// Copyright (c) 2017-2022, Lawrence Livermore National Security, LLC and other CEED contributors. // All Rights Reserved. See the top-level LICENSE and NOTICE files for details. // // SPDX-License-Identifier: BSD-2-Clause // // This file is part of CEED: http://github.com/ceed /// @file /// Structs and helper functions regarding the state of a newtonian simulation #ifndef newtonian_state_h #define newtonian_state_h #include #include #include "ceed/types.h" #include "newtonian_types.h" #include "utils.h" typedef struct { CeedScalar pressure; CeedScalar velocity[3]; CeedScalar temperature; } StatePrimitive; typedef struct { CeedScalar density; CeedScalar momentum[3]; CeedScalar E_total; } StateConservative; typedef struct { StateConservative U; StatePrimitive Y; } State; CEED_QFUNCTION_HELPER void UnpackState_U(StateConservative s, CeedScalar U[5]) { U[0] = s.density; for (int i=0; i<3; i++) U[i+1] = s.momentum[i]; U[4] = s.E_total; } CEED_QFUNCTION_HELPER void UnpackState_Y(StatePrimitive s, CeedScalar Y[5]) { Y[0] = s.pressure; for (int i=0; i<3; i++) Y[i+1] = s.velocity[i]; Y[4] = s.temperature; } CEED_QFUNCTION_HELPER CeedScalar HeatCapacityRatio( NewtonianIdealGasContext gas) { return gas->cp / gas->cv; } CEED_QFUNCTION_HELPER CeedScalar GasConstant( NewtonianIdealGasContext gas) { return gas->cp - gas->cv; } CEED_QFUNCTION_HELPER CeedScalar Prandtl(NewtonianIdealGasContext gas) { return gas->cp * gas->mu / gas->k; } CEED_QFUNCTION_HELPER CeedScalar SoundSpeed(NewtonianIdealGasContext gas, CeedScalar T) { return sqrt(gas->cp * (HeatCapacityRatio(gas) - 1.) * T); } CEED_QFUNCTION_HELPER CeedScalar Mach(NewtonianIdealGasContext gas, CeedScalar T, CeedScalar u) { return u / SoundSpeed(gas, T); } CEED_QFUNCTION_HELPER StatePrimitive StatePrimitiveFromConservative( NewtonianIdealGasContext gas, StateConservative U, const CeedScalar x[3]) { StatePrimitive Y; for (CeedInt i=0; i<3; i++) Y.velocity[i] = U.momentum[i] / U.density; CeedScalar e_kinetic = .5 * Dot3(Y.velocity, Y.velocity); CeedScalar e_potential = -Dot3(gas->g, x); CeedScalar e_total = U.E_total / U.density; CeedScalar e_internal = e_total - e_kinetic - e_potential; Y.temperature = e_internal / gas->cv; Y.pressure = (HeatCapacityRatio(gas) - 1) * U.density * e_internal; return Y; } CEED_QFUNCTION_HELPER StatePrimitive StatePrimitiveFromConservative_fwd( NewtonianIdealGasContext gas, State s, StateConservative dU, const CeedScalar x[3], const CeedScalar dx[3]) { StatePrimitive dY; for (CeedInt i=0; i<3; i++) { dY.velocity[i] = (dU.momentum[i] - s.Y.velocity[i] * dU.density) / s.U.density; } CeedScalar e_kinetic = .5 * Dot3(s.Y.velocity, s.Y.velocity); CeedScalar de_kinetic = Dot3(dY.velocity, s.Y.velocity); CeedScalar e_potential = -Dot3(gas->g, x); CeedScalar de_potential = -Dot3(gas->g, dx); CeedScalar e_total = s.U.E_total / s.U.density; CeedScalar de_total = (dU.E_total - e_total * dU.density) / s.U.density; CeedScalar e_internal = e_total - e_kinetic - e_potential; CeedScalar de_internal = de_total - de_kinetic - de_potential; dY.temperature = de_internal / gas->cv; dY.pressure = (HeatCapacityRatio(gas) - 1) * (dU.density * e_internal + s.U.density * de_internal); return dY; } CEED_QFUNCTION_HELPER StateConservative StateConservativeFromPrimitive( NewtonianIdealGasContext gas, StatePrimitive Y, const CeedScalar x[3]) { StateConservative U; U.density = Y.pressure / (GasConstant(gas) * Y.temperature); for (int i=0; i<3; i++) U.momentum[i] = U.density*Y.velocity[i]; CeedScalar e_internal = gas->cv * Y.temperature; CeedScalar e_kinetic = .5 * Dot3(Y.velocity, Y.velocity); CeedScalar e_potential = -Dot3(gas->g, x); CeedScalar e_total = e_internal + e_kinetic + e_potential; U.E_total = U.density*e_total; return U; } CEED_QFUNCTION_HELPER StateConservative StateConservativeFromPrimitive_fwd( NewtonianIdealGasContext gas, State s, StatePrimitive dY, const CeedScalar x[3], const CeedScalar dx[3]) { StateConservative dU; dU.density = (dY.pressure * s.Y.temperature - s.Y.pressure * dY.temperature) / (GasConstant(gas) * s.Y.temperature * s.Y.temperature); for (int i=0; i<3; i++) { dU.momentum[i] = dU.density * s.Y.velocity[i] + s.U.density * dY.velocity[i]; } CeedScalar e_kinetic = .5 * Dot3(s.Y.velocity, s.Y.velocity); CeedScalar de_kinetic = Dot3(dY.velocity, s.Y.velocity); CeedScalar e_potential = -Dot3(gas->g, x); CeedScalar de_potential = -Dot3(gas->g, dx); CeedScalar e_internal = gas->cv * s.Y.temperature; CeedScalar de_internal = gas->cv * dY.temperature; CeedScalar e_total = e_internal + e_kinetic + e_potential; CeedScalar de_total = de_internal + de_kinetic + de_potential; dU.E_total = dU.density*e_total + s.U.density*de_total; return dU; } // Function pointer types for generic state array -> State struct functions typedef State (*StateFromQi_t)(NewtonianIdealGasContext gas, const CeedScalar qi[5], const CeedScalar x[3]); typedef State (*StateFromQi_fwd_t)(NewtonianIdealGasContext gas, State s, const CeedScalar dqi[5], const CeedScalar x[3], const CeedScalar dx[3]); CEED_QFUNCTION_HELPER State StateFromU(NewtonianIdealGasContext gas, const CeedScalar U[5], const CeedScalar x[3]) { State s; s.U.density = U[0]; s.U.momentum[0] = U[1]; s.U.momentum[1] = U[2]; s.U.momentum[2] = U[3]; s.U.E_total = U[4]; s.Y = StatePrimitiveFromConservative(gas, s.U, x); return s; } CEED_QFUNCTION_HELPER State StateFromU_fwd(NewtonianIdealGasContext gas, State s, const CeedScalar dU[5], const CeedScalar x[3], const CeedScalar dx[3]) { State ds; ds.U.density = dU[0]; ds.U.momentum[0] = dU[1]; ds.U.momentum[1] = dU[2]; ds.U.momentum[2] = dU[3]; ds.U.E_total = dU[4]; ds.Y = StatePrimitiveFromConservative_fwd(gas, s, ds.U, x, dx); return ds; } CEED_QFUNCTION_HELPER State StateFromY(NewtonianIdealGasContext gas, const CeedScalar Y[5], const CeedScalar x[3]) { State s; s.Y.pressure = Y[0]; s.Y.velocity[0] = Y[1]; s.Y.velocity[1] = Y[2]; s.Y.velocity[2] = Y[3]; s.Y.temperature = Y[4]; s.U = StateConservativeFromPrimitive(gas, s.Y, x); return s; } CEED_QFUNCTION_HELPER State StateFromY_fwd(NewtonianIdealGasContext gas, State s, const CeedScalar dY[5], const CeedScalar x[3], const CeedScalar dx[3]) { State ds; ds.Y.pressure = dY[0]; ds.Y.velocity[0] = dY[1]; ds.Y.velocity[1] = dY[2]; ds.Y.velocity[2] = dY[3]; ds.Y.temperature = dY[4]; ds.U = StateConservativeFromPrimitive_fwd(gas, s, ds.Y, x, dx); return ds; } // Function pointer types for State struct -> generic state array typedef void (*StateToQi_t)(NewtonianIdealGasContext gas, const State input, CeedScalar qi[5]); CEED_QFUNCTION_HELPER void StateToU(NewtonianIdealGasContext gas, const State input, CeedScalar U[5]) { UnpackState_U(input.U, U); } CEED_QFUNCTION_HELPER void StateToY(NewtonianIdealGasContext gas, const State input, CeedScalar Y[5]) { UnpackState_Y(input.Y, Y); } CEED_QFUNCTION_HELPER void FluxInviscid(NewtonianIdealGasContext gas, State s, StateConservative Flux[3]) { for (CeedInt i=0; i<3; i++) { Flux[i].density = s.U.momentum[i]; for (CeedInt j=0; j<3; j++) Flux[i].momentum[j] = s.U.momentum[i] * s.Y.velocity[j] + s.Y.pressure * (i == j); Flux[i].E_total = (s.U.E_total + s.Y.pressure) * s.Y.velocity[i]; } } CEED_QFUNCTION_HELPER StateConservative FluxInviscidDotNormal( NewtonianIdealGasContext gas, State s, const CeedScalar normal[3]) { StateConservative Flux[3], Flux_dot_n = {0}; FluxInviscid(gas, s, Flux); for (CeedInt i=0; i<3; i++) { Flux_dot_n.density += Flux[i].density * normal[i]; for (CeedInt j=0; j<3; j++) Flux_dot_n.momentum[j] += Flux[i].momentum[j] * normal[i]; Flux_dot_n.E_total += Flux[i].E_total * normal[i]; } return Flux_dot_n; } CEED_QFUNCTION_HELPER void FluxInviscid_fwd(NewtonianIdealGasContext gas, State s, State ds, StateConservative dFlux[3]) { for (CeedInt i=0; i<3; i++) { dFlux[i].density = ds.U.momentum[i]; for (CeedInt j=0; j<3; j++) dFlux[i].momentum[j] = ds.U.momentum[i] * s.Y.velocity[j] + s.U.momentum[i] * ds.Y.velocity[j] + ds.Y.pressure * (i == j); dFlux[i].E_total = (ds.U.E_total + ds.Y.pressure) * s.Y.velocity[i] + (s.U.E_total + s.Y.pressure) * ds.Y.velocity[i]; } } CEED_QFUNCTION_HELPER void FluxInviscidStrong(NewtonianIdealGasContext gas, State s, State ds[3], CeedScalar strong_conv[5]) { for (CeedInt i=0; i<5; i++) strong_conv[i] = 0; for (CeedInt i=0; i<3; i++) { StateConservative dF[3]; FluxInviscid_fwd(gas, s, ds[i], dF); CeedScalar dF_i[5]; UnpackState_U(dF[i], dF_i); for (CeedInt j=0; j<5; j++) strong_conv[j] += dF_i[j]; } } CEED_QFUNCTION_HELPER void FluxTotal(const StateConservative F_inviscid[3], CeedScalar stress[3][3], CeedScalar Fe[3], CeedScalar Flux[5][3]) { for (CeedInt j=0; j<3; j++) { Flux[0][j] = F_inviscid[j].density; for (CeedInt k=0; k<3; k++) Flux[k+1][j] = F_inviscid[j].momentum[k] - stress[k][j]; Flux[4][j] = F_inviscid[j].E_total + Fe[j]; } } CEED_QFUNCTION_HELPER void FluxTotal_Boundary( const StateConservative F_inviscid[3], const CeedScalar stress[3][3], const CeedScalar Fe[3], const CeedScalar normal[3], CeedScalar Flux[5]) { for (CeedInt j=0; j<5; j++) Flux[j] = 0.; for (CeedInt j=0; j<3; j++) { Flux[0] += F_inviscid[j].density * normal[j]; for (CeedInt k=0; k<3; k++) { Flux[k+1] += (F_inviscid[j].momentum[k] - stress[k][j]) * normal[j]; } Flux[4] += (F_inviscid[j].E_total + Fe[j]) * normal[j]; } } // Kelvin-Mandel notation CEED_QFUNCTION_HELPER void KMStrainRate(const State grad_s[3], CeedScalar strain_rate[6]) { const CeedScalar weight = 1 / sqrt(2.); strain_rate[0] = grad_s[0].Y.velocity[0]; strain_rate[1] = grad_s[1].Y.velocity[1]; strain_rate[2] = grad_s[2].Y.velocity[2]; strain_rate[3] = weight * (grad_s[2].Y.velocity[1] + grad_s[1].Y.velocity[2]); strain_rate[4] = weight * (grad_s[2].Y.velocity[0] + grad_s[0].Y.velocity[2]); strain_rate[5] = weight * (grad_s[1].Y.velocity[0] + grad_s[0].Y.velocity[1]); } CEED_QFUNCTION_HELPER void NewtonianStress(NewtonianIdealGasContext gas, const CeedScalar strain_rate[6], CeedScalar stress[6]) { CeedScalar div_u = strain_rate[0] + strain_rate[1] + strain_rate[2]; for (CeedInt i=0; i<6; i++) { stress[i] = gas->mu * (2 * strain_rate[i] + gas->lambda * div_u * (i < 3)); } } CEED_QFUNCTION_HELPER void ViscousEnergyFlux(NewtonianIdealGasContext gas, StatePrimitive Y, const State grad_s[3], const CeedScalar stress[3][3], CeedScalar Fe[3]) { for (CeedInt i=0; i<3; i++) { Fe[i] = - Y.velocity[0] * stress[0][i] - Y.velocity[1] * stress[1][i] - Y.velocity[2] * stress[2][i] - gas->k * grad_s[i].Y.temperature; } } CEED_QFUNCTION_HELPER void ViscousEnergyFlux_fwd(NewtonianIdealGasContext gas, StatePrimitive Y, StatePrimitive dY, const State grad_ds[3], const CeedScalar stress[3][3], const CeedScalar dstress[3][3], CeedScalar dFe[3]) { for (CeedInt i=0; i<3; i++) { dFe[i] = - Y.velocity[0] * dstress[0][i] - dY.velocity[0] * stress[0][i] - Y.velocity[1] * dstress[1][i] - dY.velocity[1] * stress[1][i] - Y.velocity[2] * dstress[2][i] - dY.velocity[2] * stress[2][i] - gas->k * grad_ds[i].Y.temperature; } } #endif // newtonian_state_h