1c4762a1bSJed Brown static char help[] = "Solves a ODE-constrained optimization problem -- finding the optimal initial conditions for the van der Pol equation.\n"; 2c4762a1bSJed Brown 30e3d61c9SBarry Smith /* 4c4762a1bSJed Brown Concepts: TS^time-dependent nonlinear problems 5c4762a1bSJed Brown Concepts: TS^van der Pol equation DAE equivalent 6ee300463SSatish Balay Concepts: TS^Optimization using adjoint sensitivity analysis 7c4762a1bSJed Brown Processors: 1 8c4762a1bSJed Brown */ 90e3d61c9SBarry Smith /* 10c4762a1bSJed Brown Notes: 11c4762a1bSJed Brown This code demonstrates how to solve an ODE-constrained optimization problem with TAO, TSAdjoint and TS. 12c4762a1bSJed Brown The nonlinear problem is written in an ODE equivalent form. 13c4762a1bSJed Brown The objective is to minimize the difference between observation and model prediction by finding optimal values for initial conditions. 14c4762a1bSJed Brown The gradient is computed with the discrete adjoint of an implicit method or an explicit method, see ex20adj.c for details. 15c4762a1bSJed Brown */ 16c4762a1bSJed Brown 17c4762a1bSJed Brown #include <petsctao.h> 18c4762a1bSJed Brown #include <petscts.h> 19c4762a1bSJed Brown 20c4762a1bSJed Brown typedef struct _n_User *User; 21c4762a1bSJed Brown struct _n_User { 22c4762a1bSJed Brown TS ts; 23c4762a1bSJed Brown PetscReal mu; 24c4762a1bSJed Brown PetscReal next_output; 25c4762a1bSJed Brown 26c4762a1bSJed Brown /* Sensitivity analysis support */ 27c4762a1bSJed Brown PetscInt steps; 28c4762a1bSJed Brown PetscReal ftime; 29c4762a1bSJed Brown Mat A; /* Jacobian matrix for ODE */ 30c4762a1bSJed Brown Mat Jacp; /* JacobianP matrix for ODE*/ 31c4762a1bSJed Brown Mat H; /* Hessian matrix for optimization */ 32c4762a1bSJed Brown Vec U,Lambda[1],Mup[1]; /* first-order adjoint variables */ 33c4762a1bSJed Brown Vec Lambda2[2]; /* second-order adjoint variables */ 34c4762a1bSJed Brown Vec Ihp1[1]; /* working space for Hessian evaluations */ 35c4762a1bSJed Brown Vec Dir; /* direction vector */ 36c4762a1bSJed Brown PetscReal ob[2]; /* observation used by the cost function */ 37c4762a1bSJed Brown PetscBool implicitform; /* implicit ODE? */ 38c4762a1bSJed Brown }; 39c4762a1bSJed Brown PetscErrorCode Adjoint2(Vec,PetscScalar[],User); 40c4762a1bSJed Brown 41c4762a1bSJed Brown /* ----------------------- Explicit form of the ODE -------------------- */ 42c4762a1bSJed Brown 43c4762a1bSJed Brown static PetscErrorCode RHSFunction(TS ts,PetscReal t,Vec U,Vec F,void *ctx) 44c4762a1bSJed Brown { 45c4762a1bSJed Brown User user = (User)ctx; 46c4762a1bSJed Brown PetscScalar *f; 47c4762a1bSJed Brown const PetscScalar *u; 48c4762a1bSJed Brown 49c4762a1bSJed Brown PetscFunctionBeginUser; 50*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(U,&u)); 51*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(F,&f)); 52c4762a1bSJed Brown f[0] = u[1]; 53c4762a1bSJed Brown f[1] = user->mu*((1.-u[0]*u[0])*u[1]-u[0]); 54*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(U,&u)); 55*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(F,&f)); 56c4762a1bSJed Brown PetscFunctionReturn(0); 57c4762a1bSJed Brown } 58c4762a1bSJed Brown 59c4762a1bSJed Brown static PetscErrorCode RHSJacobian(TS ts,PetscReal t,Vec U,Mat A,Mat B,void *ctx) 60c4762a1bSJed Brown { 61c4762a1bSJed Brown User user = (User)ctx; 62c4762a1bSJed Brown PetscReal mu = user->mu; 63c4762a1bSJed Brown PetscInt rowcol[] = {0,1}; 64c4762a1bSJed Brown PetscScalar J[2][2]; 65c4762a1bSJed Brown const PetscScalar *u; 66c4762a1bSJed Brown 67c4762a1bSJed Brown PetscFunctionBeginUser; 68*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(U,&u)); 69c4762a1bSJed Brown J[0][0] = 0; 70c4762a1bSJed Brown J[1][0] = -mu*(2.0*u[1]*u[0]+1.); 71c4762a1bSJed Brown J[0][1] = 1.0; 72c4762a1bSJed Brown J[1][1] = mu*(1.0-u[0]*u[0]); 73*9566063dSJacob Faibussowitsch PetscCall(MatSetValues(A,2,rowcol,2,rowcol,&J[0][0],INSERT_VALUES)); 74*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyBegin(A,MAT_FINAL_ASSEMBLY)); 75*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyEnd(A,MAT_FINAL_ASSEMBLY)); 76c4762a1bSJed Brown if (A != B) { 77*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyBegin(B,MAT_FINAL_ASSEMBLY)); 78*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyEnd(B,MAT_FINAL_ASSEMBLY)); 79c4762a1bSJed Brown } 80*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(U,&u)); 81c4762a1bSJed Brown PetscFunctionReturn(0); 82c4762a1bSJed Brown } 83c4762a1bSJed Brown 84c4762a1bSJed Brown static PetscErrorCode RHSHessianProductUU(TS ts,PetscReal t,Vec U,Vec *Vl,Vec Vr,Vec *VHV,void *ctx) 85c4762a1bSJed Brown { 86c4762a1bSJed Brown const PetscScalar *vl,*vr,*u; 87c4762a1bSJed Brown PetscScalar *vhv; 88c4762a1bSJed Brown PetscScalar dJdU[2][2][2]={{{0}}}; 89c4762a1bSJed Brown PetscInt i,j,k; 90c4762a1bSJed Brown User user = (User)ctx; 91c4762a1bSJed Brown 92c4762a1bSJed Brown PetscFunctionBeginUser; 93*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(U,&u)); 94*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(Vl[0],&vl)); 95*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(Vr,&vr)); 96*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(VHV[0],&vhv)); 97c4762a1bSJed Brown 98c4762a1bSJed Brown dJdU[1][0][0] = -2.*user->mu*u[1]; 99c4762a1bSJed Brown dJdU[1][1][0] = -2.*user->mu*u[0]; 100c4762a1bSJed Brown dJdU[1][0][1] = -2.*user->mu*u[0]; 101c4762a1bSJed Brown for (j=0;j<2;j++) { 102c4762a1bSJed Brown vhv[j] = 0; 103c4762a1bSJed Brown for (k=0;k<2;k++) 104c4762a1bSJed Brown for (i=0;i<2;i++) 105c4762a1bSJed Brown vhv[j] += vl[i]*dJdU[i][j][k]*vr[k]; 106c4762a1bSJed Brown } 107*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(U,&u)); 108*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(Vl[0],&vl)); 109*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(Vr,&vr)); 110*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(VHV[0],&vhv)); 111c4762a1bSJed Brown PetscFunctionReturn(0); 112c4762a1bSJed Brown } 113c4762a1bSJed Brown 114c4762a1bSJed Brown /* ----------------------- Implicit form of the ODE -------------------- */ 115c4762a1bSJed Brown 116c4762a1bSJed Brown static PetscErrorCode IFunction(TS ts,PetscReal t,Vec U,Vec Udot,Vec F,void *ctx) 117c4762a1bSJed Brown { 118c4762a1bSJed Brown User user = (User)ctx; 119c4762a1bSJed Brown const PetscScalar *u,*udot; 120c4762a1bSJed Brown PetscScalar *f; 121c4762a1bSJed Brown 122c4762a1bSJed Brown PetscFunctionBeginUser; 123*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(U,&u)); 124*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(Udot,&udot)); 125*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(F,&f)); 126c4762a1bSJed Brown f[0] = udot[0] - u[1]; 127c4762a1bSJed Brown f[1] = udot[1] - user->mu*((1.0-u[0]*u[0])*u[1] - u[0]) ; 128*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(U,&u)); 129*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(Udot,&udot)); 130*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(F,&f)); 131c4762a1bSJed Brown PetscFunctionReturn(0); 132c4762a1bSJed Brown } 133c4762a1bSJed Brown 134c4762a1bSJed Brown static PetscErrorCode IJacobian(TS ts,PetscReal t,Vec U,Vec Udot,PetscReal a,Mat A,Mat B,void *ctx) 135c4762a1bSJed Brown { 136c4762a1bSJed Brown User user = (User)ctx; 137c4762a1bSJed Brown PetscInt rowcol[] = {0,1}; 138c4762a1bSJed Brown PetscScalar J[2][2]; 139c4762a1bSJed Brown const PetscScalar *u; 140c4762a1bSJed Brown 141c4762a1bSJed Brown PetscFunctionBeginUser; 142*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(U,&u)); 143c4762a1bSJed Brown J[0][0] = a; J[0][1] = -1.0; 144c4762a1bSJed Brown J[1][0] = user->mu*(1.0 + 2.0*u[0]*u[1]); J[1][1] = a - user->mu*(1.0-u[0]*u[0]); 145*9566063dSJacob Faibussowitsch PetscCall(MatSetValues(B,2,rowcol,2,rowcol,&J[0][0],INSERT_VALUES)); 146*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(U,&u)); 147*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyBegin(A,MAT_FINAL_ASSEMBLY)); 148*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyEnd(A,MAT_FINAL_ASSEMBLY)); 149c4762a1bSJed Brown if (A != B) { 150*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyBegin(B,MAT_FINAL_ASSEMBLY)); 151*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyEnd(B,MAT_FINAL_ASSEMBLY)); 152c4762a1bSJed Brown } 153c4762a1bSJed Brown PetscFunctionReturn(0); 154c4762a1bSJed Brown } 155c4762a1bSJed Brown 156c4762a1bSJed Brown /* Monitor timesteps and use interpolation to output at integer multiples of 0.1 */ 157c4762a1bSJed Brown static PetscErrorCode Monitor(TS ts,PetscInt step,PetscReal t,Vec U,void *ctx) 158c4762a1bSJed Brown { 159c4762a1bSJed Brown const PetscScalar *u; 160c4762a1bSJed Brown PetscReal tfinal, dt; 161c4762a1bSJed Brown User user = (User)ctx; 162c4762a1bSJed Brown Vec interpolatedU; 163c4762a1bSJed Brown 164c4762a1bSJed Brown PetscFunctionBeginUser; 165*9566063dSJacob Faibussowitsch PetscCall(TSGetTimeStep(ts,&dt)); 166*9566063dSJacob Faibussowitsch PetscCall(TSGetMaxTime(ts,&tfinal)); 167c4762a1bSJed Brown 168c4762a1bSJed Brown while (user->next_output <= t && user->next_output <= tfinal) { 169*9566063dSJacob Faibussowitsch PetscCall(VecDuplicate(U,&interpolatedU)); 170*9566063dSJacob Faibussowitsch PetscCall(TSInterpolate(ts,user->next_output,interpolatedU)); 171*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(interpolatedU,&u)); 172*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"[%g] %D TS %g (dt = %g) X %g %g\n", 173c4762a1bSJed Brown (double)user->next_output,step,(double)t,(double)dt,(double)PetscRealPart(u[0]), 174b122ec5aSJacob Faibussowitsch (double)PetscRealPart(u[1]))); 175*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(interpolatedU,&u)); 176*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&interpolatedU)); 177c4762a1bSJed Brown user->next_output += 0.1; 178c4762a1bSJed Brown } 179c4762a1bSJed Brown PetscFunctionReturn(0); 180c4762a1bSJed Brown } 181c4762a1bSJed Brown 182c4762a1bSJed Brown static PetscErrorCode IHessianProductUU(TS ts,PetscReal t,Vec U,Vec *Vl,Vec Vr,Vec *VHV,void *ctx) 183c4762a1bSJed Brown { 184c4762a1bSJed Brown const PetscScalar *vl,*vr,*u; 185c4762a1bSJed Brown PetscScalar *vhv; 186c4762a1bSJed Brown PetscScalar dJdU[2][2][2]={{{0}}}; 187c4762a1bSJed Brown PetscInt i,j,k; 188c4762a1bSJed Brown User user = (User)ctx; 189c4762a1bSJed Brown 190c4762a1bSJed Brown PetscFunctionBeginUser; 191*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(U,&u)); 192*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(Vl[0],&vl)); 193*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(Vr,&vr)); 194*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(VHV[0],&vhv)); 195c4762a1bSJed Brown dJdU[1][0][0] = 2.*user->mu*u[1]; 196c4762a1bSJed Brown dJdU[1][1][0] = 2.*user->mu*u[0]; 197c4762a1bSJed Brown dJdU[1][0][1] = 2.*user->mu*u[0]; 198c4762a1bSJed Brown for (j=0;j<2;j++) { 199c4762a1bSJed Brown vhv[j] = 0; 200c4762a1bSJed Brown for (k=0;k<2;k++) 201c4762a1bSJed Brown for (i=0;i<2;i++) 202c4762a1bSJed Brown vhv[j] += vl[i]*dJdU[i][j][k]*vr[k]; 203c4762a1bSJed Brown } 204*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(U,&u)); 205*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(Vl[0],&vl)); 206*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(Vr,&vr)); 207*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(VHV[0],&vhv)); 208c4762a1bSJed Brown PetscFunctionReturn(0); 209c4762a1bSJed Brown } 210c4762a1bSJed Brown 211c4762a1bSJed Brown /* ------------------ User-defined routines for TAO -------------------------- */ 212c4762a1bSJed Brown 213c4762a1bSJed Brown static PetscErrorCode FormFunctionGradient(Tao tao,Vec IC,PetscReal *f,Vec G,void *ctx) 214c4762a1bSJed Brown { 215c4762a1bSJed Brown User user_ptr = (User)ctx; 216c4762a1bSJed Brown TS ts = user_ptr->ts; 217c4762a1bSJed Brown const PetscScalar *x_ptr; 218c4762a1bSJed Brown PetscScalar *y_ptr; 219c4762a1bSJed Brown 220c4762a1bSJed Brown PetscFunctionBeginUser; 221*9566063dSJacob Faibussowitsch PetscCall(VecCopy(IC,user_ptr->U)); /* set up the initial condition */ 222c4762a1bSJed Brown 223*9566063dSJacob Faibussowitsch PetscCall(TSSetTime(ts,0.0)); 224*9566063dSJacob Faibussowitsch PetscCall(TSSetStepNumber(ts,0)); 225*9566063dSJacob Faibussowitsch PetscCall(TSSetTimeStep(ts,0.001)); /* can be overwritten by command line options */ 226*9566063dSJacob Faibussowitsch PetscCall(TSSetFromOptions(ts)); 227*9566063dSJacob Faibussowitsch PetscCall(TSSolve(ts,user_ptr->U)); 228c4762a1bSJed Brown 229*9566063dSJacob Faibussowitsch PetscCall(VecGetArrayRead(user_ptr->U,&x_ptr)); 230*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user_ptr->Lambda[0],&y_ptr)); 231c4762a1bSJed Brown *f = (x_ptr[0]-user_ptr->ob[0])*(x_ptr[0]-user_ptr->ob[0])+(x_ptr[1]-user_ptr->ob[1])*(x_ptr[1]-user_ptr->ob[1]); 232c4762a1bSJed Brown y_ptr[0] = 2.*(x_ptr[0]-user_ptr->ob[0]); 233c4762a1bSJed Brown y_ptr[1] = 2.*(x_ptr[1]-user_ptr->ob[1]); 234*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user_ptr->Lambda[0],&y_ptr)); 235*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArrayRead(user_ptr->U,&x_ptr)); 236c4762a1bSJed Brown 237*9566063dSJacob Faibussowitsch PetscCall(TSSetCostGradients(ts,1,user_ptr->Lambda,NULL)); 238*9566063dSJacob Faibussowitsch PetscCall(TSAdjointSolve(ts)); 239*9566063dSJacob Faibussowitsch PetscCall(VecCopy(user_ptr->Lambda[0],G)); 240c4762a1bSJed Brown PetscFunctionReturn(0); 241c4762a1bSJed Brown } 242c4762a1bSJed Brown 243c4762a1bSJed Brown static PetscErrorCode FormHessian(Tao tao,Vec U,Mat H,Mat Hpre,void *ctx) 244c4762a1bSJed Brown { 245c4762a1bSJed Brown User user_ptr = (User)ctx; 246c4762a1bSJed Brown PetscScalar harr[2]; 247c4762a1bSJed Brown PetscScalar *x_ptr; 248c4762a1bSJed Brown const PetscInt rows[2] = {0,1}; 249c4762a1bSJed Brown PetscInt col; 250c4762a1bSJed Brown 251c4762a1bSJed Brown PetscFunctionBeginUser; 252*9566063dSJacob Faibussowitsch PetscCall(VecCopy(U,user_ptr->U)); 253*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user_ptr->Dir,&x_ptr)); 254c4762a1bSJed Brown x_ptr[0] = 1.; 255c4762a1bSJed Brown x_ptr[1] = 0.; 256*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user_ptr->Dir,&x_ptr)); 257*9566063dSJacob Faibussowitsch PetscCall(Adjoint2(user_ptr->U,harr,user_ptr)); 258c4762a1bSJed Brown col = 0; 259*9566063dSJacob Faibussowitsch PetscCall(MatSetValues(H,2,rows,1,&col,harr,INSERT_VALUES)); 260c4762a1bSJed Brown 261*9566063dSJacob Faibussowitsch PetscCall(VecCopy(U,user_ptr->U)); 262*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user_ptr->Dir,&x_ptr)); 263c4762a1bSJed Brown x_ptr[0] = 0.; 264c4762a1bSJed Brown x_ptr[1] = 1.; 265*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user_ptr->Dir,&x_ptr)); 266*9566063dSJacob Faibussowitsch PetscCall(Adjoint2(user_ptr->U,harr,user_ptr)); 267c4762a1bSJed Brown col = 1; 268*9566063dSJacob Faibussowitsch PetscCall(MatSetValues(H,2,rows,1,&col,harr,INSERT_VALUES)); 269c4762a1bSJed Brown 270*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyBegin(H,MAT_FINAL_ASSEMBLY)); 271*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyEnd(H,MAT_FINAL_ASSEMBLY)); 272c4762a1bSJed Brown if (H != Hpre) { 273*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyBegin(Hpre,MAT_FINAL_ASSEMBLY)); 274*9566063dSJacob Faibussowitsch PetscCall(MatAssemblyEnd(Hpre,MAT_FINAL_ASSEMBLY)); 275c4762a1bSJed Brown } 276c4762a1bSJed Brown PetscFunctionReturn(0); 277c4762a1bSJed Brown } 278c4762a1bSJed Brown 279c4762a1bSJed Brown static PetscErrorCode MatrixFreeHessian(Tao tao,Vec U,Mat H,Mat Hpre,void *ctx) 280c4762a1bSJed Brown { 281c4762a1bSJed Brown User user_ptr = (User)ctx; 282c4762a1bSJed Brown 283c4762a1bSJed Brown PetscFunctionBeginUser; 284*9566063dSJacob Faibussowitsch PetscCall(VecCopy(U,user_ptr->U)); 285c4762a1bSJed Brown PetscFunctionReturn(0); 286c4762a1bSJed Brown } 287c4762a1bSJed Brown 288c4762a1bSJed Brown /* ------------ Routines calculating second-order derivatives -------------- */ 289c4762a1bSJed Brown 2900e3d61c9SBarry Smith /* 291c4762a1bSJed Brown Compute the Hessian-vector product for the cost function using Second-order adjoint 292c4762a1bSJed Brown */ 293c4762a1bSJed Brown PetscErrorCode Adjoint2(Vec U,PetscScalar arr[],User ctx) 294c4762a1bSJed Brown { 295c4762a1bSJed Brown TS ts = ctx->ts; 296c4762a1bSJed Brown PetscScalar *x_ptr,*y_ptr; 297c4762a1bSJed Brown Mat tlmsen; 298c4762a1bSJed Brown 299c4762a1bSJed Brown PetscFunctionBeginUser; 300*9566063dSJacob Faibussowitsch PetscCall(TSAdjointReset(ts)); 301c4762a1bSJed Brown 302*9566063dSJacob Faibussowitsch PetscCall(TSSetTime(ts,0.0)); 303*9566063dSJacob Faibussowitsch PetscCall(TSSetStepNumber(ts,0)); 304*9566063dSJacob Faibussowitsch PetscCall(TSSetTimeStep(ts,0.001)); 305*9566063dSJacob Faibussowitsch PetscCall(TSSetFromOptions(ts)); 306*9566063dSJacob Faibussowitsch PetscCall(TSSetCostHessianProducts(ts,1,ctx->Lambda2,NULL,ctx->Dir)); 307*9566063dSJacob Faibussowitsch PetscCall(TSAdjointSetForward(ts,NULL)); 308*9566063dSJacob Faibussowitsch PetscCall(TSSolve(ts,U)); 309c4762a1bSJed Brown 310c4762a1bSJed Brown /* Set terminal conditions for first- and second-order adjonts */ 311*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(U,&x_ptr)); 312*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(ctx->Lambda[0],&y_ptr)); 313c4762a1bSJed Brown y_ptr[0] = 2.*(x_ptr[0]-ctx->ob[0]); 314c4762a1bSJed Brown y_ptr[1] = 2.*(x_ptr[1]-ctx->ob[1]); 315*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(ctx->Lambda[0],&y_ptr)); 316*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(U,&x_ptr)); 317*9566063dSJacob Faibussowitsch PetscCall(TSForwardGetSensitivities(ts,NULL,&tlmsen)); 318*9566063dSJacob Faibussowitsch PetscCall(MatDenseGetColumn(tlmsen,0,&x_ptr)); 319*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(ctx->Lambda2[0],&y_ptr)); 320c4762a1bSJed Brown y_ptr[0] = 2.*x_ptr[0]; 321c4762a1bSJed Brown y_ptr[1] = 2.*x_ptr[1]; 322*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(ctx->Lambda2[0],&y_ptr)); 323*9566063dSJacob Faibussowitsch PetscCall(MatDenseRestoreColumn(tlmsen,&x_ptr)); 324c4762a1bSJed Brown 325*9566063dSJacob Faibussowitsch PetscCall(TSSetCostGradients(ts,1,ctx->Lambda,NULL)); 326c4762a1bSJed Brown if (ctx->implicitform) { 327*9566063dSJacob Faibussowitsch PetscCall(TSSetIHessianProduct(ts,ctx->Ihp1,IHessianProductUU,NULL,NULL,NULL,NULL,NULL,NULL,ctx)); 328c4762a1bSJed Brown } else { 329*9566063dSJacob Faibussowitsch PetscCall(TSSetRHSHessianProduct(ts,ctx->Ihp1,RHSHessianProductUU,NULL,NULL,NULL,NULL,NULL,NULL,ctx)); 330c4762a1bSJed Brown } 331*9566063dSJacob Faibussowitsch PetscCall(TSAdjointSolve(ts)); 332c4762a1bSJed Brown 333*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(ctx->Lambda2[0],&x_ptr)); 334c4762a1bSJed Brown arr[0] = x_ptr[0]; 335c4762a1bSJed Brown arr[1] = x_ptr[1]; 336*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(ctx->Lambda2[0],&x_ptr)); 337c4762a1bSJed Brown 338*9566063dSJacob Faibussowitsch PetscCall(TSAdjointReset(ts)); 339*9566063dSJacob Faibussowitsch PetscCall(TSAdjointResetForward(ts)); 340c4762a1bSJed Brown PetscFunctionReturn(0); 341c4762a1bSJed Brown } 342c4762a1bSJed Brown 343c4762a1bSJed Brown PetscErrorCode FiniteDiff(Vec U,PetscScalar arr[],User ctx) 344c4762a1bSJed Brown { 345c4762a1bSJed Brown Vec Up,G,Gp; 346c4762a1bSJed Brown const PetscScalar eps = PetscRealConstant(1e-7); 347c4762a1bSJed Brown PetscScalar *u; 348c4762a1bSJed Brown Tao tao = NULL; 349c4762a1bSJed Brown PetscReal f; 350c4762a1bSJed Brown 351c4762a1bSJed Brown PetscFunctionBeginUser; 352*9566063dSJacob Faibussowitsch PetscCall(VecDuplicate(U,&Up)); 353*9566063dSJacob Faibussowitsch PetscCall(VecDuplicate(U,&G)); 354*9566063dSJacob Faibussowitsch PetscCall(VecDuplicate(U,&Gp)); 355c4762a1bSJed Brown 356*9566063dSJacob Faibussowitsch PetscCall(FormFunctionGradient(tao,U,&f,G,ctx)); 357c4762a1bSJed Brown 358*9566063dSJacob Faibussowitsch PetscCall(VecCopy(U,Up)); 359*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(Up,&u)); 360c4762a1bSJed Brown u[0] += eps; 361*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(Up,&u)); 362*9566063dSJacob Faibussowitsch PetscCall(FormFunctionGradient(tao,Up,&f,Gp,ctx)); 363*9566063dSJacob Faibussowitsch PetscCall(VecAXPY(Gp,-1,G)); 364*9566063dSJacob Faibussowitsch PetscCall(VecScale(Gp,1./eps)); 365*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(Gp,&u)); 366c4762a1bSJed Brown arr[0] = u[0]; 367c4762a1bSJed Brown arr[1] = u[1]; 368*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(Gp,&u)); 369c4762a1bSJed Brown 370*9566063dSJacob Faibussowitsch PetscCall(VecCopy(U,Up)); 371*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(Up,&u)); 372c4762a1bSJed Brown u[1] += eps; 373*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(Up,&u)); 374*9566063dSJacob Faibussowitsch PetscCall(FormFunctionGradient(tao,Up,&f,Gp,ctx)); 375*9566063dSJacob Faibussowitsch PetscCall(VecAXPY(Gp,-1,G)); 376*9566063dSJacob Faibussowitsch PetscCall(VecScale(Gp,1./eps)); 377*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(Gp,&u)); 378c4762a1bSJed Brown arr[2] = u[0]; 379c4762a1bSJed Brown arr[3] = u[1]; 380*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(Gp,&u)); 381c4762a1bSJed Brown 382*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&G)); 383*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&Gp)); 384*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&Up)); 385c4762a1bSJed Brown PetscFunctionReturn(0); 386c4762a1bSJed Brown } 387c4762a1bSJed Brown 388c4762a1bSJed Brown static PetscErrorCode HessianProductMat(Mat mat,Vec svec,Vec y) 389c4762a1bSJed Brown { 390c4762a1bSJed Brown User user_ptr; 391c4762a1bSJed Brown PetscScalar *y_ptr; 392c4762a1bSJed Brown 393c4762a1bSJed Brown PetscFunctionBeginUser; 394*9566063dSJacob Faibussowitsch PetscCall(MatShellGetContext(mat,&user_ptr)); 395*9566063dSJacob Faibussowitsch PetscCall(VecCopy(svec,user_ptr->Dir)); 396*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(y,&y_ptr)); 397*9566063dSJacob Faibussowitsch PetscCall(Adjoint2(user_ptr->U,y_ptr,user_ptr)); 398*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(y,&y_ptr)); 399c4762a1bSJed Brown PetscFunctionReturn(0); 400c4762a1bSJed Brown } 401c4762a1bSJed Brown 402c4762a1bSJed Brown int main(int argc,char **argv) 403c4762a1bSJed Brown { 404c4762a1bSJed Brown PetscBool monitor = PETSC_FALSE,mf = PETSC_TRUE; 405c4762a1bSJed Brown PetscInt mode = 0; 406c4762a1bSJed Brown PetscMPIInt size; 407c4762a1bSJed Brown struct _n_User user; 408c4762a1bSJed Brown Vec x; /* working vector for TAO */ 409c4762a1bSJed Brown PetscScalar *x_ptr,arr[4]; 410c4762a1bSJed Brown PetscScalar ic1 = 2.2,ic2 = -0.7; /* initial guess for TAO */ 411c4762a1bSJed Brown Tao tao; 412c4762a1bSJed Brown KSP ksp; 413c4762a1bSJed Brown PC pc; 414c4762a1bSJed Brown 415c4762a1bSJed Brown /* Initialize program */ 416*9566063dSJacob Faibussowitsch PetscCall(PetscInitialize(&argc,&argv,NULL,help)); 417*9566063dSJacob Faibussowitsch PetscCallMPI(MPI_Comm_size(PETSC_COMM_WORLD,&size)); 4183c633725SBarry Smith PetscCheck(size == 1,PETSC_COMM_WORLD,PETSC_ERR_WRONG_MPI_SIZE,"This is a uniprocessor example only!"); 419c4762a1bSJed Brown 420c4762a1bSJed Brown /* Set runtime options */ 421c4762a1bSJed Brown user.next_output = 0.0; 422c4762a1bSJed Brown user.mu = 1.0e3; 423c4762a1bSJed Brown user.steps = 0; 424c4762a1bSJed Brown user.ftime = 0.5; 425c4762a1bSJed Brown user.implicitform = PETSC_TRUE; 426c4762a1bSJed Brown 427*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetBool(NULL,NULL,"-monitor",&monitor,NULL)); 428*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetReal(NULL,NULL,"-mu",&user.mu,NULL)); 429*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetInt(NULL,NULL,"-mode",&mode,NULL)); 430*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetReal(NULL,NULL,"-ic1",&ic1,NULL)); 431*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetReal(NULL,NULL,"-ic2",&ic2,NULL)); 432*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetBool(NULL,NULL,"-my_tao_mf",&mf,NULL)); /* matrix-free hessian for optimization */ 433*9566063dSJacob Faibussowitsch PetscCall(PetscOptionsGetBool(NULL,NULL,"-implicitform",&user.implicitform,NULL)); 434c4762a1bSJed Brown 435c4762a1bSJed Brown /* Create necessary matrix and vectors, solve same ODE on every process */ 436*9566063dSJacob Faibussowitsch PetscCall(MatCreate(PETSC_COMM_WORLD,&user.A)); 437*9566063dSJacob Faibussowitsch PetscCall(MatSetSizes(user.A,PETSC_DECIDE,PETSC_DECIDE,2,2)); 438*9566063dSJacob Faibussowitsch PetscCall(MatSetFromOptions(user.A)); 439*9566063dSJacob Faibussowitsch PetscCall(MatSetUp(user.A)); 440*9566063dSJacob Faibussowitsch PetscCall(MatCreateVecs(user.A,&user.U,NULL)); 441*9566063dSJacob Faibussowitsch PetscCall(MatCreateVecs(user.A,&user.Dir,NULL)); 442*9566063dSJacob Faibussowitsch PetscCall(MatCreateVecs(user.A,&user.Lambda[0],NULL)); 443*9566063dSJacob Faibussowitsch PetscCall(MatCreateVecs(user.A,&user.Lambda2[0],NULL)); 444*9566063dSJacob Faibussowitsch PetscCall(MatCreateVecs(user.A,&user.Ihp1[0],NULL)); 445c4762a1bSJed Brown 446c4762a1bSJed Brown /* Create timestepping solver context */ 447*9566063dSJacob Faibussowitsch PetscCall(TSCreate(PETSC_COMM_WORLD,&user.ts)); 448*9566063dSJacob Faibussowitsch PetscCall(TSSetEquationType(user.ts,TS_EQ_ODE_EXPLICIT)); /* less Jacobian evaluations when adjoint BEuler is used, otherwise no effect */ 449c4762a1bSJed Brown if (user.implicitform) { 450*9566063dSJacob Faibussowitsch PetscCall(TSSetIFunction(user.ts,NULL,IFunction,&user)); 451*9566063dSJacob Faibussowitsch PetscCall(TSSetIJacobian(user.ts,user.A,user.A,IJacobian,&user)); 452*9566063dSJacob Faibussowitsch PetscCall(TSSetType(user.ts,TSCN)); 453c4762a1bSJed Brown } else { 454*9566063dSJacob Faibussowitsch PetscCall(TSSetRHSFunction(user.ts,NULL,RHSFunction,&user)); 455*9566063dSJacob Faibussowitsch PetscCall(TSSetRHSJacobian(user.ts,user.A,user.A,RHSJacobian,&user)); 456*9566063dSJacob Faibussowitsch PetscCall(TSSetType(user.ts,TSRK)); 457c4762a1bSJed Brown } 458*9566063dSJacob Faibussowitsch PetscCall(TSSetMaxTime(user.ts,user.ftime)); 459*9566063dSJacob Faibussowitsch PetscCall(TSSetExactFinalTime(user.ts,TS_EXACTFINALTIME_MATCHSTEP)); 460c4762a1bSJed Brown 461c4762a1bSJed Brown if (monitor) { 462*9566063dSJacob Faibussowitsch PetscCall(TSMonitorSet(user.ts,Monitor,&user,NULL)); 463c4762a1bSJed Brown } 464c4762a1bSJed Brown 465c4762a1bSJed Brown /* Set ODE initial conditions */ 466*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user.U,&x_ptr)); 467c4762a1bSJed Brown x_ptr[0] = 2.0; 468c4762a1bSJed Brown x_ptr[1] = -2.0/3.0 + 10.0/(81.0*user.mu) - 292.0/(2187.0*user.mu*user.mu); 469*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user.U,&x_ptr)); 470c4762a1bSJed Brown 471c4762a1bSJed Brown /* Set runtime options */ 472*9566063dSJacob Faibussowitsch PetscCall(TSSetFromOptions(user.ts)); 473c4762a1bSJed Brown 474c4762a1bSJed Brown /* Obtain the observation */ 475*9566063dSJacob Faibussowitsch PetscCall(TSSolve(user.ts,user.U)); 476*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user.U,&x_ptr)); 477c4762a1bSJed Brown user.ob[0] = x_ptr[0]; 478c4762a1bSJed Brown user.ob[1] = x_ptr[1]; 479*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user.U,&x_ptr)); 480c4762a1bSJed Brown 481*9566063dSJacob Faibussowitsch PetscCall(VecDuplicate(user.U,&x)); 482*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(x,&x_ptr)); 483c4762a1bSJed Brown x_ptr[0] = ic1; 484c4762a1bSJed Brown x_ptr[1] = ic2; 485*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(x,&x_ptr)); 486c4762a1bSJed Brown 487c4762a1bSJed Brown /* Save trajectory of solution so that TSAdjointSolve() may be used */ 488*9566063dSJacob Faibussowitsch PetscCall(TSSetSaveTrajectory(user.ts)); 489c4762a1bSJed Brown 490c4762a1bSJed Brown /* Compare finite difference and second-order adjoint. */ 491c4762a1bSJed Brown switch (mode) { 492c4762a1bSJed Brown case 2 : 493*9566063dSJacob Faibussowitsch PetscCall(FiniteDiff(x,arr,&user)); 494*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"\n Finite difference approximation of the Hessian\n")); 495*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"%g %g\n%g %g\n",(double)arr[0],(double)arr[1],(double)arr[2],(double)arr[3])); 496c4762a1bSJed Brown break; 497c4762a1bSJed Brown case 1 : /* Compute the Hessian column by column */ 498*9566063dSJacob Faibussowitsch PetscCall(VecCopy(x,user.U)); 499*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user.Dir,&x_ptr)); 500c4762a1bSJed Brown x_ptr[0] = 1.; 501c4762a1bSJed Brown x_ptr[1] = 0.; 502*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user.Dir,&x_ptr)); 503*9566063dSJacob Faibussowitsch PetscCall(Adjoint2(user.U,arr,&user)); 504*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"\nFirst column of the Hessian\n")); 505*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"%g\n%g\n",(double)arr[0],(double)arr[1])); 506*9566063dSJacob Faibussowitsch PetscCall(VecCopy(x,user.U)); 507*9566063dSJacob Faibussowitsch PetscCall(VecGetArray(user.Dir,&x_ptr)); 508c4762a1bSJed Brown x_ptr[0] = 0.; 509c4762a1bSJed Brown x_ptr[1] = 1.; 510*9566063dSJacob Faibussowitsch PetscCall(VecRestoreArray(user.Dir,&x_ptr)); 511*9566063dSJacob Faibussowitsch PetscCall(Adjoint2(user.U,arr,&user)); 512*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"\nSecond column of the Hessian\n")); 513*9566063dSJacob Faibussowitsch PetscCall(PetscPrintf(PETSC_COMM_WORLD,"%g\n%g\n",(double)arr[0],(double)arr[1])); 514c4762a1bSJed Brown break; 515c4762a1bSJed Brown case 0 : 516c4762a1bSJed Brown /* Create optimization context and set up */ 517*9566063dSJacob Faibussowitsch PetscCall(TaoCreate(PETSC_COMM_WORLD,&tao)); 518*9566063dSJacob Faibussowitsch PetscCall(TaoSetType(tao,TAOBLMVM)); 519*9566063dSJacob Faibussowitsch PetscCall(TaoSetObjectiveAndGradient(tao,NULL,FormFunctionGradient,(void *)&user)); 520c4762a1bSJed Brown 521c4762a1bSJed Brown if (mf) { 522*9566063dSJacob Faibussowitsch PetscCall(MatCreateShell(PETSC_COMM_SELF,2,2,2,2,(void*)&user,&user.H)); 523*9566063dSJacob Faibussowitsch PetscCall(MatShellSetOperation(user.H,MATOP_MULT,(void(*)(void))HessianProductMat)); 524*9566063dSJacob Faibussowitsch PetscCall(MatSetOption(user.H,MAT_SYMMETRIC,PETSC_TRUE)); 525*9566063dSJacob Faibussowitsch PetscCall(TaoSetHessian(tao,user.H,user.H,MatrixFreeHessian,(void *)&user)); 526c4762a1bSJed Brown } else { /* Create Hessian matrix */ 527*9566063dSJacob Faibussowitsch PetscCall(MatCreate(PETSC_COMM_WORLD,&user.H)); 528*9566063dSJacob Faibussowitsch PetscCall(MatSetSizes(user.H,PETSC_DECIDE,PETSC_DECIDE,2,2)); 529*9566063dSJacob Faibussowitsch PetscCall(MatSetUp(user.H)); 530*9566063dSJacob Faibussowitsch PetscCall(TaoSetHessian(tao,user.H,user.H,FormHessian,(void *)&user)); 531c4762a1bSJed Brown } 532c4762a1bSJed Brown 533c4762a1bSJed Brown /* Not use any preconditioner */ 534*9566063dSJacob Faibussowitsch PetscCall(TaoGetKSP(tao,&ksp)); 535c4762a1bSJed Brown if (ksp) { 536*9566063dSJacob Faibussowitsch PetscCall(KSPGetPC(ksp,&pc)); 537*9566063dSJacob Faibussowitsch PetscCall(PCSetType(pc,PCNONE)); 538c4762a1bSJed Brown } 539c4762a1bSJed Brown 540c4762a1bSJed Brown /* Set initial solution guess */ 541*9566063dSJacob Faibussowitsch PetscCall(TaoSetSolution(tao,x)); 542*9566063dSJacob Faibussowitsch PetscCall(TaoSetFromOptions(tao)); 543*9566063dSJacob Faibussowitsch PetscCall(TaoSolve(tao)); 544*9566063dSJacob Faibussowitsch PetscCall(TaoDestroy(&tao)); 545*9566063dSJacob Faibussowitsch PetscCall(MatDestroy(&user.H)); 546c4762a1bSJed Brown break; 547c4762a1bSJed Brown default: 548c4762a1bSJed Brown break; 549c4762a1bSJed Brown } 550c4762a1bSJed Brown 551c4762a1bSJed Brown /* Free work space. All PETSc objects should be destroyed when they are no longer needed. */ 552*9566063dSJacob Faibussowitsch PetscCall(MatDestroy(&user.A)); 553*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&user.U)); 554*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&user.Lambda[0])); 555*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&user.Lambda2[0])); 556*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&user.Ihp1[0])); 557*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&user.Dir)); 558*9566063dSJacob Faibussowitsch PetscCall(TSDestroy(&user.ts)); 559*9566063dSJacob Faibussowitsch PetscCall(VecDestroy(&x)); 560*9566063dSJacob Faibussowitsch PetscCall(PetscFinalize()); 561b122ec5aSJacob Faibussowitsch return 0; 562c4762a1bSJed Brown } 563c4762a1bSJed Brown 564c4762a1bSJed Brown /*TEST 565c4762a1bSJed Brown build: 566c4762a1bSJed Brown requires: !complex !single 567c4762a1bSJed Brown 568c4762a1bSJed Brown test: 569c4762a1bSJed Brown args: -ts_type cn -viewer_binary_skip_info -tao_monitor -tao_view -mu 1000 -ts_dt 0.03125 570c4762a1bSJed Brown output_file: output/ex20opt_ic_1.out 571c4762a1bSJed Brown 572c4762a1bSJed Brown test: 573c4762a1bSJed Brown suffix: 2 574c4762a1bSJed Brown args: -ts_type beuler -viewer_binary_skip_info -tao_monitor -tao_view -mu 100 -ts_dt 0.01 -tao_type bntr -tao_bnk_pc_type none 575c4762a1bSJed Brown output_file: output/ex20opt_ic_2.out 576c4762a1bSJed Brown 577c4762a1bSJed Brown test: 578c4762a1bSJed Brown suffix: 3 579c4762a1bSJed Brown args: -ts_type cn -viewer_binary_skip_info -tao_monitor -tao_view -mu 100 -ts_dt 0.01 -tao_type bntr -tao_bnk_pc_type none 580c4762a1bSJed Brown output_file: output/ex20opt_ic_3.out 581c4762a1bSJed Brown 582c4762a1bSJed Brown test: 583c4762a1bSJed Brown suffix: 4 584c4762a1bSJed Brown args: -implicitform 0 -ts_dt 0.01 -ts_max_steps 2 -ts_rhs_jacobian_test_mult_transpose -mat_shell_test_mult_transpose_view -ts_rhs_jacobian_test_mult -mat_shell_test_mult_view -mode 1 -my_tao_mf 585c4762a1bSJed Brown TEST*/ 586