1dc936754SJeremy L Thompson // Copyright (c) 2017-2024, Lawrence Livermore National Security, LLC and other CEED contributors. 262b7942eSJames Wright // All Rights Reserved. See the top-level LICENSE and NOTICE files for details. 362b7942eSJames Wright // 462b7942eSJames Wright // SPDX-License-Identifier: BSD-2-Clause 562b7942eSJames Wright // 662b7942eSJames Wright // This file is part of CEED: http://github.com/ceed 762b7942eSJames Wright 862b7942eSJames Wright #include "../qfunctions/sgs_dd_model.h" 962b7942eSJames Wright 1062b7942eSJames Wright #include <petscdmplex.h> 1162b7942eSJames Wright 124c07ec22SJames Wright #include <sgs_model_torch.h> 1362b7942eSJames Wright #include "../navierstokes.h" 1462b7942eSJames Wright 15c38c977aSJames Wright typedef struct { 16c38c977aSJames Wright CeedElemRestriction elem_restr_grid_aniso, elem_restr_sgs; 17c38c977aSJames Wright CeedVector grid_aniso_ceed; 1840816385SJames Wright CeedQFunctionContext sgsdd_qfctx, ifunction_qfctx; 194c07ec22SJames Wright SGSModelDDImplementation sgs_dd_model_implementation; 20ad494f68SJames Wright } *SgsDDSetupData; 21c38c977aSJames Wright 22ad494f68SJames Wright PetscErrorCode SgsDDSetupDataDestroy(SgsDDSetupData sgs_dd_setup_data) { 23b4c37c5cSJames Wright Ceed ceed; 24ad494f68SJames Wright 25c38c977aSJames Wright PetscFunctionBeginUser; 26b4c37c5cSJames Wright PetscCall(CeedElemRestrictionGetCeed(sgs_dd_setup_data->elem_restr_sgs, &ceed)); 27ad494f68SJames Wright 28b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&sgs_dd_setup_data->elem_restr_grid_aniso)); 29b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&sgs_dd_setup_data->elem_restr_sgs)); 30b4c37c5cSJames Wright PetscCallCeed(ceed, CeedVectorDestroy(&sgs_dd_setup_data->grid_aniso_ceed)); 31b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionContextDestroy(&sgs_dd_setup_data->sgsdd_qfctx)); 3240816385SJames Wright PetscCallCeed(ceed, CeedQFunctionContextDestroy(&sgs_dd_setup_data->ifunction_qfctx)); 33c38c977aSJames Wright PetscCall(PetscFree(sgs_dd_setup_data)); 34d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 35c38c977aSJames Wright } 36c38c977aSJames Wright 37ee1455b7SJames Wright // @brief Create DM for storing subgrid stress at nodes 38ad494f68SJames Wright static PetscErrorCode SgsDDCreateDM(DM dm_source, DM *dm_sgs, PetscInt degree, PetscInt q_extra, PetscInt *num_components) { 39ee1455b7SJames Wright PetscSection section; 40ee1455b7SJames Wright 41ee1455b7SJames Wright PetscFunctionBeginUser; 42ee1455b7SJames Wright *num_components = 6; 43ee1455b7SJames Wright 44ee1455b7SJames Wright PetscCall(DMClone(dm_source, dm_sgs)); 45ee1455b7SJames Wright PetscCall(PetscObjectSetName((PetscObject)*dm_sgs, "Subgrid Stress Projection")); 46ee1455b7SJames Wright 47da4ca0cfSJames Wright PetscCall(DMSetupByOrder_FEM(PETSC_TRUE, PETSC_TRUE, degree, 1, q_extra, 1, num_components, *dm_sgs)); 48ee1455b7SJames Wright 49ee1455b7SJames Wright PetscCall(DMGetLocalSection(*dm_sgs, §ion)); 50ee1455b7SJames Wright PetscCall(PetscSectionSetFieldName(section, 0, "")); 51ee1455b7SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, 0, "KMSubgridStressXX")); 52ee1455b7SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, 1, "KMSubgridStressYY")); 53ee1455b7SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, 2, "KMSubgridStressZZ")); 54ee1455b7SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, 3, "KMSubgridStressYZ")); 55ee1455b7SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, 4, "KMSubgridStressXZ")); 56ee1455b7SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, 5, "KMSubgridStressXY")); 57d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 58ee1455b7SJames Wright }; 59ee1455b7SJames Wright 60ad494f68SJames Wright // @brief Evaluate data-driven SGS using fused method 61ad494f68SJames Wright static PetscErrorCode SgsDDNodalStressEval_Fused(User user, Vec Q_loc, Vec VelocityGradient, Vec SGSNodal_loc) { 62cceb3143SJames Wright SgsDDData sgs_dd_data = user->sgs_dd_data; 63cceb3143SJames Wright PetscMemType q_mem_type; 64cceb3143SJames Wright 65cceb3143SJames Wright PetscFunctionBeginUser; 66a7dac1d5SJames Wright PetscCall(VecPetscToCeed(Q_loc, &q_mem_type, user->q_ceed)); // q_ceed is an implicit input 67cceb3143SJames Wright 68cceb3143SJames Wright PetscCall(ApplyCeedOperatorGlobalToLocal(VelocityGradient, SGSNodal_loc, sgs_dd_data->op_nodal_evaluation_ctx)); 69cceb3143SJames Wright 70a7dac1d5SJames Wright PetscCall(VecCeedToPetsc(user->q_ceed, q_mem_type, Q_loc)); 71cceb3143SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 72cceb3143SJames Wright } 73cceb3143SJames Wright 74b87d60b3SJames Wright // @brief Create CeedOperator to calculate data-drive SGS at nodes using fused operator 75ad494f68SJames Wright static PetscErrorCode SgsDDSetupNodalEvaluation_Fused(Ceed ceed, User user, CeedData ceed_data, SgsDDSetupData sgs_dd_setup_data) { 7642454adaSJames Wright SgsDDData sgs_dd_data = user->sgs_dd_data; 775930f037SJames Wright CeedQFunction qf_sgs_dd_nodal; 785930f037SJames Wright CeedOperator op_sgs_dd_nodal; 7915c18037SJames Wright CeedInt num_comp_q, num_comp_grad_velo, num_comp_x, num_comp_grid_aniso; 80defe8520SJames Wright PetscInt dim; 815930f037SJames Wright CeedVector inv_multiplicity; 82ee1455b7SJames Wright CeedElemRestriction elem_restr_inv_multiplicity, elem_restr_grad_velo, elem_restr_sgs; 8315c18037SJames Wright DMLabel domain_label = NULL; 8415c18037SJames Wright PetscInt label_value = 0, height = 0, dm_field = 0; 85ee1455b7SJames Wright 86ee1455b7SJames Wright PetscFunctionBeginUser; 87ee1455b7SJames Wright PetscCall(DMGetDimension(user->dm, &dim)); 88b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_x, &num_comp_x)); 89b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_q, &num_comp_q)); 90b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(sgs_dd_setup_data->elem_restr_grid_aniso, &num_comp_grid_aniso)); 91ee1455b7SJames Wright 92ee1455b7SJames Wright { // Get velocity gradient information 93ee1455b7SJames Wright CeedOperatorField op_field; 94b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorGetFieldByName(user->grad_velo_proj->l2_rhs_ctx->op, "velocity gradient", &op_field)); 95b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorFieldGetElemRestriction(op_field, &elem_restr_grad_velo)); 96b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(elem_restr_grad_velo, &num_comp_grad_velo)); 97ee1455b7SJames Wright } 9815c18037SJames Wright PetscCall(DMPlexCeedElemRestrictionCreate(ceed, sgs_dd_data->dm_sgs, domain_label, label_value, height, dm_field, &elem_restr_sgs)); 99b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionCreateVector(elem_restr_sgs, &sgs_dd_data->sgs_nodal_ceed, NULL)); 100ee1455b7SJames Wright 1015930f037SJames Wright PetscCall(GetInverseMultiplicity(ceed, sgs_dd_data->dm_sgs, domain_label, label_value, height, dm_field, PETSC_FALSE, &elem_restr_inv_multiplicity, 1025930f037SJames Wright &inv_multiplicity)); 103ee1455b7SJames Wright 104ee1455b7SJames Wright // -- Create operator for SGS DD model nodal evaluation 105ee1455b7SJames Wright switch (user->phys->state_var) { 106ee1455b7SJames Wright case STATEVAR_PRIMITIVE: 107ad494f68SJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, ComputeSgsDDNodal_Prim, ComputeSgsDDNodal_Prim_loc, &qf_sgs_dd_nodal)); 108ee1455b7SJames Wright break; 109ee1455b7SJames Wright case STATEVAR_CONSERVATIVE: 110ad494f68SJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, ComputeSgsDDNodal_Conserv, ComputeSgsDDNodal_Conserv_loc, &qf_sgs_dd_nodal)); 111ee1455b7SJames Wright break; 112ee1455b7SJames Wright default: 113ad494f68SJames Wright SETERRQ(PetscObjectComm((PetscObject)user->dm), PETSC_ERR_SUP, "Data-driven SGS nodal evaluation not available for chosen state variable"); 114ee1455b7SJames Wright } 115ee1455b7SJames Wright 116ee1455b7SJames Wright // Mesh/geometry order and solution basis order may differ, therefore must interpolate 117ee1455b7SJames Wright CeedBasis basis_x_to_q; 118b4c37c5cSJames Wright PetscCallCeed(ceed, CeedBasisCreateProjection(ceed_data->basis_x, ceed_data->basis_q, &basis_x_to_q)); 119ee1455b7SJames Wright 120b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionSetContext(qf_sgs_dd_nodal, sgs_dd_setup_data->sgsdd_qfctx)); 121b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_nodal, "q", num_comp_q, CEED_EVAL_NONE)); 122b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_nodal, "x", num_comp_x, CEED_EVAL_INTERP)); 123b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_nodal, "gradient velocity", num_comp_grad_velo, CEED_EVAL_NONE)); 124b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_nodal, "anisotropy tensor", num_comp_grid_aniso, CEED_EVAL_NONE)); 125b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_nodal, "inverse multiplicity", 1, CEED_EVAL_NONE)); 126b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddOutput(qf_sgs_dd_nodal, "km_sgs", sgs_dd_data->num_comp_sgs, CEED_EVAL_NONE)); 127ee1455b7SJames Wright 128b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorCreate(ceed, qf_sgs_dd_nodal, NULL, NULL, &op_sgs_dd_nodal)); 12958e1cbfdSJeremy L Thompson PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_nodal, "q", ceed_data->elem_restr_q, CEED_BASIS_NONE, user->q_ceed)); 130b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_nodal, "x", ceed_data->elem_restr_x, basis_x_to_q, ceed_data->x_coord)); 13158e1cbfdSJeremy L Thompson PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_nodal, "gradient velocity", elem_restr_grad_velo, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 13258e1cbfdSJeremy L Thompson PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_nodal, "anisotropy tensor", sgs_dd_setup_data->elem_restr_grid_aniso, CEED_BASIS_NONE, 133b4c37c5cSJames Wright sgs_dd_setup_data->grid_aniso_ceed)); 13458e1cbfdSJeremy L Thompson PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_nodal, "inverse multiplicity", elem_restr_inv_multiplicity, CEED_BASIS_NONE, inv_multiplicity)); 13558e1cbfdSJeremy L Thompson PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_nodal, "km_sgs", elem_restr_sgs, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 136ee1455b7SJames Wright 1374b0f6111SJames Wright PetscCall(OperatorApplyContextCreate(user->grad_velo_proj->dm, sgs_dd_data->dm_sgs, ceed, op_sgs_dd_nodal, NULL, sgs_dd_data->sgs_nodal_ceed, NULL, 1384b0f6111SJames Wright NULL, &sgs_dd_data->op_nodal_evaluation_ctx)); 139ee1455b7SJames Wright 140ee1455b7SJames Wright sgs_dd_setup_data->elem_restr_sgs = elem_restr_sgs; 141ad494f68SJames Wright sgs_dd_data->sgs_nodal_eval = SgsDDNodalStressEval_Fused; 142ee1455b7SJames Wright 143b4c37c5cSJames Wright PetscCallCeed(ceed, CeedVectorDestroy(&inv_multiplicity)); 144b4c37c5cSJames Wright PetscCallCeed(ceed, CeedBasisDestroy(&basis_x_to_q)); 145b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&elem_restr_inv_multiplicity)); 146b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionDestroy(&qf_sgs_dd_nodal)); 147b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorDestroy(&op_sgs_dd_nodal)); 148d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 149ee1455b7SJames Wright } 150ee1455b7SJames Wright 1514c07ec22SJames Wright // @brief Setup data-driven model inference using libCEED native implementation 1524c07ec22SJames Wright static PetscErrorCode SgsDDSetupNodalEvaluation_Sequential_Ceed(Ceed ceed, SgsDDData sgs_dd_data, SgsDDSetupData sgs_dd_setup_data, 1534c07ec22SJames Wright CeedElemRestriction elem_restr_dd_inputs, CeedElemRestriction elem_restr_dd_outputs, 154b87d60b3SJames Wright CeedElemRestriction elem_restr_inv_multiplicity, CeedVector inv_multiplicity, 155b87d60b3SJames Wright void **ctx) { 156b87d60b3SJames Wright CeedQFunction qf_sgs_dd_inference; 157b87d60b3SJames Wright CeedOperator op_sgs_dd_inference; 158b87d60b3SJames Wright OperatorApplyContext *op_context = (OperatorApplyContext *)ctx; 159b87d60b3SJames Wright 160b87d60b3SJames Wright PetscFunctionBeginUser; 161b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, ComputeSgsDDNodal_Sequential_Inference, ComputeSgsDDNodal_Sequential_Inference_loc, 162b87d60b3SJames Wright &qf_sgs_dd_inference)); 163b87d60b3SJames Wright 164b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionSetContext(qf_sgs_dd_inference, sgs_dd_setup_data->sgsdd_qfctx)); 165b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_inference, "model inputs", sgs_dd_data->num_comp_inputs, CEED_EVAL_NONE)); 166b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_inference, "inverse multiplicity", 1, CEED_EVAL_NONE)); 167b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddOutput(qf_sgs_dd_inference, "model outputs", sgs_dd_data->num_comp_outputs, CEED_EVAL_NONE)); 168b87d60b3SJames Wright 169b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorCreate(ceed, qf_sgs_dd_inference, NULL, NULL, &op_sgs_dd_inference)); 170b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inference, "model inputs", elem_restr_dd_inputs, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 171b87d60b3SJames Wright PetscCallCeed(ceed, 172b87d60b3SJames Wright CeedOperatorSetField(op_sgs_dd_inference, "inverse multiplicity", elem_restr_inv_multiplicity, CEED_BASIS_NONE, inv_multiplicity)); 173b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inference, "model outputs", elem_restr_dd_outputs, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 174b87d60b3SJames Wright 175b87d60b3SJames Wright PetscCall(OperatorApplyContextCreate(sgs_dd_data->dm_dd_inputs, sgs_dd_data->dm_dd_outputs, ceed, op_sgs_dd_inference, NULL, NULL, NULL, NULL, 176b87d60b3SJames Wright op_context)); 177b87d60b3SJames Wright sgs_dd_data->sgs_nodal_inference_ctx_destroy = (PetscErrorCode(*)(void *))OperatorApplyContextDestroy; 178b87d60b3SJames Wright 179b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorDestroy(&op_sgs_dd_inference)); 180b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionDestroy(&qf_sgs_dd_inference)); 181b87d60b3SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 182b87d60b3SJames Wright } 183b87d60b3SJames Wright 1844c07ec22SJames Wright // @brief Perform data-driven model inference using libCEED native implementation 1854c07ec22SJames Wright PetscErrorCode SgsDDNodalStressEval_Sequential_Ceed(Vec DD_Inputs_loc, Vec DD_Outputs_loc, void *ctx) { 186b87d60b3SJames Wright OperatorApplyContext op_context = *(OperatorApplyContext *)ctx; 187b87d60b3SJames Wright 188b87d60b3SJames Wright PetscFunctionBeginUser; 189b40a7e63SJames Wright PetscCall(PetscLogEventBegin(FLUIDS_SgsModelDDData, DD_Inputs_loc, DD_Outputs_loc, NULL, NULL)); 190b40a7e63SJames Wright PetscCall(PetscLogEventBegin(FLUIDS_SgsModelDDInference, DD_Inputs_loc, DD_Outputs_loc, NULL, NULL)); 191b40a7e63SJames Wright PetscCall(PetscLogGpuTimeBegin()); 192b87d60b3SJames Wright PetscCall(ApplyCeedOperatorLocalToLocal(DD_Inputs_loc, DD_Outputs_loc, op_context)); 193b40a7e63SJames Wright PetscCall(PetscLogGpuTimeEnd()); 194b40a7e63SJames Wright PetscCall(PetscLogEventEnd(FLUIDS_SgsModelDDInference, DD_Inputs_loc, DD_Outputs_loc, NULL, NULL)); 195b40a7e63SJames Wright PetscCall(PetscLogEventEnd(FLUIDS_SgsModelDDData, DD_Inputs_loc, DD_Outputs_loc, NULL, NULL)); 196b87d60b3SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 197b87d60b3SJames Wright } 198b87d60b3SJames Wright 1994c07ec22SJames Wright // @brief Setup data-driven model inference using libtorch 2004c07ec22SJames Wright static PetscErrorCode SgsDDSetupNodalEvaluation_Sequential_Torch(Ceed ceed, SgsDDData sgs_dd_data, SgsDDSetupData sgs_dd_setup_data, 2014c07ec22SJames Wright CeedElemRestriction elem_restr_dd_inputs, CeedElemRestriction elem_restr_dd_outputs, 2024c07ec22SJames Wright CeedElemRestriction elem_restr_inv_multiplicity, CeedVector inv_multiplicity, 2034c07ec22SJames Wright void **ctx) { 2044c07ec22SJames Wright const char *ceed_resource; 2054c07ec22SJames Wright char model_path[PETSC_MAX_PATH_LEN] = ""; 2064c07ec22SJames Wright TorchDeviceType model_device_type; 2074c07ec22SJames Wright 2084c07ec22SJames Wright PetscFunctionBeginUser; 2094c07ec22SJames Wright PetscCallCeed(ceed, CeedGetResource(ceed, &ceed_resource)); 2104c07ec22SJames Wright if (strstr(ceed_resource, "/gpu/cuda")) model_device_type = TORCH_DEVICE_CUDA; 2114c07ec22SJames Wright else if (strstr(ceed_resource, "/gpu/hip")) model_device_type = TORCH_DEVICE_HIP; 212*7ffa0ff8SJames Wright // On-device XPU is not working reliably currently, default to CPU inference evaluation 213*7ffa0ff8SJames Wright // else if (strstr(ceed_resource, "/gpu/sycl")) model_device_type = TORCH_DEVICE_XPU; 2144c07ec22SJames Wright else model_device_type = TORCH_DEVICE_CPU; 2154c07ec22SJames Wright PetscCall(PetscOptionsGetEnum(NULL, NULL, "-sgs_model_dd_torch_model_device", TorchDeviceTypes, (PetscEnum *)&model_device_type, NULL)); 2164c07ec22SJames Wright PetscCall(PetscOptionsGetString(NULL, NULL, "-sgs_model_dd_torch_model_path", model_path, sizeof(model_path), NULL)); 2174c07ec22SJames Wright 2184c07ec22SJames Wright PetscCall(LoadModel_Torch(model_path, model_device_type)); 2194c07ec22SJames Wright 2204c07ec22SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 2214c07ec22SJames Wright } 2224c07ec22SJames Wright 2234c07ec22SJames Wright // @brief Perform data-driven model inference using libtorch 2244c07ec22SJames Wright static PetscErrorCode SgsDDNodalStressEval_Sequential_Torch(Vec DD_Inputs_loc, Vec DD_Outputs_loc, void *ctx) { 2254c07ec22SJames Wright static PetscBool run_through = PETSC_FALSE; 2264c07ec22SJames Wright PetscFunctionBeginUser; 2274c07ec22SJames Wright if (!run_through) { 2284c07ec22SJames Wright PetscCall(VecViewFromOptions(DD_Inputs_loc, NULL, "-dd_inputs_loc_view")); 2294c07ec22SJames Wright } 2304c07ec22SJames Wright PetscCall(ModelInference_Torch(DD_Inputs_loc, DD_Outputs_loc)); 2314c07ec22SJames Wright if (!run_through) { 2324c07ec22SJames Wright PetscCall(VecViewFromOptions(DD_Outputs_loc, NULL, "-dd_outputs_loc_view")); 2334c07ec22SJames Wright run_through = PETSC_TRUE; 2344c07ec22SJames Wright } 2354c07ec22SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 2364c07ec22SJames Wright } 2374c07ec22SJames Wright 238b87d60b3SJames Wright // @brief Evaluate data-driven SGS using sequential method 239b87d60b3SJames Wright PetscErrorCode SgsDDNodalStressEval_Sequential(User user, Vec Q_loc, Vec VelocityGradient, Vec SGSNodal_loc) { 240b87d60b3SJames Wright SgsDDData sgs_dd_data = user->sgs_dd_data; 241b87d60b3SJames Wright PetscMemType q_mem_type; 242b87d60b3SJames Wright Vec DD_Inputs_loc, DD_Outputs_loc; 243b87d60b3SJames Wright 244b87d60b3SJames Wright PetscFunctionBeginUser; 245b87d60b3SJames Wright PetscCall(DMGetLocalVector(sgs_dd_data->dm_dd_inputs, &DD_Inputs_loc)); 246b87d60b3SJames Wright PetscCall(DMGetLocalVector(sgs_dd_data->dm_dd_outputs, &DD_Outputs_loc)); 247a7dac1d5SJames Wright PetscCall(VecPetscToCeed(Q_loc, &q_mem_type, user->q_ceed)); // q_ceed is an implicit input 248b87d60b3SJames Wright 249b87d60b3SJames Wright PetscCall(ApplyCeedOperatorGlobalToLocal(VelocityGradient, DD_Inputs_loc, sgs_dd_data->op_nodal_dd_inputs_ctx)); 250b87d60b3SJames Wright PetscCall(sgs_dd_data->sgs_nodal_inference(DD_Inputs_loc, DD_Outputs_loc, &sgs_dd_data->sgs_nodal_inference_ctx)); 251b87d60b3SJames Wright PetscCall(ApplyCeedOperatorLocalToLocal(DD_Outputs_loc, SGSNodal_loc, sgs_dd_data->op_nodal_dd_outputs_ctx)); 252b87d60b3SJames Wright 253a7dac1d5SJames Wright PetscCall(VecCeedToPetsc(user->q_ceed, q_mem_type, Q_loc)); 254b87d60b3SJames Wright PetscCall(DMRestoreLocalVector(sgs_dd_data->dm_dd_inputs, &DD_Inputs_loc)); 255b87d60b3SJames Wright PetscCall(DMRestoreLocalVector(sgs_dd_data->dm_dd_outputs, &DD_Outputs_loc)); 256b87d60b3SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 257b87d60b3SJames Wright } 258b87d60b3SJames Wright 259b87d60b3SJames Wright // @brief Create CeedOperator to calculate data-drive SGS at nodes using sequentially-applied operators 260b87d60b3SJames Wright static PetscErrorCode SgsDDSetupNodalEvaluation_Sequential(Ceed ceed, User user, CeedData ceed_data, SgsDDSetupData sgs_dd_setup_data) { 261b87d60b3SJames Wright SgsDDData sgs_dd_data = user->sgs_dd_data; 262b87d60b3SJames Wright CeedInt num_comp_q, num_comp_grad_velo, num_comp_x, num_comp_grid_aniso, num_comp_eigvec = 9 + 1; 263b87d60b3SJames Wright PetscInt dim; 264b87d60b3SJames Wright CeedVector inv_multiplicity, eigvec; 265b87d60b3SJames Wright CeedElemRestriction elem_restr_inv_multiplicity, elem_restr_grad_velo, elem_restr_sgs, elem_restr_eigvec, elem_restr_dd_inputs, 266b87d60b3SJames Wright elem_restr_dd_outputs; 267b87d60b3SJames Wright DMLabel domain_label = NULL; 268b87d60b3SJames Wright PetscInt label_value = 0, height = 0, dm_field = 0; 269b87d60b3SJames Wright 270b87d60b3SJames Wright PetscFunctionBeginUser; 271b87d60b3SJames Wright { // Create DMs for data-driven input and output values 272b87d60b3SJames Wright PetscSection section; 273b87d60b3SJames Wright PetscInt degree, q_extra; 274b87d60b3SJames Wright { // Get degree and number of quadrature points from dm_sgs 275b87d60b3SJames Wright PetscFE fe; 276b87d60b3SJames Wright PetscSpace basis; 277b87d60b3SJames Wright PetscQuadrature quadrature; 278b87d60b3SJames Wright PetscInt num_qpnts; 279b87d60b3SJames Wright PetscCall(DMGetField(sgs_dd_data->dm_sgs, 0, NULL, (PetscObject *)&fe)); 280b87d60b3SJames Wright PetscCall(PetscFEGetBasisSpace(fe, &basis)); 281b87d60b3SJames Wright PetscCall(PetscSpaceGetDegree(basis, °ree, NULL)); 282b87d60b3SJames Wright PetscCall(PetscFEGetQuadrature(fe, &quadrature)); 283b87d60b3SJames Wright PetscCall(PetscQuadratureGetOrder(quadrature, &num_qpnts)); 284b87d60b3SJames Wright q_extra = degree - num_qpnts; 285b87d60b3SJames Wright } 286b87d60b3SJames Wright 287b87d60b3SJames Wright PetscCall(DMClone(sgs_dd_data->dm_sgs, &sgs_dd_data->dm_dd_inputs)); 288b87d60b3SJames Wright PetscCall(PetscObjectSetName((PetscObject)sgs_dd_data->dm_dd_inputs, "Data-Driven Model Inputs")); 289b87d60b3SJames Wright PetscCall(DMSetupByOrder_FEM(PETSC_TRUE, PETSC_TRUE, degree, 1, q_extra, 1, &sgs_dd_data->num_comp_inputs, sgs_dd_data->dm_dd_inputs)); 290b87d60b3SJames Wright PetscCall(DMGetLocalSection(sgs_dd_data->dm_dd_inputs, §ion)); 291b87d60b3SJames Wright PetscCall(PetscSectionSetFieldName(section, 0, "")); 292b87d60b3SJames Wright for (CeedInt i = 0; i < sgs_dd_data->num_comp_inputs; i++) { 293b87d60b3SJames Wright char component_name[PETSC_MAX_PATH_LEN]; 294b87d60b3SJames Wright 295b87d60b3SJames Wright PetscCall(PetscSNPrintf(component_name, sizeof component_name, "DataDrivenInput%" CeedInt_FMT, i + 1)); 296b87d60b3SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, i, component_name)); 297b87d60b3SJames Wright } 298b87d60b3SJames Wright 299b87d60b3SJames Wright PetscCall(DMClone(sgs_dd_data->dm_sgs, &sgs_dd_data->dm_dd_outputs)); 300b87d60b3SJames Wright PetscCall(PetscObjectSetName((PetscObject)sgs_dd_data->dm_dd_outputs, "Data-Driven Model Outputs")); 301b87d60b3SJames Wright PetscCall(DMSetupByOrder_FEM(PETSC_TRUE, PETSC_TRUE, degree, 1, q_extra, 1, &sgs_dd_data->num_comp_outputs, sgs_dd_data->dm_dd_outputs)); 302b87d60b3SJames Wright PetscCall(DMGetLocalSection(sgs_dd_data->dm_dd_outputs, §ion)); 303b87d60b3SJames Wright PetscCall(PetscSectionSetFieldName(section, 0, "")); 304b87d60b3SJames Wright for (CeedInt i = 0; i < sgs_dd_data->num_comp_outputs; i++) { 305b87d60b3SJames Wright char component_name[PETSC_MAX_PATH_LEN]; 306b87d60b3SJames Wright 307b87d60b3SJames Wright PetscCall(PetscSNPrintf(component_name, sizeof component_name, "DataDrivenOutput%" CeedInt_FMT, i + 1)); 308b87d60b3SJames Wright PetscCall(PetscSectionSetComponentName(section, 0, i, component_name)); 309b87d60b3SJames Wright } 310b87d60b3SJames Wright } 311b87d60b3SJames Wright 312b87d60b3SJames Wright PetscCall(DMGetDimension(user->dm, &dim)); 313b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_x, &num_comp_x)); 314b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_q, &num_comp_q)); 315b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(sgs_dd_setup_data->elem_restr_grid_aniso, &num_comp_grid_aniso)); 316b87d60b3SJames Wright 317b87d60b3SJames Wright { // Get velocity gradient information 318b87d60b3SJames Wright CeedOperatorField op_field; 319b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorGetFieldByName(user->grad_velo_proj->l2_rhs_ctx->op, "velocity gradient", &op_field)); 320b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorFieldGetElemRestriction(op_field, &elem_restr_grad_velo)); 321b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(elem_restr_grad_velo, &num_comp_grad_velo)); 322b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionCreateVector(elem_restr_grad_velo, &sgs_dd_data->grad_velo_ceed, NULL)); 323b87d60b3SJames Wright } 324b87d60b3SJames Wright 325b87d60b3SJames Wright PetscCall(DMPlexCeedElemRestrictionCreate(ceed, sgs_dd_data->dm_sgs, domain_label, label_value, height, dm_field, &elem_restr_sgs)); 326b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionCreateVector(elem_restr_sgs, &sgs_dd_data->sgs_nodal_ceed, NULL)); 327b87d60b3SJames Wright PetscCall( 328b87d60b3SJames Wright DMPlexCeedElemRestrictionCollocatedCreate(ceed, sgs_dd_data->dm_sgs, domain_label, label_value, height, num_comp_eigvec, &elem_restr_eigvec)); 329b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionCreateVector(elem_restr_eigvec, &eigvec, NULL)); 330b87d60b3SJames Wright 331b87d60b3SJames Wright PetscCall(DMPlexCeedElemRestrictionCreate(ceed, sgs_dd_data->dm_dd_inputs, domain_label, label_value, height, dm_field, &elem_restr_dd_inputs)); 332b87d60b3SJames Wright PetscCall(DMPlexCeedElemRestrictionCreate(ceed, sgs_dd_data->dm_dd_outputs, domain_label, label_value, height, dm_field, &elem_restr_dd_outputs)); 333b87d60b3SJames Wright 3345930f037SJames Wright PetscCall(GetInverseMultiplicity(ceed, sgs_dd_data->dm_sgs, domain_label, label_value, height, dm_field, PETSC_FALSE, &elem_restr_inv_multiplicity, 3355930f037SJames Wright &inv_multiplicity)); 336b87d60b3SJames Wright 337b87d60b3SJames Wright { // Create operator for data-driven input evaluation 338b87d60b3SJames Wright CeedQFunction qf_sgs_dd_inputs; 339b87d60b3SJames Wright CeedOperator op_sgs_dd_inputs; 340b87d60b3SJames Wright 341b87d60b3SJames Wright switch (user->phys->state_var) { 342b87d60b3SJames Wright case STATEVAR_PRIMITIVE: 343b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, ComputeSgsDDNodal_Sequential_Inputs_Prim, 344b87d60b3SJames Wright ComputeSgsDDNodal_Sequential_Inputs_Prim_loc, &qf_sgs_dd_inputs)); 345b87d60b3SJames Wright break; 346b87d60b3SJames Wright case STATEVAR_CONSERVATIVE: 347b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, ComputeSgsDDNodal_Sequential_Inputs_Conserv, 348b87d60b3SJames Wright ComputeSgsDDNodal_Sequential_Inputs_Conserv_loc, &qf_sgs_dd_inputs)); 349b87d60b3SJames Wright break; 350b87d60b3SJames Wright default: 351b87d60b3SJames Wright SETERRQ(PetscObjectComm((PetscObject)user->dm), PETSC_ERR_SUP, 352b87d60b3SJames Wright "Data-driven SGS nodal input evaluation not available for chosen state variable"); 353b87d60b3SJames Wright } 354b87d60b3SJames Wright 355b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionSetContext(qf_sgs_dd_inputs, sgs_dd_setup_data->sgsdd_qfctx)); 356b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_inputs, "q", num_comp_q, CEED_EVAL_NONE)); 357b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_inputs, "gradient velocity", num_comp_grad_velo, CEED_EVAL_NONE)); 358b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_inputs, "anisotropy tensor", num_comp_grid_aniso, CEED_EVAL_NONE)); 359b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_inputs, "inverse multiplicity", 1, CEED_EVAL_NONE)); 360b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddOutput(qf_sgs_dd_inputs, "eigenvectors", num_comp_eigvec, CEED_EVAL_NONE)); 361b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddOutput(qf_sgs_dd_inputs, "model inputs", sgs_dd_data->num_comp_inputs, CEED_EVAL_NONE)); 362b87d60b3SJames Wright 363b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorCreate(ceed, qf_sgs_dd_inputs, NULL, NULL, &op_sgs_dd_inputs)); 364b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inputs, "q", ceed_data->elem_restr_q, CEED_BASIS_NONE, user->q_ceed)); 365b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inputs, "gradient velocity", elem_restr_grad_velo, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 366b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inputs, "anisotropy tensor", sgs_dd_setup_data->elem_restr_grid_aniso, CEED_BASIS_NONE, 367b87d60b3SJames Wright sgs_dd_setup_data->grid_aniso_ceed)); 368b87d60b3SJames Wright PetscCallCeed(ceed, 369b87d60b3SJames Wright CeedOperatorSetField(op_sgs_dd_inputs, "inverse multiplicity", elem_restr_inv_multiplicity, CEED_BASIS_NONE, inv_multiplicity)); 370b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inputs, "eigenvectors", elem_restr_eigvec, CEED_BASIS_NONE, eigvec)); 371b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_inputs, "model inputs", elem_restr_dd_inputs, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 372b87d60b3SJames Wright 373b87d60b3SJames Wright PetscCall(OperatorApplyContextCreate(user->grad_velo_proj->dm, sgs_dd_data->dm_dd_inputs, ceed, op_sgs_dd_inputs, NULL, NULL, NULL, NULL, 374b87d60b3SJames Wright &sgs_dd_data->op_nodal_dd_inputs_ctx)); 375b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorDestroy(&op_sgs_dd_inputs)); 376b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionDestroy(&qf_sgs_dd_inputs)); 377b87d60b3SJames Wright } 378b87d60b3SJames Wright 379b87d60b3SJames Wright { // Create operator for data-driven output handling 380b87d60b3SJames Wright CeedQFunction qf_sgs_dd_outputs; 381b87d60b3SJames Wright CeedOperator op_sgs_dd_outputs; 382b87d60b3SJames Wright 383b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, ComputeSgsDDNodal_Sequential_Outputs, ComputeSgsDDNodal_Sequential_Outputs_loc, 384b87d60b3SJames Wright &qf_sgs_dd_outputs)); 385b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionSetContext(qf_sgs_dd_outputs, sgs_dd_setup_data->sgsdd_qfctx)); 386b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_outputs, "model outputs", sgs_dd_data->num_comp_outputs, CEED_EVAL_NONE)); 387b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_outputs, "anisotropy tensor", num_comp_grid_aniso, CEED_EVAL_NONE)); 388b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_outputs, "inverse multiplicity", 1, CEED_EVAL_NONE)); 389b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_dd_outputs, "eigenvectors", num_comp_eigvec, CEED_EVAL_NONE)); 390b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionAddOutput(qf_sgs_dd_outputs, "km_sgs", sgs_dd_data->num_comp_sgs, CEED_EVAL_NONE)); 391b87d60b3SJames Wright 392b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorCreate(ceed, qf_sgs_dd_outputs, NULL, NULL, &op_sgs_dd_outputs)); 393b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_outputs, "model outputs", elem_restr_dd_outputs, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 394b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_outputs, "anisotropy tensor", sgs_dd_setup_data->elem_restr_grid_aniso, CEED_BASIS_NONE, 395b87d60b3SJames Wright sgs_dd_setup_data->grid_aniso_ceed)); 396b87d60b3SJames Wright PetscCallCeed(ceed, 397b87d60b3SJames Wright CeedOperatorSetField(op_sgs_dd_outputs, "inverse multiplicity", elem_restr_inv_multiplicity, CEED_BASIS_NONE, inv_multiplicity)); 398b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_outputs, "eigenvectors", elem_restr_eigvec, CEED_BASIS_NONE, eigvec)); 399b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_dd_outputs, "km_sgs", elem_restr_sgs, CEED_BASIS_NONE, CEED_VECTOR_ACTIVE)); 400b87d60b3SJames Wright 401b87d60b3SJames Wright PetscCall(OperatorApplyContextCreate(sgs_dd_data->dm_dd_outputs, sgs_dd_data->dm_sgs, ceed, op_sgs_dd_outputs, NULL, sgs_dd_data->sgs_nodal_ceed, 402b87d60b3SJames Wright NULL, NULL, &sgs_dd_data->op_nodal_dd_outputs_ctx)); 403b87d60b3SJames Wright PetscCallCeed(ceed, CeedOperatorDestroy(&op_sgs_dd_outputs)); 404b87d60b3SJames Wright PetscCallCeed(ceed, CeedQFunctionDestroy(&qf_sgs_dd_outputs)); 405b87d60b3SJames Wright } 406b87d60b3SJames Wright 407b87d60b3SJames Wright sgs_dd_data->sgs_nodal_eval = SgsDDNodalStressEval_Sequential; 4084c07ec22SJames Wright 4094c07ec22SJames Wright if (sgs_dd_setup_data->sgs_dd_model_implementation == SGS_MODEL_DD_SEQENTIAL_CEED) { 4104c07ec22SJames Wright sgs_dd_data->sgs_nodal_inference = SgsDDNodalStressEval_Sequential_Ceed; 4114c07ec22SJames Wright PetscCall(SgsDDSetupNodalEvaluation_Sequential_Ceed(ceed, sgs_dd_data, sgs_dd_setup_data, elem_restr_dd_inputs, elem_restr_dd_outputs, 412b87d60b3SJames Wright elem_restr_inv_multiplicity, inv_multiplicity, &sgs_dd_data->sgs_nodal_inference_ctx)); 4134c07ec22SJames Wright } else if (sgs_dd_setup_data->sgs_dd_model_implementation == SGS_MODEL_DD_SEQENTIAL_TORCH) { 4144c07ec22SJames Wright sgs_dd_data->sgs_nodal_inference = SgsDDNodalStressEval_Sequential_Torch; 4154c07ec22SJames Wright PetscCall(SgsDDSetupNodalEvaluation_Sequential_Torch(ceed, sgs_dd_data, sgs_dd_setup_data, elem_restr_dd_inputs, elem_restr_dd_outputs, 4164c07ec22SJames Wright elem_restr_inv_multiplicity, inv_multiplicity, &sgs_dd_data->sgs_nodal_inference_ctx)); 4174c07ec22SJames Wright } 418b87d60b3SJames Wright 419b87d60b3SJames Wright sgs_dd_setup_data->elem_restr_sgs = elem_restr_sgs; 420b87d60b3SJames Wright 421b87d60b3SJames Wright PetscCallCeed(ceed, CeedVectorDestroy(&inv_multiplicity)); 422b87d60b3SJames Wright PetscCallCeed(ceed, CeedVectorDestroy(&eigvec)); 423b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&elem_restr_inv_multiplicity)); 424b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&elem_restr_eigvec)); 425b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&elem_restr_dd_inputs)); 426b87d60b3SJames Wright PetscCallCeed(ceed, CeedElemRestrictionDestroy(&elem_restr_dd_outputs)); 427b87d60b3SJames Wright PetscFunctionReturn(PETSC_SUCCESS); 428b87d60b3SJames Wright } 429b87d60b3SJames Wright 4309c678832SJames Wright // @brief Create CeedOperator to compute SGS contribution to the residual 431ad494f68SJames Wright static PetscErrorCode SgsSetupNodalIFunction(Ceed ceed, User user, CeedData ceed_data, SgsDDSetupData sgs_dd_setup_data) { 43242454adaSJames Wright SgsDDData sgs_dd_data = user->sgs_dd_data; 43367263decSKenneth E. Jansen CeedInt num_comp_q, num_comp_qd, num_comp_x; 434defe8520SJames Wright PetscInt dim; 4359c678832SJames Wright CeedQFunction qf_sgs_apply; 4369c678832SJames Wright CeedOperator op_sgs_apply; 4379c678832SJames Wright CeedBasis basis_sgs; 4389c678832SJames Wright 4399c678832SJames Wright PetscFunctionBeginUser; 4409c678832SJames Wright PetscCall(DMGetDimension(user->dm, &dim)); 441b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_q, &num_comp_q)); 442b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_qd_i, &num_comp_qd)); 443b4c37c5cSJames Wright PetscCallCeed(ceed, CeedElemRestrictionGetNumComponents(ceed_data->elem_restr_x, &num_comp_x)); 4449c678832SJames Wright 44567263decSKenneth E. Jansen PetscCall(CreateBasisFromPlex(ceed, sgs_dd_data->dm_sgs, 0, 0, 0, 0, &basis_sgs)); 4469c678832SJames Wright 4479c678832SJames Wright switch (user->phys->state_var) { 4489c678832SJames Wright case STATEVAR_PRIMITIVE: 44942454adaSJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, IFunction_NodalSgs_Prim, IFunction_NodalSgs_Prim_loc, &qf_sgs_apply)); 4509c678832SJames Wright break; 4519c678832SJames Wright case STATEVAR_CONSERVATIVE: 45242454adaSJames Wright PetscCallCeed(ceed, CeedQFunctionCreateInterior(ceed, 1, IFunction_NodalSgs_Conserv, IFunction_NodalSgs_Conserv_loc, &qf_sgs_apply)); 4539c678832SJames Wright break; 4549c678832SJames Wright default: 4559c678832SJames Wright SETERRQ(PetscObjectComm((PetscObject)user->dm), PETSC_ERR_SUP, "Nodal SGS evaluation not available for chosen state variable"); 4569c678832SJames Wright } 4579c678832SJames Wright 45840816385SJames Wright PetscCallCeed(ceed, CeedQFunctionSetContext(qf_sgs_apply, sgs_dd_setup_data->ifunction_qfctx)); 459b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_apply, "q", num_comp_q, CEED_EVAL_INTERP)); 460b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_apply, "qdata", num_comp_qd, CEED_EVAL_NONE)); 461b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddInput(qf_sgs_apply, "km_sgs", sgs_dd_data->num_comp_sgs, CEED_EVAL_INTERP)); 462b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionAddOutput(qf_sgs_apply, "Grad_v", num_comp_q * dim, CEED_EVAL_GRAD)); 4639c678832SJames Wright 464b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorCreate(ceed, qf_sgs_apply, NULL, NULL, &op_sgs_apply)); 465b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_apply, "q", ceed_data->elem_restr_q, ceed_data->basis_q, CEED_VECTOR_ACTIVE)); 46658e1cbfdSJeremy L Thompson PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_apply, "qdata", ceed_data->elem_restr_qd_i, CEED_BASIS_NONE, ceed_data->q_data)); 467b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_apply, "km_sgs", sgs_dd_setup_data->elem_restr_sgs, basis_sgs, sgs_dd_data->sgs_nodal_ceed)); 468b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorSetField(op_sgs_apply, "Grad_v", ceed_data->elem_restr_q, ceed_data->basis_q, CEED_VECTOR_ACTIVE)); 4699c678832SJames Wright 4709c678832SJames Wright PetscCall( 4719c678832SJames Wright OperatorApplyContextCreate(user->dm, user->dm, ceed, op_sgs_apply, user->q_ceed, user->g_ceed, NULL, NULL, &sgs_dd_data->op_sgs_apply_ctx)); 4729c678832SJames Wright 473b4c37c5cSJames Wright PetscCallCeed(ceed, CeedOperatorDestroy(&op_sgs_apply)); 474b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionDestroy(&qf_sgs_apply)); 475d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 4769c678832SJames Wright } 4779c678832SJames Wright 4789c678832SJames Wright // @brief Calculate and add data-driven SGS residual to the global residual 479ad494f68SJames Wright PetscErrorCode SgsDDApplyIFunction(User user, const Vec Q_loc, Vec G_loc) { 48042454adaSJames Wright SgsDDData sgs_dd_data = user->sgs_dd_data; 4819c678832SJames Wright Vec VelocityGradient, SGSNodal_loc; 482cceb3143SJames Wright PetscMemType sgs_nodal_mem_type; 4839c678832SJames Wright 4849c678832SJames Wright PetscFunctionBeginUser; 485b40a7e63SJames Wright PetscCall(PetscLogEventBegin(FLUIDS_SgsModel, Q_loc, G_loc, NULL, NULL)); 4869c678832SJames Wright PetscCall(DMGetGlobalVector(user->grad_velo_proj->dm, &VelocityGradient)); 487f6ac214eSJames Wright PetscCall(VelocityGradientProjectionApply(user->grad_velo_proj, Q_loc, VelocityGradient)); 4889c678832SJames Wright 4899c678832SJames Wright // -- Compute Nodal SGS tensor 4909c678832SJames Wright PetscCall(DMGetLocalVector(sgs_dd_data->dm_sgs, &SGSNodal_loc)); 491cceb3143SJames Wright PetscCall(sgs_dd_data->sgs_nodal_eval(user, Q_loc, VelocityGradient, SGSNodal_loc)); 4929c678832SJames Wright 4939c678832SJames Wright // -- Compute contribution of the SGS stress 494a7dac1d5SJames Wright PetscCall(VecPetscToCeed(SGSNodal_loc, &sgs_nodal_mem_type, sgs_dd_data->sgs_nodal_ceed)); // sgs_nodal_ceed is an implicit input 4959c678832SJames Wright PetscCall(ApplyAddCeedOperatorLocalToLocal(Q_loc, G_loc, sgs_dd_data->op_sgs_apply_ctx)); 4969c678832SJames Wright 4979c678832SJames Wright // -- Return local SGS vector 498a7dac1d5SJames Wright PetscCall(VecCeedToPetsc(sgs_dd_data->sgs_nodal_ceed, sgs_nodal_mem_type, SGSNodal_loc)); 4999c678832SJames Wright PetscCall(DMRestoreLocalVector(sgs_dd_data->dm_sgs, &SGSNodal_loc)); 5009c678832SJames Wright PetscCall(DMRestoreGlobalVector(user->grad_velo_proj->dm, &VelocityGradient)); 501b40a7e63SJames Wright PetscCall(PetscLogEventEnd(FLUIDS_SgsModel, Q_loc, G_loc, NULL, NULL)); 502d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 5039c678832SJames Wright } 5049c678832SJames Wright 50562b7942eSJames Wright // @brief B = A^T, A is NxM, B is MxN 506cceb3143SJames Wright static PetscErrorCode TransposeMatrix(const PetscScalar *A, PetscScalar *B, const PetscInt N, const PetscInt M) { 50762b7942eSJames Wright PetscFunctionBeginUser; 50862b7942eSJames Wright for (PetscInt i = 0; i < N; i++) { 50962b7942eSJames Wright for (PetscInt j = 0; j < M; j++) { 51062b7942eSJames Wright B[j * N + i] = A[i * M + j]; 51162b7942eSJames Wright } 51262b7942eSJames Wright } 513d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 51462b7942eSJames Wright } 51562b7942eSJames Wright 51662b7942eSJames Wright // @brief Read neural network coefficients from file and put into context struct 517ad494f68SJames Wright static PetscErrorCode SgsDDContextFill(MPI_Comm comm, char data_dir[PETSC_MAX_PATH_LEN], SgsDDContext *psgsdd_ctx) { 518ad494f68SJames Wright SgsDDContext sgsdd_ctx; 51962b7942eSJames Wright PetscInt num_inputs = (*psgsdd_ctx)->num_inputs, num_outputs = (*psgsdd_ctx)->num_outputs, num_neurons = (*psgsdd_ctx)->num_neurons; 52062b7942eSJames Wright char file_path[PETSC_MAX_PATH_LEN]; 52162b7942eSJames Wright PetscScalar *temp; 52262b7942eSJames Wright 52362b7942eSJames Wright PetscFunctionBeginUser; 52462b7942eSJames Wright { 525ad494f68SJames Wright SgsDDContext sgsdd_temp; 52662b7942eSJames Wright PetscCall(PetscNew(&sgsdd_temp)); 52762b7942eSJames Wright *sgsdd_temp = **psgsdd_ctx; 52862b7942eSJames Wright sgsdd_temp->offsets.bias1 = 0; 52962b7942eSJames Wright sgsdd_temp->offsets.bias2 = sgsdd_temp->offsets.bias1 + num_neurons; 53062b7942eSJames Wright sgsdd_temp->offsets.weight1 = sgsdd_temp->offsets.bias2 + num_neurons; 53162b7942eSJames Wright sgsdd_temp->offsets.weight2 = sgsdd_temp->offsets.weight1 + num_neurons * num_inputs; 53262b7942eSJames Wright sgsdd_temp->offsets.out_scaling = sgsdd_temp->offsets.weight2 + num_inputs * num_neurons; 53362b7942eSJames Wright PetscInt total_num_scalars = sgsdd_temp->offsets.out_scaling + 2 * num_outputs; 53462b7942eSJames Wright sgsdd_temp->total_bytes = sizeof(*sgsdd_ctx) + total_num_scalars * sizeof(sgsdd_ctx->data[0]); 53562b7942eSJames Wright PetscCall(PetscMalloc(sgsdd_temp->total_bytes, &sgsdd_ctx)); 53662b7942eSJames Wright *sgsdd_ctx = *sgsdd_temp; 53762b7942eSJames Wright PetscCall(PetscFree(sgsdd_temp)); 53862b7942eSJames Wright } 53962b7942eSJames Wright 54062b7942eSJames Wright PetscCall(PetscSNPrintf(file_path, sizeof file_path, "%s/%s", data_dir, "b1.dat")); 54142454adaSJames Wright PetscCall(PhastaDatFileReadToArrayReal(comm, file_path, &sgsdd_ctx->data[sgsdd_ctx->offsets.bias1])); 54262b7942eSJames Wright PetscCall(PetscSNPrintf(file_path, sizeof file_path, "%s/%s", data_dir, "b2.dat")); 54342454adaSJames Wright PetscCall(PhastaDatFileReadToArrayReal(comm, file_path, &sgsdd_ctx->data[sgsdd_ctx->offsets.bias2])); 54462b7942eSJames Wright PetscCall(PetscSNPrintf(file_path, sizeof file_path, "%s/%s", data_dir, "OutScaling.dat")); 54542454adaSJames Wright PetscCall(PhastaDatFileReadToArrayReal(comm, file_path, &sgsdd_ctx->data[sgsdd_ctx->offsets.out_scaling])); 54662b7942eSJames Wright 54762b7942eSJames Wright { 54862b7942eSJames Wright PetscCall(PetscMalloc1(num_inputs * num_neurons, &temp)); 54962b7942eSJames Wright PetscCall(PetscSNPrintf(file_path, sizeof file_path, "%s/%s", data_dir, "w1.dat")); 55042454adaSJames Wright PetscCall(PhastaDatFileReadToArrayReal(comm, file_path, temp)); 55162b7942eSJames Wright PetscCall(TransposeMatrix(temp, &sgsdd_ctx->data[sgsdd_ctx->offsets.weight1], num_inputs, num_neurons)); 55262b7942eSJames Wright PetscCall(PetscFree(temp)); 55362b7942eSJames Wright } 55462b7942eSJames Wright { 55562b7942eSJames Wright PetscCall(PetscMalloc1(num_outputs * num_neurons, &temp)); 55662b7942eSJames Wright PetscCall(PetscSNPrintf(file_path, sizeof file_path, "%s/%s", data_dir, "w2.dat")); 55742454adaSJames Wright PetscCall(PhastaDatFileReadToArrayReal(comm, file_path, temp)); 55862b7942eSJames Wright PetscCall(TransposeMatrix(temp, &sgsdd_ctx->data[sgsdd_ctx->offsets.weight2], num_neurons, num_outputs)); 55962b7942eSJames Wright PetscCall(PetscFree(temp)); 56062b7942eSJames Wright } 56162b7942eSJames Wright 56262b7942eSJames Wright PetscCall(PetscFree(*psgsdd_ctx)); 56362b7942eSJames Wright *psgsdd_ctx = sgsdd_ctx; 564d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 56562b7942eSJames Wright } 56662b7942eSJames Wright 567991aef52SJames Wright PetscErrorCode SgsDDSetup(Ceed ceed, User user, CeedData ceed_data, ProblemData problem) { 568ee1455b7SJames Wright PetscReal alpha = 0; 569ad494f68SJames Wright SgsDDContext sgsdd_ctx; 57062b7942eSJames Wright MPI_Comm comm = user->comm; 571ee1455b7SJames Wright char sgs_dd_dir[PETSC_MAX_PATH_LEN] = "./dd_sgs_parameters"; 572ad494f68SJames Wright SgsDDSetupData sgs_dd_setup_data; 573ee1455b7SJames Wright NewtonianIdealGasContext gas; 57462b7942eSJames Wright 57506f41313SJames Wright PetscFunctionBeginUser; 576f6ac214eSJames Wright PetscCall(VelocityGradientProjectionSetup(ceed, user, ceed_data, problem, user->phys->state_var, ceed_data->elem_restr_q, ceed_data->basis_q, 577f6ac214eSJames Wright &user->grad_velo_proj)); 5789ab09d51SJames Wright 579b87d60b3SJames Wright PetscCall(PetscNew(&user->sgs_dd_data)); 580b87d60b3SJames Wright user->sgs_dd_data->num_comp_inputs = 6; 581b87d60b3SJames Wright user->sgs_dd_data->num_comp_outputs = 6; 58262b7942eSJames Wright 5834c07ec22SJames Wright PetscCall(PetscNew(&sgs_dd_setup_data)); 5844c07ec22SJames Wright 5854b0f6111SJames Wright PetscOptionsBegin(comm, NULL, "SGS Data-Driven Model Options", NULL); 58662b7942eSJames Wright PetscCall(PetscOptionsReal("-sgs_model_dd_leakyrelu_alpha", "Slope parameter for Leaky ReLU activation function", NULL, alpha, &alpha, NULL)); 58762b7942eSJames Wright PetscCall(PetscOptionsString("-sgs_model_dd_parameter_dir", "Path to directory with model parameters (weights, biases, etc.)", NULL, sgs_dd_dir, 58862b7942eSJames Wright sgs_dd_dir, sizeof(sgs_dd_dir), NULL)); 5894c07ec22SJames Wright PetscCall(PetscOptionsDeprecated("-sgs_model_dd_use_fused", NULL, "libCEED 0.12.0", "Use -sgs_model_dd_type instead")); 5904c07ec22SJames Wright sgs_dd_setup_data->sgs_dd_model_implementation = SGS_MODEL_DD_FUSED; 5914c07ec22SJames Wright PetscCall(PetscOptionsEnum("-sgs_model_dd_implementation", "Data-Driven SGS model implementation", NULL, SGSModelDDImplementations, 5924c07ec22SJames Wright (PetscEnum)sgs_dd_setup_data->sgs_dd_model_implementation, (PetscEnum *)&sgs_dd_setup_data->sgs_dd_model_implementation, 5934c07ec22SJames Wright NULL)); 59462b7942eSJames Wright PetscOptionsEnd(); 59562b7942eSJames Wright 596b87d60b3SJames Wright PetscCall(PetscNew(&sgsdd_ctx)); 5974b0f6111SJames Wright sgsdd_ctx->num_layers = 1; 59862b7942eSJames Wright sgsdd_ctx->num_inputs = 6; 59962b7942eSJames Wright sgsdd_ctx->num_outputs = 6; 60062b7942eSJames Wright sgsdd_ctx->num_neurons = 20; 60162b7942eSJames Wright sgsdd_ctx->alpha = alpha; 60262b7942eSJames Wright 603ad494f68SJames Wright PetscCall(SgsDDContextFill(comm, sgs_dd_dir, &sgsdd_ctx)); 60462b7942eSJames Wright 605ee1455b7SJames Wright // -- Create DM for storing SGS tensor at nodes 606ad494f68SJames Wright PetscCall(SgsDDCreateDM(user->dm, &user->sgs_dd_data->dm_sgs, user->app_ctx->degree, user->app_ctx->q_extra, &user->sgs_dd_data->num_comp_sgs)); 607ee1455b7SJames Wright 608b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionContextGetDataRead(problem->apply_vol_ifunction.qfunction_context, CEED_MEM_HOST, &gas)); 609ee1455b7SJames Wright sgsdd_ctx->gas = *gas; 610b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionContextRestoreDataRead(problem->apply_vol_ifunction.qfunction_context, &gas)); 611b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionContextCreate(user->ceed, &sgs_dd_setup_data->sgsdd_qfctx)); 612b4c37c5cSJames Wright PetscCallCeed(ceed, 613b4c37c5cSJames Wright CeedQFunctionContextSetData(sgs_dd_setup_data->sgsdd_qfctx, CEED_MEM_HOST, CEED_USE_POINTER, sgsdd_ctx->total_bytes, sgsdd_ctx)); 614b4c37c5cSJames Wright PetscCallCeed(ceed, CeedQFunctionContextSetDataDestroy(sgs_dd_setup_data->sgsdd_qfctx, CEED_MEM_HOST, FreeContextPetsc)); 615ee1455b7SJames Wright 61640816385SJames Wright PetscCallCeed(ceed, CeedQFunctionContextReferenceCopy(problem->apply_vol_ifunction.qfunction_context, &sgs_dd_setup_data->ifunction_qfctx)); 61740816385SJames Wright 618c38c977aSJames Wright // -- Compute and store anisotropy tensor 619c38c977aSJames Wright PetscCall(GridAnisotropyTensorProjectionSetupApply(ceed, user, ceed_data, &sgs_dd_setup_data->elem_restr_grid_aniso, 620c38c977aSJames Wright &sgs_dd_setup_data->grid_aniso_ceed)); 621c38c977aSJames Wright 622ee1455b7SJames Wright // -- Create Nodal Evaluation Operator 6234c07ec22SJames Wright switch (sgs_dd_setup_data->sgs_dd_model_implementation) { 6244c07ec22SJames Wright case SGS_MODEL_DD_FUSED: 6254c07ec22SJames Wright PetscCall(SgsDDSetupNodalEvaluation_Fused(ceed, user, ceed_data, sgs_dd_setup_data)); 6264c07ec22SJames Wright break; 6274c07ec22SJames Wright case SGS_MODEL_DD_SEQENTIAL_CEED: 6284c07ec22SJames Wright case SGS_MODEL_DD_SEQENTIAL_TORCH: 6294c07ec22SJames Wright PetscCall(SgsDDSetupNodalEvaluation_Sequential(ceed, user, ceed_data, sgs_dd_setup_data)); 6304c07ec22SJames Wright break; 6314c07ec22SJames Wright } 632ee1455b7SJames Wright 6339c678832SJames Wright // -- Create Operator to evalutate residual of SGS stress 634ad494f68SJames Wright PetscCall(SgsSetupNodalIFunction(ceed, user, ceed_data, sgs_dd_setup_data)); 6359c678832SJames Wright 636ad494f68SJames Wright PetscCall(SgsDDSetupDataDestroy(sgs_dd_setup_data)); 637d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 63862b7942eSJames Wright } 639ee1455b7SJames Wright 64042454adaSJames Wright PetscErrorCode SgsDDDataDestroy(SgsDDData sgs_dd_data) { 641ee1455b7SJames Wright PetscFunctionBeginUser; 642d949ddfcSJames Wright if (!sgs_dd_data) PetscFunctionReturn(PETSC_SUCCESS); 643b4c37c5cSJames Wright Ceed ceed = sgs_dd_data->op_sgs_apply_ctx->ceed; 644ee1455b7SJames Wright 645b4c37c5cSJames Wright PetscCallCeed(ceed, CeedVectorDestroy(&sgs_dd_data->sgs_nodal_ceed)); 646b87d60b3SJames Wright PetscCallCeed(ceed, CeedVectorDestroy(&sgs_dd_data->grad_velo_ceed)); 647ee1455b7SJames Wright PetscCall(OperatorApplyContextDestroy(sgs_dd_data->op_nodal_evaluation_ctx)); 64841edf198SJames Wright PetscCall(OperatorApplyContextDestroy(sgs_dd_data->op_sgs_apply_ctx)); 649b87d60b3SJames Wright PetscCall(OperatorApplyContextDestroy(sgs_dd_data->op_nodal_dd_inputs_ctx)); 650b87d60b3SJames Wright PetscCall(OperatorApplyContextDestroy(sgs_dd_data->op_nodal_dd_outputs_ctx)); 651ee1455b7SJames Wright PetscCall(DMDestroy(&sgs_dd_data->dm_sgs)); 652b87d60b3SJames Wright PetscCall(DMDestroy(&sgs_dd_data->dm_dd_inputs)); 653b87d60b3SJames Wright PetscCall(DMDestroy(&sgs_dd_data->dm_dd_outputs)); 654b87d60b3SJames Wright if (sgs_dd_data->sgs_nodal_inference_ctx) PetscCall(sgs_dd_data->sgs_nodal_inference_ctx_destroy(sgs_dd_data->sgs_nodal_inference_ctx)); 655ee1455b7SJames Wright PetscCall(PetscFree(sgs_dd_data)); 656d949ddfcSJames Wright PetscFunctionReturn(PETSC_SUCCESS); 657ee1455b7SJames Wright } 658