417cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetTolerance_C", 10427cb94ee6SHong Zhang "TSSundialsSetTolerance_Sundials", 10437cb94ee6SHong Zhang TSSundialsSetTolerance_Sundials);CHKERRQ(ierr); 1044f1cd61daSJed Brown ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetMinTimeStep_C", 1045f1cd61daSJed Brown "TSSundialsSetMinTimeStep_Sundials", 1046f1cd61daSJed Brown TSSundialsSetMinTimeStep_Sundials);CHKERRQ(ierr); 1047f1cd61daSJed Brown ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetMaxTimeStep_C", 1048f1cd61daSJed Brown "TSSundialsSetMaxTimeStep_Sundials", 1049f1cd61daSJed Brown TSSundialsSetMaxTimeStep_Sundials);CHKERRQ(ierr); 10507cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsGetPC_C", 10517cb94ee6SHong Zhang "TSSundialsGetPC_Sundials", 10527cb94ee6SHong Zhang TSSundialsGetPC_Sundials);CHKERRQ(ierr); 10537cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsGetIterations_C", 10547cb94ee6SHong Zhang "TSSundialsGetIterations_Sundials", 10557cb94ee6SHong Zhang TSSundialsGetIterations_Sundials);CHKERRQ(ierr); 10567cb94ee6SHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsSetExactFinalTime_C", 10577cb94ee6SHong Zhang "TSSundialsSetExactFinalTime_Sundials", 10587cb94ee6SHong Zhang TSSundialsSetExactFinalTime_Sundials);CHKERRQ(ierr); 10592bfc04deSHong Zhang ierr = PetscObjectComposeFunctionDynamic((PetscObject)ts,"TSSundialsMonitorInternalSteps_C", 10602bfc04deSHong Zhang "TSSundialsMonitorInternalSteps_Sundials", 10612bfc04deSHong Zhang TSSundialsMonitorInternalSteps_Sundials);CHKERRQ(ierr); 10622bfc04deSHong Zhang 10637cb94ee6SHong Zhang PetscFunctionReturn(0); 10647cb94ee6SHong Zhang } 10657cb94ee6SHong Zhang EXTERN_C_END 1066