Beispiel #1
0
def main(ctx_factory=cl.create_some_context, use_logmgr=True,
         use_leap=False, use_profiling=False, casename=None,
         rst_filename=None, actx_class=PyOpenCLArrayContext):
    """Run the example."""
    cl_ctx = cl.create_some_context()
    queue = cl.CommandQueue(cl_ctx)

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    num_parts = comm.Get_size()

    logmgr = initialize_logmgr(use_logmgr,
        filename="heat-source.sqlite", mode="wu", mpi_comm=comm)

    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
    else:
        queue = cl.CommandQueue(cl_ctx)

    actx = actx_class(
        queue,
        allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)))

    from meshmode.distributed import MPIMeshDistributor, get_partition_by_pymetis
    mesh_dist = MPIMeshDistributor(comm)

    dim = 2
    nel_1d = 16

    t = 0
    t_final = 0.0002
    istep = 0

    if mesh_dist.is_mananger_rank():
        from meshmode.mesh.generation import generate_regular_rect_mesh
        mesh = generate_regular_rect_mesh(
            a=(-0.5,)*dim,
            b=(0.5,)*dim,
            nelements_per_axis=(nel_1d,)*dim,
            boundary_tag_to_face={
                "dirichlet": ["+x", "-x"],
                "neumann": ["+y", "-y"]
                }
            )

        print("%d elements" % mesh.nelements)

        part_per_element = get_partition_by_pymetis(mesh, num_parts)

        local_mesh = mesh_dist.send_mesh_parts(mesh, part_per_element, num_parts)

        del mesh

    else:
        local_mesh = mesh_dist.receive_mesh_part()

    order = 3

    discr = EagerDGDiscretization(actx, local_mesh, order=order,
                    mpi_communicator=comm)

    if dim == 2:
        # no deep meaning here, just a fudge factor
        dt = 0.0025/(nel_1d*order**2)
    else:
        raise ValueError("don't have a stable time step guesstimate")

    source_width = 0.2

    from arraycontext import thaw
    nodes = thaw(discr.nodes(), actx)

    boundaries = {
        DTAG_BOUNDARY("dirichlet"): DirichletDiffusionBoundary(0.),
        DTAG_BOUNDARY("neumann"): NeumannDiffusionBoundary(0.)
    }

    u = discr.zeros(actx)

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_device_memory_usage(logmgr, queue)

        logmgr.add_watches(["step.max", "t_step.max", "t_log.max"])

        try:
            logmgr.add_watches(["memory_usage_python.max", "memory_usage_gpu.max"])
        except KeyError:
            pass

        if use_profiling:
            logmgr.add_watches(["multiply_time.max"])

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

    vis = make_visualizer(discr)

    def rhs(t, u):
        return (
            diffusion_operator(
                discr, quad_tag=DISCR_TAG_BASE,
                alpha=1, boundaries=boundaries, u=u)
            + actx.np.exp(-np.dot(nodes, nodes)/source_width**2))

    compiled_rhs = actx.compile(rhs)

    rank = comm.Get_rank()

    while t < t_final:
        if logmgr:
            logmgr.tick_before()

        if istep % 10 == 0:
            print(istep, t, actx.to_numpy(actx.np.linalg.norm(u[0])))
            vis.write_vtk_file("fld-heat-source-mpi-%03d-%04d.vtu" % (rank, istep),
                    [
                        ("u", u)
                        ], overwrite=True)

        u = rk4_step(u, t, dt, compiled_rhs)
        t += dt
        istep += 1

        if logmgr:
            set_dt(logmgr, dt)
            logmgr.tick_after()
    final_answer = discr.norm(u, np.inf)
    resid = abs(final_answer - 0.00020620711665201585)
    if resid > 1e-15:
        raise ValueError(f"Run did not produce the expected result {resid=}")
Beispiel #2
0
def main(ctx_factory=cl.create_some_context, use_logmgr=True,
         use_leap=False, use_profiling=False, casename=None,
         rst_filename=None, actx_class=PyOpenCLArrayContext):
    """Drive example."""
    cl_ctx = ctx_factory()

    if casename is None:
        casename = "mirgecom"

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    rank = comm.Get_rank()
    nparts = comm.Get_size()

    logmgr = initialize_logmgr(use_logmgr,
        filename=f"{casename}.sqlite", mode="wu", mpi_comm=comm)

    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
    else:
        queue = cl.CommandQueue(cl_ctx)

    actx = actx_class(
        queue,
        allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)))

    # timestepping control
    current_step = 0
    if use_leap:
        from leap.rk import RK4MethodBuilder
        timestepper = RK4MethodBuilder("state")
    else:
        timestepper = rk4_step
    t_final = 0.005
    current_cfl = 1.0
    current_dt = .001
    current_t = 0
    constant_cfl = False

    # some i/o frequencies
    nstatus = 1
    nrestart = 5
    nviz = 1
    nhealth = 1

    dim = 2
    rst_path = "restart_data/"
    rst_pattern = (
        rst_path + "{cname}-{step:04d}-{rank:04d}.pkl"
    )
    if rst_filename:  # read the grid from restart data
        rst_filename = f"{rst_filename}-{rank:04d}.pkl"
        from mirgecom.restart import read_restart_data
        restart_data = read_restart_data(actx, rst_filename)
        local_mesh = restart_data["local_mesh"]
        local_nelements = local_mesh.nelements
        global_nelements = restart_data["global_nelements"]
        assert restart_data["nparts"] == nparts
    else:  # generate the grid from scratch
        box_ll = -5.0
        box_ur = 5.0
        nel_1d = 16
        from meshmode.mesh.generation import generate_regular_rect_mesh
        generate_mesh = partial(generate_regular_rect_mesh, a=(box_ll,)*dim,
                                b=(box_ur,) * dim, nelements_per_axis=(nel_1d,)*dim)
        local_mesh, global_nelements = generate_and_distribute_mesh(comm,
                                                                    generate_mesh)
        local_nelements = local_mesh.nelements

    order = 3
    discr = EagerDGDiscretization(
        actx, local_mesh, order=order, mpi_communicator=comm
    )
    nodes = thaw(actx, discr.nodes())

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_device_memory_usage(logmgr, queue)
        logmgr_add_many_discretization_quantities(logmgr, discr, dim,
                             extract_vars_for_logging, units_for_logging)

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

        logmgr.add_watches([
            ("step.max", "step = {value}, "),
            ("t_sim.max", "sim time: {value:1.6e} s\n"),
            ("min_pressure", "------- P (min, max) (Pa) = ({value:1.9e}, "),
            ("max_pressure",    "{value:1.9e})\n"),
            ("t_step.max", "------- step walltime: {value:6g} s, "),
            ("t_log.max", "log walltime: {value:6g} s")
        ])

    # soln setup and init
    nspecies = 4
    centers = make_obj_array([np.zeros(shape=(dim,)) for i in range(nspecies)])
    spec_y0s = np.ones(shape=(nspecies,))
    spec_amplitudes = np.ones(shape=(nspecies,))
    eos = IdealSingleGas()
    velocity = np.ones(shape=(dim,))

    initializer = MulticomponentLump(dim=dim, nspecies=nspecies,
                                     spec_centers=centers, velocity=velocity,
                                     spec_y0s=spec_y0s,
                                     spec_amplitudes=spec_amplitudes)
    boundaries = {
        BTAG_ALL: PrescribedInviscidBoundary(fluid_solution_func=initializer)
    }

    if rst_filename:
        current_t = restart_data["t"]
        current_step = restart_data["step"]
        current_state = restart_data["state"]
        if logmgr:
            from mirgecom.logging_quantities import logmgr_set_time
            logmgr_set_time(logmgr, current_step, current_t)
    else:
        # Set the current state from time 0
        current_state = initializer(nodes)

    visualizer = make_visualizer(discr)
    initname = initializer.__class__.__name__
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim, order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt, t_final=t_final, nstatus=nstatus,
                                     nviz=nviz, cfl=current_cfl,
                                     constant_cfl=constant_cfl, initname=initname,
                                     eosname=eosname, casename=casename)
    if rank == 0:
        logger.info(init_message)

    def my_write_status(component_errors):
        if rank == 0:
            logger.info(
                "------- errors="
                + ", ".join("%.3g" % en for en in component_errors))

    def my_write_viz(step, t, state, dv=None, exact=None, resid=None):
        if dv is None:
            dv = eos.dependent_vars(state)
        if exact is None:
            exact = initializer(x_vec=nodes, eos=eos, time=t)
        if resid is None:
            resid = state - exact
        viz_fields = [("cv", state),
                      ("dv", dv),
                      ("exact", exact),
                      ("resid", resid)]
        from mirgecom.simutil import write_visfile
        write_visfile(discr, viz_fields, visualizer, vizname=casename,
                      step=step, t=t, overwrite=True, vis_timer=vis_timer)

    def my_write_restart(step, t, state):
        rst_fname = rst_pattern.format(cname=casename, step=step, rank=rank)
        if rst_fname != rst_filename:
            rst_data = {
                "local_mesh": local_mesh,
                "state": state,
                "t": t,
                "step": step,
                "order": order,
                "global_nelements": global_nelements,
                "num_parts": nparts
            }
            from mirgecom.restart import write_restart_file
            write_restart_file(actx, rst_data, rst_fname, comm)

    def my_health_check(pressure, component_errors):
        health_error = False
        from mirgecom.simutil import check_naninf_local, check_range_local
        if check_naninf_local(discr, "vol", pressure) \
           or check_range_local(discr, "vol", pressure, .99999999, 1.00000001):
            health_error = True
            logger.info(f"{rank=}: Invalid pressure data found.")

        exittol = .09
        if max(component_errors) > exittol:
            health_error = True
            if rank == 0:
                logger.info("Solution diverged from exact soln.")

        return health_error

    def my_pre_step(step, t, dt, state):
        try:
            dv = None
            exact = None
            component_errors = None

            if logmgr:
                logmgr.tick_before()

            from mirgecom.simutil import check_step
            do_viz = check_step(step=step, interval=nviz)
            do_restart = check_step(step=step, interval=nrestart)
            do_health = check_step(step=step, interval=nhealth)
            do_status = check_step(step=step, interval=nstatus)

            if do_health:
                dv = eos.dependent_vars(state)
                exact = initializer(x_vec=nodes, eos=eos, time=t)
                from mirgecom.simutil import compare_fluid_solutions
                component_errors = compare_fluid_solutions(discr, state, exact)
                from mirgecom.simutil import allsync
                health_errors = allsync(
                    my_health_check(dv.pressure, component_errors),
                    comm, op=MPI.LOR
                )
                if health_errors:
                    if rank == 0:
                        logger.info("Fluid solution failed health check.")
                    raise MyRuntimeError("Failed simulation health check.")

            if do_restart:
                my_write_restart(step=step, t=t, state=state)

            if do_viz:
                if dv is None:
                    dv = eos.dependent_vars(state)
                if exact is None:
                    exact = initializer(x_vec=nodes, eos=eos, time=t)
                resid = state - exact
                my_write_viz(step=step, t=t, state=state, dv=dv, exact=exact,
                             resid=resid)

            if do_status:
                if component_errors is None:
                    if exact is None:
                        exact = initializer(x_vec=nodes, eos=eos, time=t)
                    from mirgecom.simutil import compare_fluid_solutions
                    component_errors = compare_fluid_solutions(discr, state, exact)
                my_write_status(component_errors)

        except MyRuntimeError:
            if rank == 0:
                logger.info("Errors detected; attempting graceful exit.")
            my_write_viz(step=step, t=t, state=state)
            my_write_restart(step=step, t=t, state=state)
            raise

        dt = get_sim_timestep(discr, state, t, dt, current_cfl, eos, t_final,
                              constant_cfl)
        return state, dt

    def my_post_step(step, t, dt, state):
        # Logmgr needs to know about EOS, dt, dim?
        # imo this is a design/scope flaw
        if logmgr:
            set_dt(logmgr, dt)
            set_sim_state(logmgr, dim, state, eos)
            logmgr.tick_after()
        return state, dt

    def my_rhs(t, state):
        return euler_operator(discr, cv=state, time=t,
                              boundaries=boundaries, eos=eos)

    current_dt = get_sim_timestep(discr, current_state, current_t, current_dt,
                                  current_cfl, eos, t_final, constant_cfl)

    current_step, current_t, current_state = \
        advance_state(rhs=my_rhs, timestepper=timestepper,
                      pre_step_callback=my_pre_step, dt=current_dt,
                      post_step_callback=my_post_step,
                      state=current_state, t=current_t, t_final=t_final)

    # Dump the final data
    if rank == 0:
        logger.info("Checkpointing final state ...")

    final_dv = eos.dependent_vars(current_state)
    final_exact = initializer(x_vec=nodes, eos=eos, time=current_t)
    final_resid = current_state - final_exact
    my_write_viz(step=current_step, t=current_t, state=current_state, dv=final_dv,
                 exact=final_exact, resid=final_resid)
    my_write_restart(step=current_step, t=current_t, state=current_state)

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())

    finish_tol = 1e-16
    time_err = current_t - t_final
    if np.abs(time_err) > finish_tol:
        raise ValueError(f"Simulation did not finish at expected time {time_err=}.")
def main(ctx_factory=cl.create_some_context,
         snapshot_pattern="y0euler-{step:06d}-{rank:04d}.pkl",
         restart_step=None,
         use_profiling=False,
         use_logmgr=False):
    """Drive the Y0 example."""

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    rank = 0
    rank = comm.Get_rank()
    nparts = comm.Get_size()
    """logging and profiling"""
    logmgr = initialize_logmgr(use_logmgr,
                               use_profiling,
                               filename="y0euler.sqlite",
                               mode="wu",
                               mpi_comm=comm)

    cl_ctx = ctx_factory()
    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
        actx = PyOpenCLProfilingArrayContext(
            queue,
            allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)),
            logmgr=logmgr)
    else:
        queue = cl.CommandQueue(cl_ctx)
        actx = PyOpenCLArrayContext(queue,
                                    allocator=cl_tools.MemoryPool(
                                        cl_tools.ImmediateAllocator(queue)))

    #nviz = 500
    #nrestart = 500
    nviz = 50
    nrestart = 10000000
    current_dt = 1.0e-7
    #t_final = 5.e-7
    t_final = 3e-4

    dim = 2
    order = 1
    exittol = 10000000  # do never exit when comparing to exact solution
    #t_final = 0.001
    current_cfl = 1.0
    vel_init = np.zeros(shape=(dim, ))
    vel_inflow = np.zeros(shape=(dim, ))
    vel_outflow = np.zeros(shape=(dim, ))
    orig = np.zeros(shape=(dim, ))
    #vel[0] = 340.0
    #vel_inflow[0] = 100.0  # m/s
    current_t = 0
    casename = "y0euler"
    constant_cfl = False
    # no internal euler status messages
    nstatus = 1000000000
    checkpoint_t = current_t
    current_step = 0

    # working gas: CO2 #
    #   gamma = 1.289
    #   MW=44.009  g/mol
    #   cp = 37.135 J/mol-K,
    #   rho= 1.977 kg/m^3 @298K
    gamma_CO2 = 1.289
    R_CO2 = 8314.59 / 44.009

    # background
    #   100 Pa
    #   298 K
    #   rho = 1.77619667e-3 kg/m^3
    #   velocity = 0,0,0
    rho_bkrnd = 1.77619667e-3
    pres_bkrnd = 100
    temp_bkrnd = 298
    c_bkrnd = math.sqrt(gamma_CO2 * pres_bkrnd / rho_bkrnd)

    # isentropic shock relations #
    # lab frame, moving shock
    # state 1 is behind (downstream) the shock, state 2 is in front (upstream) of the shock

    mach = 2.0
    pressure_ratio = (2. * gamma_CO2 * mach * mach -
                      (gamma_CO2 - 1.)) / (gamma_CO2 + 1.)
    density_ratio = (gamma_CO2 + 1.) * mach * mach / (
        (gamma_CO2 - 1.) * mach * mach + 2.)
    mach2 = math.sqrt(((gamma_CO2 - 1.) * mach * mach + 2.) /
                      (2. * gamma_CO2 * mach * mach - (gamma_CO2 - 1.)))

    rho1 = rho_bkrnd
    pressure1 = pres_bkrnd
    rho2 = rho1 * density_ratio
    pressure2 = pressure1 * pressure_ratio
    velocity1 = 0.
    velocity2 = -mach * c_bkrnd * (1 / density_ratio - 1)
    c_shkd = math.sqrt(gamma_CO2 * pressure2 / rho2)

    vel_inflow[0] = velocity2

    timestepper = rk4_step
    eos = IdealSingleGas(gamma=gamma_CO2, gas_const=R_CO2)
    bulk_init = Discontinuity(dim=dim,
                              x0=.05,
                              sigma=0.01,
                              rhol=rho2,
                              rhor=rho1,
                              pl=pressure2,
                              pr=pressure1,
                              ul=vel_inflow[0],
                              ur=0.)
    inflow_init = Lump(dim=dim,
                       rho0=rho2,
                       p0=pressure2,
                       center=orig,
                       velocity=vel_inflow,
                       rhoamp=0.0)
    outflow_init = Lump(dim=dim,
                        rho0=rho1,
                        p0=pressure1,
                        center=orig,
                        velocity=vel_outflow,
                        rhoamp=0.0)

    inflow = PrescribedBoundary(inflow_init)
    outflow = PrescribedBoundary(outflow_init)
    wall = AdiabaticSlipBoundary()
    dummy = DummyBoundary()

    # shock capturing parameters
    # sonic conditions
    density_ratio = (gamma_CO2 + 1.) * 1.0 / ((gamma_CO2 - 1.) + 2.)

    density_star = rho1 * density_ratio
    shock_thickness = 20 * 0.001  # on the order of 3 elements, should match what is in mesh generator
    # alpha is ~h/p (spacing/order)
    #alpha_sc = shock_thickness*abs(velocity1-velocity2)*density_star
    alpha_sc = 0.1
    # sigma is ~p^-4
    sigma_sc = -11.0
    # kappa is empirical ...
    kappa_sc = 0.5
    print(
        f"Shock capturing parameters: alpha {alpha_sc}, s0 {sigma_sc}, kappa {kappa_sc}"
    )

    # timestep estimate
    wave_speed = max(mach2 * c_bkrnd, c_shkd + velocity2)
    char_len = 0.001
    area = char_len * char_len / 2
    perimeter = 2 * char_len + math.sqrt(2 * char_len * char_len)
    h = 2 * area / perimeter

    dt_est = 1 / (wave_speed * order * order / h)
    print(f"Time step estimate {dt_est}\n")

    dt_est_visc = 1 / (wave_speed * order * order / h +
                       alpha_sc * order * order * order * order / h / h)
    print(f"Viscous timestep estimate {dt_est_visc}\n")

    from grudge import sym
    #    boundaries = {BTAG_ALL: DummyBoundary}
    boundaries = {
        sym.DTAG_BOUNDARY("Inflow"): inflow,
        sym.DTAG_BOUNDARY("Outflow"): outflow,
        sym.DTAG_BOUNDARY("Wall"): wall
    }

    #local_mesh, global_nelements = create_parallel_grid(comm,
    #get_pseudo_y0_mesh)
    #
    #local_nelements = local_mesh.nelements

    if restart_step is None:
        local_mesh, global_nelements = create_parallel_grid(comm, get_mesh)
        local_nelements = local_mesh.nelements

    else:  # Restart
        with open(snapshot_pattern.format(step=restart_step, rank=rank),
                  "rb") as f:
            restart_data = pickle.load(f)

        local_mesh = restart_data["local_mesh"]
        local_nelements = local_mesh.nelements
        global_nelements = restart_data["global_nelements"]

        assert comm.Get_size() == restart_data["num_parts"]

    if rank == 0:
        logging.info("Making discretization")
    discr = EagerDGDiscretization(actx,
                                  local_mesh,
                                  order=order,
                                  mpi_communicator=comm)
    nodes = thaw(actx, discr.nodes())

    if restart_step is None:
        if rank == 0:
            logging.info("Initializing soln.")
        current_state = bulk_init(0, nodes, eos=eos)
    else:
        current_t = restart_data["t"]
        current_step = restart_step

        current_state = unflatten(
            actx, discr.discr_from_dd("vol"),
            obj_array_vectorize(actx.from_numpy, restart_data["state"]))

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_discretization_quantities(logmgr, discr, eos, dim)
        #logmgr_add_package_versions(logmgr)

        logmgr.add_watches([
            "step.max", "t_sim.max", "t_step.max", "min_pressure",
            "max_pressure", "min_temperature", "max_temperature"
        ])

        try:
            logmgr.add_watches(["memory_usage.max"])
        except KeyError:
            pass

        if use_profiling:
            logmgr.add_watches(["pyopencl_array_time.max"])

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

    #visualizer = make_visualizer(discr, discr.order + 3
    #if discr.dim == 2 else discr.order)
    visualizer = make_visualizer(discr, discr.order)

    #    initname = initializer.__class__.__name__
    initname = "pseudoY0"
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim,
                                     order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt,
                                     t_final=t_final,
                                     nstatus=nstatus,
                                     nviz=nviz,
                                     cfl=current_cfl,
                                     constant_cfl=constant_cfl,
                                     initname=initname,
                                     eosname=eosname,
                                     casename=casename)
    if rank == 0:
        logger.info(init_message)

    get_timestep = partial(inviscid_sim_timestep,
                           discr=discr,
                           t=current_t,
                           dt=current_dt,
                           cfl=current_cfl,
                           eos=eos,
                           t_final=t_final,
                           constant_cfl=constant_cfl)

    def my_rhs(t, state):
        #return inviscid_operator(discr, eos=eos, boundaries=boundaries, q=state, t=t)
        return (inviscid_operator(
            discr, q=state, t=t, boundaries=boundaries, eos=eos) +
                artificial_viscosity(discr,
                                     t=t,
                                     r=state,
                                     eos=eos,
                                     boundaries=boundaries,
                                     alpha=alpha_sc,
                                     sigma=sigma_sc,
                                     kappa=kappa_sc))

    def my_checkpoint(step, t, dt, state):

        write_restart = (check_step(step, nrestart)
                         if step != restart_step else False)
        if write_restart is True:
            with open(snapshot_pattern.format(step=step, rank=rank),
                      "wb") as f:
                pickle.dump(
                    {
                        "local_mesh": local_mesh,
                        "state": obj_array_vectorize(actx.to_numpy,
                                                     flatten(state)),
                        "t": t,
                        "step": step,
                        "global_nelements": global_nelements,
                        "num_parts": nparts,
                    }, f)

        #x0=f(time)
        exact_soln = Discontinuity(dim=dim,
                                   x0=.05,
                                   sigma=0.00001,
                                   rhol=rho2,
                                   rhor=rho1,
                                   pl=pressure2,
                                   pr=pressure1,
                                   ul=vel_inflow[0],
                                   ur=0.,
                                   uc=mach * c_bkrnd)

        return sim_checkpoint(discr=discr,
                              visualizer=visualizer,
                              eos=eos,
                              q=state,
                              vizname=casename,
                              step=step,
                              t=t,
                              dt=dt,
                              nstatus=nstatus,
                              nviz=nviz,
                              exittol=exittol,
                              constant_cfl=constant_cfl,
                              comm=comm,
                              vis_timer=vis_timer,
                              overwrite=True,
                              exact_soln=exact_soln,
                              sigma=sigma_sc,
                              kappa=kappa_sc)

    if rank == 0:
        logging.info("Stepping.")

    (current_step, current_t, current_state) = \
        advance_state(rhs=my_rhs, timestepper=timestepper,
                      checkpoint=my_checkpoint,
                      get_timestep=get_timestep, state=current_state,
                      t_final=t_final, t=current_t, istep=current_step,
                      logmgr=logmgr,eos=eos,dim=dim)

    if rank == 0:
        logger.info("Checkpointing final state ...")

    my_checkpoint(current_step,
                  t=current_t,
                  dt=(current_t - checkpoint_t),
                  state=current_state)

    if current_t - t_final < 0:
        raise ValueError("Simulation exited abnormally")

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())
Beispiel #4
0
def main(ctx_factory=cl.create_some_context,
         use_logmgr=True,
         use_leap=False,
         use_profiling=False,
         casename=None,
         rst_filename=None,
         actx_class=PyOpenCLArrayContext):
    """Drive the example."""
    cl_ctx = ctx_factory()

    if casename is None:
        casename = "mirgecom"

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    rank = comm.Get_rank()
    num_parts = comm.Get_size()

    from mirgecom.simutil import global_reduce as _global_reduce
    global_reduce = partial(_global_reduce, comm=comm)

    logmgr = initialize_logmgr(use_logmgr,
                               filename=f"{casename}.sqlite",
                               mode="wu",
                               mpi_comm=comm)

    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
    else:
        queue = cl.CommandQueue(cl_ctx)

    actx = actx_class(queue,
                      allocator=cl_tools.MemoryPool(
                          cl_tools.ImmediateAllocator(queue)))

    # timestepping control
    current_step = 0
    if use_leap:
        from leap.rk import RK4MethodBuilder
        timestepper = RK4MethodBuilder("state")
    else:
        timestepper = rk4_step
    t_final = 0.01
    current_cfl = 1.0
    current_dt = .001
    current_t = 0
    constant_cfl = False

    # some i/o frequencies
    nrestart = 10
    nstatus = 1
    nviz = 10
    nhealth = 10

    dim = 2
    if dim != 2:
        raise ValueError("This example must be run with dim = 2.")

    rst_path = "restart_data/"
    rst_pattern = (rst_path + "{cname}-{step:04d}-{rank:04d}.pkl")
    if rst_filename:  # read the grid from restart data
        rst_filename = f"{rst_filename}-{rank:04d}.pkl"
        from mirgecom.restart import read_restart_data
        restart_data = read_restart_data(actx, rst_filename)
        local_mesh = restart_data["local_mesh"]
        local_nelements = local_mesh.nelements
        global_nelements = restart_data["global_nelements"]
        assert restart_data["num_parts"] == num_parts
    else:  # generate the grid from scratch
        nel_1d = 16
        box_ll = -5.0
        box_ur = 5.0
        from meshmode.mesh.generation import generate_regular_rect_mesh
        generate_mesh = partial(generate_regular_rect_mesh,
                                a=(box_ll, ) * dim,
                                b=(box_ur, ) * dim,
                                nelements_per_axis=(nel_1d, ) * dim)
        local_mesh, global_nelements = generate_and_distribute_mesh(
            comm, generate_mesh)
        local_nelements = local_mesh.nelements

    order = 3
    discr = EagerDGDiscretization(actx,
                                  local_mesh,
                                  order=order,
                                  mpi_communicator=comm)
    nodes = thaw(discr.nodes(), actx)

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_device_memory_usage(logmgr, queue)
        logmgr_add_many_discretization_quantities(logmgr, discr, dim,
                                                  extract_vars_for_logging,
                                                  units_for_logging)

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

        logmgr.add_watches([
            ("step.max", "step = {value}, "),
            ("t_sim.max", "sim time: {value:1.6e} s\n"),
            ("min_pressure", "------- P (min, max) (Pa) = ({value:1.9e}, "),
            ("max_pressure", "{value:1.9e})\n"),
            ("t_step.max", "------- step walltime: {value:6g} s, "),
            ("t_log.max", "log walltime: {value:6g} s")
        ])

        try:
            logmgr.add_watches(
                ["memory_usage_python.max", "memory_usage_gpu.max"])
        except KeyError:
            pass

        if use_profiling:
            logmgr.add_watches(["multiply_time.max"])

    # soln setup and init
    eos = IdealSingleGas()
    vel = np.zeros(shape=(dim, ))
    orig = np.zeros(shape=(dim, ))
    vel[:dim] = 1.0
    initializer = Vortex2D(center=orig, velocity=vel)
    gas_model = GasModel(eos=eos)

    def boundary_solution(discr, btag, gas_model, state_minus, **kwargs):
        actx = state_minus.array_context
        bnd_discr = discr.discr_from_dd(btag)
        nodes = thaw(bnd_discr.nodes(), actx)
        return make_fluid_state(
            initializer(x_vec=nodes, eos=gas_model.eos, **kwargs), gas_model)

    boundaries = {
        BTAG_ALL:
        PrescribedFluidBoundary(boundary_state_func=boundary_solution)
    }

    if rst_filename:
        current_t = restart_data["t"]
        current_step = restart_data["step"]
        current_cv = restart_data["cv"]
        if logmgr:
            from mirgecom.logging_quantities import logmgr_set_time
            logmgr_set_time(logmgr, current_step, current_t)
    else:
        # Set the current state from time 0
        current_cv = initializer(nodes)

    current_state = make_fluid_state(current_cv, gas_model)

    visualizer = make_visualizer(discr)

    initname = initializer.__class__.__name__
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim,
                                     order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt,
                                     t_final=t_final,
                                     nstatus=nstatus,
                                     nviz=nviz,
                                     cfl=current_cfl,
                                     constant_cfl=constant_cfl,
                                     initname=initname,
                                     eosname=eosname,
                                     casename=casename)
    if rank == 0:
        logger.info(init_message)

    def my_write_status(state, component_errors, cfl=None):
        if cfl is None:
            if constant_cfl:
                cfl = current_cfl
            else:
                from grudge.op import nodal_max
                from mirgecom.inviscid import get_inviscid_cfl
                cfl = actx.to_numpy(
                    nodal_max(discr, "vol",
                              get_inviscid_cfl(discr, state, current_dt)))[()]
        if rank == 0:
            logger.info(f"------ {cfl=}\n"
                        "------- errors=" +
                        ", ".join("%.3g" % en for en in component_errors))

    def my_write_viz(step, t, state, dv=None, exact=None, resid=None):
        if exact is None:
            exact = initializer(x_vec=nodes, eos=eos, time=t)
        if resid is None:
            resid = state - exact
        viz_fields = [("cv", state), ("dv", dv), ("exact", exact),
                      ("residual", resid)]
        from mirgecom.simutil import write_visfile
        write_visfile(discr,
                      viz_fields,
                      visualizer,
                      vizname=casename,
                      step=step,
                      t=t,
                      overwrite=True,
                      vis_timer=vis_timer)

    def my_write_restart(step, t, state):
        rst_fname = rst_pattern.format(cname=casename, step=step, rank=rank)
        if rst_fname != rst_filename:
            rst_data = {
                "local_mesh": local_mesh,
                "cv": state,
                "t": t,
                "step": step,
                "order": order,
                "global_nelements": global_nelements,
                "num_parts": num_parts
            }
            from mirgecom.restart import write_restart_file
            write_restart_file(actx, rst_data, rst_fname, comm)

    def my_health_check(pressure, component_errors):
        health_error = False
        from mirgecom.simutil import check_naninf_local, check_range_local
        if check_naninf_local(discr, "vol", pressure) \
           or check_range_local(discr, "vol", pressure, .2, 1.02):
            health_error = True
            logger.info(f"{rank=}: Invalid pressure data found.")

        exittol = .1
        if max(component_errors) > exittol:
            health_error = True
            if rank == 0:
                logger.info("Solution diverged from exact soln.")

        return health_error

    def my_pre_step(step, t, dt, state):
        fluid_state = make_fluid_state(state, gas_model)
        cv = fluid_state.cv
        dv = fluid_state.dv

        try:
            exact = None
            component_errors = None

            if logmgr:
                logmgr.tick_before()

            do_viz = check_step(step=step, interval=nviz)
            do_restart = check_step(step=step, interval=nrestart)
            do_health = check_step(step=step, interval=nhealth)
            do_status = check_step(step=step, interval=nstatus)

            if do_health:
                exact = initializer(x_vec=nodes, eos=eos, time=t)
                from mirgecom.simutil import compare_fluid_solutions
                component_errors = compare_fluid_solutions(discr, cv, exact)
                health_errors = global_reduce(my_health_check(
                    dv.pressure, component_errors),
                                              op="lor")
                if health_errors:
                    if rank == 0:
                        logger.info("Fluid solution failed health check.")
                    raise MyRuntimeError("Failed simulation health check.")

            if do_restart:
                my_write_restart(step=step, t=t, state=cv)

            if do_status:
                if component_errors is None:
                    if exact is None:
                        exact = initializer(x_vec=nodes, eos=eos, time=t)
                    from mirgecom.simutil import compare_fluid_solutions
                    component_errors = compare_fluid_solutions(
                        discr, cv, exact)
                my_write_status(fluid_state, component_errors)

            if do_viz:
                if exact is None:
                    exact = initializer(x_vec=nodes, eos=eos, time=t)
                resid = state - exact
                my_write_viz(step=step,
                             t=t,
                             state=cv,
                             dv=dv,
                             exact=exact,
                             resid=resid)

        except MyRuntimeError:
            if rank == 0:
                logger.info("Errors detected; attempting graceful exit.")
            my_write_viz(step=step, t=t, state=cv)
            my_write_restart(step=step, t=t, state=cv)
            raise

        dt = get_sim_timestep(discr, fluid_state, t, dt, current_cfl, t_final,
                              constant_cfl)
        return state, dt

    def my_post_step(step, t, dt, state):
        # Logmgr needs to know about EOS, dt, dim?
        # imo this is a design/scope flaw
        if logmgr:
            set_dt(logmgr, dt)
            set_sim_state(logmgr, dim, state, eos)
            logmgr.tick_after()
        return state, dt

    def my_rhs(t, state):
        fluid_state = make_fluid_state(state, gas_model)
        return euler_operator(discr,
                              state=fluid_state,
                              time=t,
                              boundaries=boundaries,
                              gas_model=gas_model)

    current_dt = get_sim_timestep(discr, current_state, current_t, current_dt,
                                  current_cfl, t_final, constant_cfl)

    current_step, current_t, current_cv = \
        advance_state(rhs=my_rhs, timestepper=timestepper,
                      pre_step_callback=my_pre_step,
                      post_step_callback=my_post_step, dt=current_dt,
                      state=current_state.cv, t=current_t, t_final=t_final)

    # Dump the final data
    if rank == 0:
        logger.info("Checkpointing final state ...")

    current_state = make_fluid_state(current_cv, gas_model)
    final_dv = current_state.dv
    final_exact = initializer(x_vec=nodes, eos=eos, time=current_t)
    final_resid = current_state.cv - final_exact
    my_write_viz(step=current_step,
                 t=current_t,
                 state=current_state.cv,
                 dv=final_dv,
                 exact=final_exact,
                 resid=final_resid)
    my_write_restart(step=current_step, t=current_t, state=current_state.cv)

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())

    finish_tol = 1e-16
    assert np.abs(current_t - t_final) < finish_tol
Beispiel #5
0
def main(ctx_factory=cl.create_some_context,
         use_profiling=False,
         use_logmgr=False,
         use_leap=False):
    """Drive the example."""
    from mpi4py import MPI
    comm = MPI.COMM_WORLD

    logmgr = initialize_logmgr(use_logmgr,
                               filename="vortex.sqlite",
                               mode="wu",
                               mpi_comm=comm)

    cl_ctx = ctx_factory()
    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
        actx = PyOpenCLProfilingArrayContext(
            queue,
            allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)),
            logmgr=logmgr)
    else:
        queue = cl.CommandQueue(cl_ctx)
        actx = PyOpenCLArrayContext(queue,
                                    allocator=cl_tools.MemoryPool(
                                        cl_tools.ImmediateAllocator(queue)))

    dim = 2
    nel_1d = 16
    order = 3
    exittol = .1
    t_final = 0.1
    current_cfl = 1.0
    vel = np.zeros(shape=(dim, ))
    orig = np.zeros(shape=(dim, ))
    vel[:dim] = 1.0
    current_dt = .001
    current_t = 0
    eos = IdealSingleGas()
    initializer = Vortex2D(center=orig, velocity=vel)
    casename = "vortex"
    boundaries = {BTAG_ALL: PrescribedBoundary(initializer)}
    constant_cfl = False
    nstatus = 10
    nviz = 10
    rank = 0
    checkpoint_t = current_t
    current_step = 0
    if use_leap:
        from leap.rk import RK4MethodBuilder
        timestepper = RK4MethodBuilder("state")
    else:
        timestepper = rk4_step
    box_ll = -5.0
    box_ur = 5.0

    rank = comm.Get_rank()

    if dim != 2:
        raise ValueError("This example must be run with dim = 2.")

    from meshmode.mesh.generation import generate_regular_rect_mesh
    generate_mesh = partial(generate_regular_rect_mesh,
                            a=(box_ll, ) * dim,
                            b=(box_ur, ) * dim,
                            nelements_per_axis=(nel_1d, ) * dim)
    local_mesh, global_nelements = generate_and_distribute_mesh(
        comm, generate_mesh)
    local_nelements = local_mesh.nelements

    discr = EagerDGDiscretization(actx,
                                  local_mesh,
                                  order=order,
                                  mpi_communicator=comm)
    nodes = thaw(actx, discr.nodes())
    current_state = initializer(nodes)

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_device_memory_usage(logmgr, queue)
        logmgr_add_many_discretization_quantities(logmgr, discr, dim,
                                                  extract_vars_for_logging,
                                                  units_for_logging)

        logmgr.add_watches([
            "step.max", "t_step.max", "t_log.max", "min_temperature",
            "L2_norm_momentum1"
        ])

        try:
            logmgr.add_watches(
                ["memory_usage_python.max", "memory_usage_gpu.max"])
        except KeyError:
            pass

        if use_profiling:
            logmgr.add_watches(["multiply_time.max"])

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

    visualizer = make_visualizer(discr)

    initname = initializer.__class__.__name__
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim,
                                     order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt,
                                     t_final=t_final,
                                     nstatus=nstatus,
                                     nviz=nviz,
                                     cfl=current_cfl,
                                     constant_cfl=constant_cfl,
                                     initname=initname,
                                     eosname=eosname,
                                     casename=casename)
    if rank == 0:
        logger.info(init_message)

    get_timestep = partial(inviscid_sim_timestep,
                           discr=discr,
                           t=current_t,
                           dt=current_dt,
                           cfl=current_cfl,
                           eos=eos,
                           t_final=t_final,
                           constant_cfl=constant_cfl)

    def my_rhs(t, state):
        return euler_operator(discr,
                              cv=state,
                              t=t,
                              boundaries=boundaries,
                              eos=eos)

    def my_checkpoint(step, t, dt, state):
        return sim_checkpoint(discr,
                              visualizer,
                              eos,
                              cv=state,
                              exact_soln=initializer,
                              vizname=casename,
                              step=step,
                              t=t,
                              dt=dt,
                              nstatus=nstatus,
                              nviz=nviz,
                              exittol=exittol,
                              constant_cfl=constant_cfl,
                              comm=comm,
                              vis_timer=vis_timer)

    try:
        (current_step, current_t, current_state) = \
            advance_state(rhs=my_rhs, timestepper=timestepper,
                checkpoint=my_checkpoint,
                get_timestep=get_timestep, state=current_state,
                t=current_t, t_final=t_final, logmgr=logmgr,
                eos=eos, dim=dim)
    except ExactSolutionMismatch as ex:
        current_step = ex.step
        current_t = ex.t
        current_state = ex.state

    #    if current_t != checkpoint_t:
    if rank == 0:
        logger.info("Checkpointing final state ...")
    my_checkpoint(current_step,
                  t=current_t,
                  dt=(current_t - checkpoint_t),
                  state=current_state)

    if current_t - t_final < 0:
        raise ValueError("Simulation exited abnormally")

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())
Beispiel #6
0
def main(ctx_factory=cl.create_some_context,
         snapshot_pattern="y0euler-{step:06d}-{rank:04d}.pkl",
         restart_step=None, use_profiling=False, use_logmgr=False):
    """Drive the Y0 example."""

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    rank = 0
    rank = comm.Get_rank()
    nparts = comm.Get_size()

    """logging and profiling"""
    logmgr = initialize_logmgr(use_logmgr, filename="y0euler.sqlite",
        mode="wo", mpi_comm=comm)

    cl_ctx = ctx_factory()
    if use_profiling:
        queue = cl.CommandQueue(cl_ctx,
            properties=cl.command_queue_properties.PROFILING_ENABLE)
        actx = PyOpenCLProfilingArrayContext(queue,
            allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)),
            logmgr=logmgr)
    else:
        queue = cl.CommandQueue(cl_ctx)
        actx = PyOpenCLArrayContext(queue,
            allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)))

    #nviz = 500
    #nrestart = 500
    nviz = 100
    nrestart = 100
    #current_dt = 2.5e-8 # stable with euler
    current_dt = 4e-7 # stable with lrsrk144
    t_final = 5.e-1

    dim = 3
    order = 1
    exittol = .09
    #t_final = 0.001
    current_cfl = 1.0
    vel_init = np.zeros(shape=(dim,))
    vel_inflow = np.zeros(shape=(dim,))
    vel_outflow = np.zeros(shape=(dim,))
    orig = np.zeros(shape=(dim,))
    orig[0] = 0.83
    orig[2] = 0.001
    #vel[0] = 340.0
    #vel_inflow[0] = 100.0  # m/s
    current_t = 0
    casename = "y0euler"
    constant_cfl = False
    nstatus = 10000000000
    rank = 0
    checkpoint_t = current_t
    current_step = 0

    # working gas: CO2 #
    #   gamma = 1.289
    #   MW=44.009  g/mol
    #   cp = 37.135 J/mol-K,
    #   rho= 1.977 kg/m^3 @298K
    gamma_CO2 = 1.289
    R_CO2 = 8314.59/44.009

    # background
    #   100 Pa
    #   298 K
    #   rho = 1.77619667e-3 kg/m^3
    #   velocity = 0,0,0
    rho_bkrnd=1.77619667e-3
    pres_bkrnd=100
    temp_bkrnd=298
     
    # nozzle inflow #
    # 
    # stagnation tempertuare 298 K
    # stagnation pressure 1.5e Pa
    # 
    # isentropic expansion based on the area ratios between the inlet (r=13e-3m) and the throat (r=6.3e-3)
    #
    #  MJA, this is calculated offline, add some code to do it for us
    # 
    #   Mach number=0.139145
    #   pressure=148142
    #   temperature=297.169
    #   density=2.63872
    #   gamma=1.289

    # calculate the inlet Mach number from the area ratio
    nozzleInletRadius = 13.e-3
    nozzleThroatRadius = 6.3e-3
    nozzleInletArea = math.pi*nozzleInletRadius*nozzleInletRadius
    nozzleThroatArea = math.pi*nozzleThroatRadius*nozzleThroatRadius
    inletAreaRatio = nozzleInletArea/nozzleThroatArea

    def getMachFromAreaRatio(area_ratio, gamma, mach_guess=0.01):
        error=1.e-8
        nextError=1.e8
        g=gamma
        M0=mach_guess
        while nextError > error:
            R = ((2/(g+1)+((g-1)/(g+1)*M0*M0))**(((g+1)/(2*g-2))))/M0-area_ratio
            dRdM = (2*((2/(g+1)+((g-1)/(g+1)*M0*M0))**(((g+1)/(2*g-2))))/
                   (2*g-2)*(g-1)/(2/(g+1)+((g-1)/(g+1)*M0*M0))-
                   ((2/(g+1)+((g-1)/(g+1)*M0*M0))**(((g+1)/(2*g-2))))* M0**(-2))
      
            M1=M0-R/dRdM
            nextError=abs(R)
            M0=M1

        return M1


    def getIsentropicPressure(mach, P0, gamma):
        pressure=(1.+(gamma-1.)*0.5*math.pow(mach,2))
        pressure=P0*math.pow(pressure,(-gamma/(gamma-1.)))
        return pressure

  
    def getIsentropicTemperature(mach, T0, gamma):
      temperature=(1.+(gamma-1.)*0.5*math.pow(mach,2))
      temperature=T0*math.pow(temperature,-1.0)
      return temperature


    inlet_mach = getMachFromAreaRatio(area_ratio = inletAreaRatio, gamma=gamma_CO2, mach_guess = 0.01);
    # ramp the stagnation pressure
    start_ramp_pres = 1000
    ramp_interval = 5.e-3
    t_ramp_start = 1e-5
    pres_inflow = getIsentropicPressure(mach=inlet_mach, P0=start_ramp_pres, gamma=gamma_CO2)
    temp_inflow = getIsentropicTemperature(mach=inlet_mach, T0=298, gamma=gamma_CO2)
    rho_inflow = pres_inflow/temp_inflow/R_CO2

    print(f'inlet Mach number {inlet_mach}')
    print(f'inlet temperature {temp_inflow}')
    print(f'inlet pressure {pres_inflow}')

    end_ramp_pres = 150000
    pres_inflow_final = getIsentropicPressure(mach=inlet_mach, P0=end_ramp_pres, gamma=gamma_CO2)

    print(f'final inlet pressure {pres_inflow_final}')


    #pres_inflow=148142
    #temp_inflow=297.169
    #rho_inflow=2.63872
    #mach_inflow=infloM = 0.139145
    vel_inflow[0] = inlet_mach*math.sqrt(gamma_CO2*pres_inflow/rho_inflow)

    # starting pressure for the inflow ramp

    #timestepper = rk4_step
    #timestepper = lsrk54_step
    timestepper = lsrk144_step
    #timestepper = euler_step
    eos = IdealSingleGas(gamma=gamma_CO2, gas_const=R_CO2)
    bulk_init = Discontinuity(dim=dim, x0=-.30,sigma=0.005,
    #bulk_init = Discontinuity(dim=dim, x0=-.31,sigma=0.04,
                              rhol=rho_inflow, rhor=rho_bkrnd,
                              pl=pres_inflow, pr=pres_bkrnd,
                              ul=vel_inflow, ur=vel_outflow)
    #inflow_init = Lump(dim=dim, rho0=rho_inflow, p0=pres_inflow,
                       #center=orig, velocity=vel_inflow, rhoamp=0.0)
    #outflow_init = Lump(dim=dim, rho0=rho_bkrnd, p0=pres_bkrnd,
                       #center=orig, velocity=vel_outflow, rhoamp=0.0)

    # pressure ramp function
    def inflow_ramp_pressure(t, startP=start_ramp_pres, finalP=end_ramp_pres, 
                             ramp_interval=ramp_interval, t_ramp_start=t_ramp_start):
      if t > t_ramp_start:
          rampPressure = min(finalP, startP+(t-t_ramp_start)/ramp_interval*(finalP-startP))
      else:
          rampPressure = startP
      return rampPressure


    class IsentropicInflow:

        def __init__(self, *, dim=1, direc=0, T0=298, P0=1e5, mach= 0.01, p_fun = None):

            self._P0 = P0
            self._T0 = T0
            self._dim = dim
            self._direc = direc
            self._mach = mach
            if p_fun is not None:
              self._p_fun = p_fun
    
        def __call__(self, x_vec, *, t=0, eos):
    
    
            if self._p_fun is not None:
                P0 = self._p_fun(t)
            else:
                P0 = self._P0
            T0 = self._T0

            gamma = eos.gamma()
            gas_const = eos.gas_const()
            pressure = getIsentropicPressure(mach=self._mach, P0=P0, gamma=gamma)
            temperature = getIsentropicTemperature(mach=self._mach, T0=T0, gamma=gamma)
            rho = pressure/temperature/gas_const

            #print(f'ramp Mach number {self._mach}')
            #print(f'ramp stagnation pressure {P0}')
            #print(f'ramp stagnation temperature {T0}')
            #print(f'ramp pressure {pressure}')
            #print(f'ramp temperature {temperature}')

            velocity = np.zeros(shape=(self._dim,)) 
            velocity[self._direc] = self._mach*math.sqrt(gamma*pressure/rho)
    
            mass = 0.0*x_vec[0] + rho
            mom = velocity*mass
            energy = (pressure/(gamma - 1.0)) + np.dot(mom, mom)/(2.0*mass)
            from mirgecom.euler import join_conserved
            return join_conserved(dim=self._dim, mass=mass, momentum=mom, energy=energy)


    inflow_init = IsentropicInflow(dim=dim, T0=298, P0=start_ramp_pres, 
                                   mach = inlet_mach , p_fun=inflow_ramp_pressure)
    outflow_init = Uniform(dim=dim, rho=rho_bkrnd, p=pres_bkrnd,
                           velocity=vel_outflow)

    inflow = PrescribedBoundary(inflow_init)
    outflow = PrescribedBoundary(outflow_init)
    wall = AdiabaticSlipBoundary()
    dummy = DummyBoundary()

    alpha_sc = 0.5
    # s0 is ~p^-4 
    #s0_sc = -11.0
    s0_sc = -5.0
    # kappa is empirical ...
    kappa_sc = 0.5
    print(f"Shock capturing parameters: alpha {alpha_sc}, s0 {s0_sc}, kappa {kappa_sc}")

    # timestep estimate
    #wave_speed = max(mach2*c_bkrnd,c_shkd+velocity2[0])
    #char_len = 0.001
    #area=char_len*char_len/2
    #perimeter = 2*char_len+math.sqrt(2*char_len*char_len)
    #h = 2*area/perimeter

    #dt_est = 1/(wave_speed*order*order/h)
    #print(f"Time step estimate {dt_est}\n")
#
    #dt_est_visc = 1/(wave_speed*order*order/h+alpha_sc*order*order*order*order/h/h)
    #print(f"Viscous timestep estimate {dt_est_visc}\n")

    from grudge import sym
    boundaries = {sym.DTAG_BOUNDARY("Inflow"): inflow,
                  sym.DTAG_BOUNDARY("Outflow"): outflow,
                  sym.DTAG_BOUNDARY("Wall"): wall}

    if restart_step is None:
        local_mesh, global_nelements = create_parallel_grid(comm, get_pseudo_y0_mesh)
        local_nelements = local_mesh.nelements

    else:  # Restart
        with open(snapshot_pattern.format(step=restart_step, rank=rank), "rb") as f:
            restart_data = pickle.load(f)

        local_mesh = restart_data["local_mesh"]
        local_nelements = local_mesh.nelements
        global_nelements = restart_data["global_nelements"]

        assert comm.Get_size() == restart_data["num_parts"]

    if rank == 0:
        logging.info("Making discretization")
    discr = EagerDGDiscretization(
        actx, local_mesh, order=order, mpi_communicator=comm
    )
    nodes = thaw(actx, discr.nodes())

    if restart_step is None:
        if rank == 0:
            logging.info("Initializing soln.")
        # for Discontinuity initial conditions
        current_state = bulk_init(0, nodes, eos=eos)
        # for uniform background initial condition
        #current_state = bulk_init(nodes, eos=eos)
    else:
        current_t = restart_data["t"]
        current_step = restart_step

        current_state = unflatten(
            actx, discr.discr_from_dd("vol"),
            obj_array_vectorize(actx.from_numpy, restart_data["state"]))

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_many_discretization_quantities(logmgr, discr, dim,
            extract_vars_for_logging, units_for_logging)
        #logmgr_add_package_versions(logmgr)

        logmgr.add_watches(["step.max", "t_sim.max", "t_step.max", "t_log.max",
                            "min_pressure", "max_pressure",
                            "min_temperature", "max_temperature"])

        try:
            logmgr.add_watches(["memory_usage.max"])
        except KeyError:
            pass

        if use_profiling:
            logmgr.add_watches(["pyopencl_array_time.max"])

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

    visualizer = make_visualizer(discr, discr.order + 3
                                 if discr.dim == 2 else discr.order)
    #    initname = initializer.__class__.__name__
    initname = "pseudoY0"
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim, order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt, t_final=t_final,
                                     nstatus=nstatus, nviz=nviz,
                                     cfl=current_cfl,
                                     constant_cfl=constant_cfl,
                                     initname=initname,
                                     eosname=eosname, casename=casename)
    if rank == 0:
        logger.info(init_message)

    get_timestep = partial(inviscid_sim_timestep, discr=discr, t=current_t,
                           dt=current_dt, cfl=current_cfl, eos=eos,
                           t_final=t_final, constant_cfl=constant_cfl)

    def my_rhs(t, state):
        #return inviscid_operator(discr, eos=eos, boundaries=boundaries, q=state, t=t)
        return ( inviscid_operator(discr, q=state, t=t,boundaries=boundaries, eos=eos)
               + artificial_viscosity(discr,t=t, r=state, eos=eos, boundaries=boundaries,
               alpha=alpha_sc, s0=s0_sc, kappa=kappa_sc))

    def my_checkpoint(step, t, dt, state):

        write_restart = (check_step(step, nrestart)
                         if step != restart_step else False)
        if write_restart is True:
            with open(snapshot_pattern.format(step=step, rank=rank), "wb") as f:
                pickle.dump({
                    "local_mesh": local_mesh,
                    "state": obj_array_vectorize(actx.to_numpy, flatten(state)),
                    "t": t,
                    "step": step,
                    "global_nelements": global_nelements,
                    "num_parts": nparts,
                    }, f)

        return sim_checkpoint(discr=discr, visualizer=visualizer, eos=eos,
                              q=state, vizname=casename,
                              step=step, t=t, dt=dt, nstatus=nstatus,
                              nviz=nviz, exittol=exittol,
                              constant_cfl=constant_cfl, comm=comm, vis_timer=vis_timer,
                              overwrite=True,s0=s0_sc,kappa=kappa_sc)

    if rank == 0:
        logging.info("Stepping.")

    (current_step, current_t, current_state) = \
        advance_state(rhs=my_rhs, timestepper=timestepper,
                      checkpoint=my_checkpoint,
                      get_timestep=get_timestep, state=current_state,
                      t_final=t_final, t=current_t, istep=current_step,
                      logmgr=logmgr,eos=eos,dim=dim)

    if rank == 0:
        logger.info("Checkpointing final state ...")

    my_checkpoint(current_step, t=current_t,
                  dt=(current_t - checkpoint_t),
                  state=current_state)

    if current_t - t_final < 0:
        raise ValueError("Simulation exited abnormally")

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())
Beispiel #7
0
def main(ctx_factory=cl.create_some_context, use_logmgr=True,
         use_leap=False, use_profiling=False, casename=None,
         rst_filename=None, actx_class=PyOpenCLArrayContext,
         log_dependent=True):
    """Drive example."""
    cl_ctx = ctx_factory()

    if casename is None:
        casename = "mirgecom"

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    rank = comm.Get_rank()
    nparts = comm.Get_size()

    from mirgecom.simutil import global_reduce as _global_reduce
    global_reduce = partial(_global_reduce, comm=comm)

    logmgr = initialize_logmgr(use_logmgr,
        filename=f"{casename}.sqlite", mode="wu", mpi_comm=comm)

    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
    else:
        queue = cl.CommandQueue(cl_ctx)

    actx = actx_class(
        queue,
        allocator=cl_tools.MemoryPool(cl_tools.ImmediateAllocator(queue)))

    # timestepping control
    if use_leap:
        from leap.rk import RK4MethodBuilder
        timestepper = RK4MethodBuilder("state")
    else:
        timestepper = rk4_step
    t_final = 1e-8
    current_cfl = 1.0
    current_dt = 1e-9
    current_t = 0
    current_step = 0
    constant_cfl = False

    # some i/o frequencies
    nstatus = 1
    nhealth = 1
    nrestart = 5
    nviz = 1

    dim = 2
    rst_path = "restart_data/"
    rst_pattern = (
        rst_path + "{cname}-{step:04d}-{rank:04d}.pkl"
    )
    if rst_filename:  # read the grid from restart data
        rst_filename = f"{rst_filename}-{rank:04d}.pkl"
        from mirgecom.restart import read_restart_data
        restart_data = read_restart_data(actx, rst_filename)
        local_mesh = restart_data["local_mesh"]
        local_nelements = local_mesh.nelements
        global_nelements = restart_data["global_nelements"]
        assert restart_data["num_parts"] == nparts
    else:  # generate the grid from scratch
        nel_1d = 16
        box_ll = -5.0
        box_ur = 5.0
        from meshmode.mesh.generation import generate_regular_rect_mesh
        generate_mesh = partial(generate_regular_rect_mesh, a=(box_ll,)*dim,
                                b=(box_ur,) * dim, nelements_per_axis=(nel_1d,)*dim)
        local_mesh, global_nelements = generate_and_distribute_mesh(comm,
                                                                    generate_mesh)
        local_nelements = local_mesh.nelements

    order = 3
    discr = EagerDGDiscretization(
        actx, local_mesh, order=order, mpi_communicator=comm
    )
    nodes = thaw(discr.nodes(), actx)

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_device_memory_usage(logmgr, queue)

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

        logmgr.add_watches([
            ("step.max", "step = {value}, "),
            ("t_sim.max", "sim time: {value:1.6e} s\n"),
            ("t_step.max", "------- step walltime: {value:6g} s, "),
            ("t_log.max", "log walltime: {value:6g} s")
        ])

        if log_dependent:
            logmgr_add_many_discretization_quantities(logmgr, discr, dim,
                                                      extract_vars_for_logging,
                                                      units_for_logging)
            logmgr.add_watches([
                ("min_pressure", "\n------- P (min, max) (Pa) = ({value:1.9e}, "),
                ("max_pressure",    "{value:1.9e})\n"),
                ("min_temperature", "------- T (min, max) (K)  = ({value:7g}, "),
                ("max_temperature",    "{value:7g})\n")])

    # Pyrometheus initialization
    from mirgecom.mechanisms import get_mechanism_cti
    mech_cti = get_mechanism_cti("uiuc")
    sol = cantera.Solution(phase_id="gas", source=mech_cti)
    from mirgecom.thermochemistry import make_pyrometheus_mechanism_class
    pyrometheus_mechanism = make_pyrometheus_mechanism_class(sol)(actx.np)

    nspecies = pyrometheus_mechanism.num_species
    eos = PyrometheusMixture(pyrometheus_mechanism)
    from mirgecom.gas_model import GasModel, make_fluid_state
    gas_model = GasModel(eos=eos)
    from pytools.obj_array import make_obj_array

    y0s = np.zeros(shape=(nspecies,))
    for i in range(nspecies-1):
        y0s[i] = 1.0 / (10.0 ** (i + 1))
    spec_sum = sum([y0s[i] for i in range(nspecies-1)])
    y0s[nspecies-1] = 1.0 - spec_sum

    # Mixture defaults to STP (p, T) = (1atm, 300K)
    velocity = np.zeros(shape=(dim,)) + 1.0
    initializer = MixtureInitializer(dim=dim, nspecies=nspecies,
                                     massfractions=y0s, velocity=velocity)

    def boundary_solution(discr, btag, gas_model, state_minus, **kwargs):
        actx = state_minus.array_context
        bnd_discr = discr.discr_from_dd(btag)
        nodes = thaw(bnd_discr.nodes(), actx)
        return make_fluid_state(initializer(x_vec=nodes, eos=gas_model.eos,
                                            **kwargs), gas_model,
                                temperature_seed=state_minus.temperature)

    boundaries = {
        BTAG_ALL: PrescribedFluidBoundary(boundary_state_func=boundary_solution)
    }

    if rst_filename:
        current_t = restart_data["t"]
        current_step = restart_data["step"]
        current_cv = restart_data["cv"]
        tseed = restart_data["temperature_seed"]
        if logmgr:
            from mirgecom.logging_quantities import logmgr_set_time
            logmgr_set_time(logmgr, current_step, current_t)
    else:
        # Set the current state from time 0
        current_cv = initializer(x_vec=nodes, eos=eos)
        tseed = 300.0

    current_state = make_fluid_state(current_cv, gas_model, temperature_seed=tseed)

    visualizer = make_visualizer(discr)
    initname = initializer.__class__.__name__
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim, order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt, t_final=t_final, nstatus=nstatus,
                                     nviz=nviz, cfl=current_cfl,
                                     constant_cfl=constant_cfl, initname=initname,
                                     eosname=eosname, casename=casename)
    if rank == 0:
        logger.info(init_message)

    def my_write_status(component_errors, dv=None):
        from mirgecom.simutil import allsync
        status_msg = (
            "------- errors="
            + ", ".join("%.3g" % en for en in component_errors))
        if ((dv is not None) and (not log_dependent)):
            temp = dv.temperature
            press = dv.pressure

            from grudge.op import nodal_min_loc, nodal_max_loc
            tmin = allsync(actx.to_numpy(nodal_min_loc(discr, "vol", temp)),
                           comm=comm, op=MPI.MIN)
            tmax = allsync(actx.to_numpy(nodal_max_loc(discr, "vol", temp)),
                           comm=comm, op=MPI.MAX)
            pmin = allsync(actx.to_numpy(nodal_min_loc(discr, "vol", press)),
                           comm=comm, op=MPI.MIN)
            pmax = allsync(actx.to_numpy(nodal_max_loc(discr, "vol", press)),
                           comm=comm, op=MPI.MAX)
            dv_status_msg = f"\nP({pmin}, {pmax}), T({tmin}, {tmax})"
            status_msg = status_msg + dv_status_msg

        if rank == 0:
            logger.info(status_msg)
        if rank == 0:
            logger.info(status_msg)

    def my_write_viz(step, t, state, dv, exact=None, resid=None):
        if exact is None:
            exact = initializer(x_vec=nodes, eos=eos, time=t)
        if resid is None:
            resid = state - exact
        viz_fields = [("cv", state), ("dv", dv)]
        from mirgecom.simutil import write_visfile
        write_visfile(discr, viz_fields, visualizer, vizname=casename,
                      step=step, t=t, overwrite=True, vis_timer=vis_timer)

    def my_write_restart(step, t, state, tseed):
        rst_fname = rst_pattern.format(cname=casename, step=step, rank=rank)
        if rst_fname != rst_filename:
            rst_data = {
                "local_mesh": local_mesh,
                "cv": state,
                "temperature_seed": tseed,
                "t": t,
                "step": step,
                "order": order,
                "global_nelements": global_nelements,
                "num_parts": nparts
            }
            from mirgecom.restart import write_restart_file
            write_restart_file(actx, rst_data, rst_fname, comm)

    def my_health_check(dv, component_errors):
        health_error = False
        from mirgecom.simutil import check_naninf_local, check_range_local
        if check_naninf_local(discr, "vol", dv.pressure) \
           or check_range_local(discr, "vol", dv.pressure, 1e5, 1.1e5):
            health_error = True
            logger.info(f"{rank=}: Invalid pressure data found.")

        exittol = .09
        if max(component_errors) > exittol:
            health_error = True
            if rank == 0:
                logger.info("Solution diverged from exact soln.")

        return health_error

    def my_pre_step(step, t, dt, state):
        cv, tseed = state
        fluid_state = make_fluid_state(cv, gas_model, temperature_seed=tseed)
        dv = fluid_state.dv

        try:
            exact = None
            component_errors = None

            if logmgr:
                logmgr.tick_before()

            from mirgecom.simutil import check_step
            do_viz = check_step(step=step, interval=nviz)
            do_restart = check_step(step=step, interval=nrestart)
            do_health = check_step(step=step, interval=nhealth)
            do_status = check_step(step=step, interval=nstatus)

            if do_health:
                exact = initializer(x_vec=nodes, eos=eos, time=t)
                from mirgecom.simutil import compare_fluid_solutions
                component_errors = compare_fluid_solutions(discr, cv, exact)
                health_errors = global_reduce(
                    my_health_check(dv, component_errors), op="lor")
                if health_errors:
                    if rank == 0:
                        logger.info("Fluid solution failed health check.")
                    raise MyRuntimeError("Failed simulation health check.")

            if do_restart:
                my_write_restart(step=step, t=t, state=cv, tseed=tseed)

            if do_viz:
                if exact is None:
                    exact = initializer(x_vec=nodes, eos=eos, time=t)
                resid = state - exact
                my_write_viz(step=step, t=t, state=cv, dv=dv, exact=exact,
                             resid=resid)

            if do_status:
                if component_errors is None:
                    if exact is None:
                        exact = initializer(x_vec=nodes, eos=eos, time=t)
                    from mirgecom.simutil import compare_fluid_solutions
                    component_errors = compare_fluid_solutions(discr, cv, exact)
                my_write_status(component_errors, dv=dv)

        except MyRuntimeError:
            if rank == 0:
                logger.info("Errors detected; attempting graceful exit.")
            my_write_viz(step=step, t=t, state=cv, dv=dv)
            my_write_restart(step=step, t=t, state=cv, tseed=tseed)
            raise

        dt = get_sim_timestep(discr, fluid_state, t, dt, current_cfl, t_final,
                              constant_cfl)
        return state, dt

    def my_post_step(step, t, dt, state):
        cv, tseed = state
        fluid_state = make_fluid_state(cv, gas_model, temperature_seed=tseed)
        tseed = fluid_state.temperature
        # Logmgr needs to know about EOS, dt, dim?
        # imo this is a design/scope flaw
        if logmgr:
            set_dt(logmgr, dt)
            set_sim_state(logmgr, dim, cv, eos)
            logmgr.tick_after()
        return make_obj_array([fluid_state.cv, tseed]), dt

    def my_rhs(t, state):
        cv, tseed = state
        fluid_state = make_fluid_state(cv, gas_model, temperature_seed=tseed)
        return make_obj_array(
            [euler_operator(discr, state=fluid_state, time=t,
                            boundaries=boundaries, gas_model=gas_model),
             0*tseed])

    current_dt = get_sim_timestep(discr, current_state, current_t, current_dt,
                                  current_cfl, t_final, constant_cfl)

    current_step, current_t, advanced_state = \
        advance_state(rhs=my_rhs, timestepper=timestepper,
                      pre_step_callback=my_pre_step,
                      post_step_callback=my_post_step, dt=current_dt,
                      state=make_obj_array([current_state.cv,
                                            current_state.temperature]),
                      t=current_t, t_final=t_final, eos=eos, dim=dim)

    # Dump the final data
    if rank == 0:
        logger.info("Checkpointing final state ...")

    current_cv, tseed = advanced_state
    current_state = make_fluid_state(current_cv, gas_model, temperature_seed=tseed)
    final_dv = current_state.dv
    final_exact = initializer(x_vec=nodes, eos=eos, time=current_t)
    final_resid = current_state.cv - final_exact
    my_write_viz(step=current_step, t=current_t, state=current_cv, dv=final_dv,
                 exact=final_exact, resid=final_resid)
    my_write_restart(step=current_step, t=current_t, state=current_state.cv,
                     tseed=tseed)

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())

    finish_tol = 1e-16
    assert np.abs(current_t - t_final) < finish_tol
def main(ctx_factory=cl.create_some_context,
         use_logmgr=True,
         use_leap=False,
         use_profiling=False,
         casename=None,
         rst_filename=None,
         actx_class=PyOpenCLArrayContext):
    """Drive example."""
    cl_ctx = ctx_factory()

    if casename is None:
        casename = "mirgecom"

    from mpi4py import MPI
    comm = MPI.COMM_WORLD
    rank = comm.Get_rank()
    nproc = comm.Get_size()

    logmgr = initialize_logmgr(use_logmgr,
                               filename=f"{casename}.sqlite",
                               mode="wu",
                               mpi_comm=comm)

    if use_profiling:
        queue = cl.CommandQueue(
            cl_ctx, properties=cl.command_queue_properties.PROFILING_ENABLE)
    else:
        queue = cl.CommandQueue(cl_ctx)

    actx = actx_class(queue,
                      allocator=cl_tools.MemoryPool(
                          cl_tools.ImmediateAllocator(queue)))

    # Some discretization parameters
    dim = 2
    nel_1d = 8
    order = 1

    # {{{ Time stepping control

    # This example runs only 3 steps by default (to keep CI ~short)
    # With the mixture defined below, equilibrium is achieved at ~40ms
    # To run to equlibrium, set t_final >= 40ms.

    # Time stepper selection
    if use_leap:
        from leap.rk import RK4MethodBuilder
        timestepper = RK4MethodBuilder("state")
    else:
        timestepper = rk4_step

    # Time loop control parameters
    current_step = 0
    t_final = 1e-8
    current_cfl = 1.0
    current_dt = 1e-9
    current_t = 0
    constant_cfl = False

    # i.o frequencies
    nstatus = 1
    nviz = 5
    nhealth = 1
    nrestart = 5

    # }}}  Time stepping control

    debug = False

    rst_path = "restart_data/"
    rst_pattern = (rst_path + "{cname}-{step:04d}-{rank:04d}.pkl")
    if rst_filename:  # read the grid from restart data
        rst_filename = f"{rst_filename}-{rank:04d}.pkl"

        from mirgecom.restart import read_restart_data
        restart_data = read_restart_data(actx, rst_filename)
        local_mesh = restart_data["local_mesh"]
        local_nelements = local_mesh.nelements
        global_nelements = restart_data["global_nelements"]
        assert restart_data["num_parts"] == nproc
        rst_time = restart_data["t"]
        rst_step = restart_data["step"]
        rst_order = restart_data["order"]
    else:  # generate the grid from scratch
        from meshmode.mesh.generation import generate_regular_rect_mesh
        box_ll = -0.005
        box_ur = 0.005
        generate_mesh = partial(generate_regular_rect_mesh,
                                a=(box_ll, ) * dim,
                                b=(box_ur, ) * dim,
                                nelements_per_axis=(nel_1d, ) * dim)
        local_mesh, global_nelements = generate_and_distribute_mesh(
            comm, generate_mesh)
        local_nelements = local_mesh.nelements

    discr = EagerDGDiscretization(actx,
                                  local_mesh,
                                  order=order,
                                  mpi_communicator=comm)
    nodes = thaw(actx, discr.nodes())

    vis_timer = None

    if logmgr:
        logmgr_add_device_name(logmgr, queue)
        logmgr_add_device_memory_usage(logmgr, queue)
        logmgr_add_many_discretization_quantities(logmgr, discr, dim,
                                                  extract_vars_for_logging,
                                                  units_for_logging)

        vis_timer = IntervalTimer("t_vis", "Time spent visualizing")
        logmgr.add_quantity(vis_timer)

        logmgr.add_watches([
            ("step.max", "step = {value}, "),
            ("t_sim.max", "sim time: {value:1.6e} s\n"),
            ("min_pressure", "------- P (min, max) (Pa) = ({value:1.9e}, "),
            ("max_pressure", "{value:1.9e})\n"),
            ("min_temperature", "------- T (min, max) (K)  = ({value:7g}, "),
            ("max_temperature", "{value:7g})\n"),
            ("t_step.max", "------- step walltime: {value:6g} s, "),
            ("t_log.max", "log walltime: {value:6g} s")
        ])

    # {{{  Set up initial state using Cantera

    # Use Cantera for initialization
    # -- Pick up a CTI for the thermochemistry config
    # --- Note: Users may add their own CTI file by dropping it into
    # ---       mirgecom/mechanisms alongside the other CTI files.
    from mirgecom.mechanisms import get_mechanism_cti
    mech_cti = get_mechanism_cti("uiuc")

    cantera_soln = cantera.Solution(phase_id="gas", source=mech_cti)
    nspecies = cantera_soln.n_species

    # Initial temperature, pressure, and mixutre mole fractions are needed to
    # set up the initial state in Cantera.
    init_temperature = 1500.0  # Initial temperature hot enough to burn
    # Parameters for calculating the amounts of fuel, oxidizer, and inert species
    equiv_ratio = 1.0
    ox_di_ratio = 0.21
    stoich_ratio = 3.0
    # Grab the array indices for the specific species, ethylene, oxygen, and nitrogen
    i_fu = cantera_soln.species_index("C2H4")
    i_ox = cantera_soln.species_index("O2")
    i_di = cantera_soln.species_index("N2")
    x = np.zeros(nspecies)
    # Set the species mole fractions according to our desired fuel/air mixture
    x[i_fu] = (ox_di_ratio * equiv_ratio) / (stoich_ratio +
                                             ox_di_ratio * equiv_ratio)
    x[i_ox] = stoich_ratio * x[i_fu] / equiv_ratio
    x[i_di] = (1.0 - ox_di_ratio) * x[i_ox] / ox_di_ratio
    # Uncomment next line to make pylint fail when it can't find cantera.one_atm
    one_atm = cantera.one_atm  # pylint: disable=no-member
    # one_atm = 101325.0

    # Let the user know about how Cantera is being initilized
    print(f"Input state (T,P,X) = ({init_temperature}, {one_atm}, {x}")
    # Set Cantera internal gas temperature, pressure, and mole fractios
    cantera_soln.TPX = init_temperature, one_atm, x
    # Pull temperature, total density, mass fractions, and pressure from Cantera
    # We need total density, and mass fractions to initialize the fluid/gas state.
    can_t, can_rho, can_y = cantera_soln.TDY
    can_p = cantera_soln.P
    # *can_t*, *can_p* should not differ (significantly) from user's initial data,
    # but we want to ensure that we use exactly the same starting point as Cantera,
    # so we use Cantera's version of these data.

    # }}}

    # {{{ Create Pyrometheus thermochemistry object & EOS

    # Create a Pyrometheus EOS with the Cantera soln. Pyrometheus uses Cantera and
    # generates a set of methods to calculate chemothermomechanical properties and
    # states for this particular mechanism.
    pyrometheus_mechanism = pyro.get_thermochem_class(cantera_soln)(actx.np)
    eos = PyrometheusMixture(pyrometheus_mechanism,
                             temperature_guess=init_temperature)

    # }}}

    # {{{ MIRGE-Com state initialization

    # Initialize the fluid/gas state with Cantera-consistent data:
    # (density, pressure, temperature, mass_fractions)
    print(f"Cantera state (rho,T,P,Y) = ({can_rho}, {can_t}, {can_p}, {can_y}")
    velocity = np.zeros(shape=(dim, ))
    initializer = MixtureInitializer(dim=dim,
                                     nspecies=nspecies,
                                     pressure=can_p,
                                     temperature=can_t,
                                     massfractions=can_y,
                                     velocity=velocity)

    my_boundary = AdiabaticSlipBoundary()
    boundaries = {BTAG_ALL: my_boundary}

    if rst_filename:
        current_step = rst_step
        current_t = rst_time
        if logmgr:
            from mirgecom.logging_quantities import logmgr_set_time
            logmgr_set_time(logmgr, current_step, current_t)
        if order == rst_order:
            current_state = restart_data["state"]
        else:
            rst_state = restart_data["state"]
            old_discr = EagerDGDiscretization(actx,
                                              local_mesh,
                                              order=rst_order,
                                              mpi_communicator=comm)
            from meshmode.discretization.connection import make_same_mesh_connection
            connection = make_same_mesh_connection(
                actx, discr.discr_from_dd("vol"),
                old_discr.discr_from_dd("vol"))
            current_state = connection(rst_state)
    else:
        # Set the current state from time 0
        current_state = initializer(eos=eos, x_vec=nodes)

    # Inspection at physics debugging time
    if debug:
        print("Initial MIRGE-Com state:")
        print(f"{current_state=}")
        print(f"Initial DV pressure: {eos.pressure(current_state)}")
        print(f"Initial DV temperature: {eos.temperature(current_state)}")

    # }}}

    visualizer = make_visualizer(discr)
    initname = initializer.__class__.__name__
    eosname = eos.__class__.__name__
    init_message = make_init_message(dim=dim,
                                     order=order,
                                     nelements=local_nelements,
                                     global_nelements=global_nelements,
                                     dt=current_dt,
                                     t_final=t_final,
                                     nstatus=nstatus,
                                     nviz=nviz,
                                     cfl=current_cfl,
                                     constant_cfl=constant_cfl,
                                     initname=initname,
                                     eosname=eosname,
                                     casename=casename)

    # Cantera equilibrate calculates the expected end state @ chemical equilibrium
    # i.e. the expected state after all reactions
    cantera_soln.equilibrate("UV")
    eq_temperature, eq_density, eq_mass_fractions = cantera_soln.TDY
    eq_pressure = cantera_soln.P

    # Report the expected final state to the user
    if rank == 0:
        logger.info(init_message)
        logger.info(f"Expected equilibrium state:"
                    f" {eq_pressure=}, {eq_temperature=},"
                    f" {eq_density=}, {eq_mass_fractions=}")

    def my_write_status(dt, cfl):
        status_msg = f"------ {dt=}" if constant_cfl else f"----- {cfl=}"
        if rank == 0:
            logger.info(status_msg)

    def my_write_viz(step,
                     t,
                     dt,
                     state,
                     ts_field=None,
                     dv=None,
                     production_rates=None,
                     cfl=None):
        if dv is None:
            dv = eos.dependent_vars(state)
        if production_rates is None:
            production_rates = eos.get_production_rates(state)
        if ts_field is None:
            ts_field, cfl, dt = my_get_timestep(t=t, dt=dt, state=state)
        viz_fields = [("cv", state), ("dv", dv),
                      ("production_rates", production_rates),
                      ("dt" if constant_cfl else "cfl", ts_field)]
        write_visfile(discr,
                      viz_fields,
                      visualizer,
                      vizname=casename,
                      step=step,
                      t=t,
                      overwrite=True,
                      vis_timer=vis_timer)

    def my_write_restart(step, t, state):
        rst_fname = rst_pattern.format(cname=casename, step=step, rank=rank)
        if rst_fname == rst_filename:
            if rank == 0:
                logger.info("Skipping overwrite of restart file.")
        else:
            rst_data = {
                "local_mesh": local_mesh,
                "state": state,
                "t": t,
                "step": step,
                "order": order,
                "global_nelements": global_nelements,
                "num_parts": nproc
            }
            from mirgecom.restart import write_restart_file
            write_restart_file(actx, rst_data, rst_fname, comm)

    def my_health_check(dv):
        health_error = False
        from mirgecom.simutil import check_naninf_local, check_range_local
        if check_naninf_local(discr, "vol", dv.pressure) \
           or check_range_local(discr, "vol", dv.pressure, 1e5, 2.4e5):
            health_error = True
            logger.info(f"{rank=}: Invalid pressure data found.")

        if check_range_local(discr, "vol", dv.temperature, 1.498e3, 1.52e3):
            health_error = True
            logger.info(f"{rank=}: Invalid temperature data found.")

        return health_error

    def my_get_timestep(t, dt, state):
        #  richer interface to calculate {dt,cfl} returns node-local estimates
        t_remaining = max(0, t_final - t)
        if constant_cfl:
            from mirgecom.inviscid import get_inviscid_timestep
            ts_field = current_cfl * get_inviscid_timestep(
                discr, eos=eos, cv=state)
            from grudge.op import nodal_min
            dt = nodal_min(discr, "vol", ts_field)
            cfl = current_cfl
        else:
            from mirgecom.inviscid import get_inviscid_cfl
            ts_field = get_inviscid_cfl(discr, eos=eos, dt=dt, cv=state)
            from grudge.op import nodal_max
            cfl = nodal_max(discr, "vol", ts_field)

        return ts_field, cfl, min(t_remaining, dt)

    def my_pre_step(step, t, dt, state):
        try:
            dv = None

            if logmgr:
                logmgr.tick_before()

            from mirgecom.simutil import check_step
            do_viz = check_step(step=step, interval=nviz)
            do_restart = check_step(step=step, interval=nrestart)
            do_health = check_step(step=step, interval=nhealth)
            do_status = check_step(step=step, interval=nstatus)

            if do_health:
                dv = eos.dependent_vars(state)
                from mirgecom.simutil import allsync
                health_errors = allsync(my_health_check(dv), comm, op=MPI.LOR)
                if health_errors:
                    if rank == 0:
                        logger.info("Fluid solution failed health check.")
                    raise MyRuntimeError("Failed simulation health check.")

            ts_field, cfl, dt = my_get_timestep(t=t, dt=dt, state=state)

            if do_status:
                my_write_status(dt, cfl)

            if do_restart:
                my_write_restart(step=step, t=t, state=state)

            if do_viz:
                production_rates = eos.get_production_rates(state)
                if dv is None:
                    dv = eos.dependent_vars(state)
                my_write_viz(step=step,
                             t=t,
                             dt=dt,
                             state=state,
                             dv=dv,
                             production_rates=production_rates,
                             ts_field=ts_field,
                             cfl=cfl)

        except MyRuntimeError:
            if rank == 0:
                logger.info("Errors detected; attempting graceful exit.")
            my_write_viz(step=step, t=t, dt=dt, state=state)
            my_write_restart(step=step, t=t, state=state)
            raise

        return state, dt

    def my_post_step(step, t, dt, state):
        # Logmgr needs to know about EOS, dt, dim?
        # imo this is a design/scope flaw
        if logmgr:
            set_dt(logmgr, dt)
            set_sim_state(logmgr, dim, state, eos)
            logmgr.tick_after()
        return state, dt

    def my_rhs(t, state):
        return (euler_operator(
            discr, cv=state, time=t, boundaries=boundaries, eos=eos) +
                eos.get_species_source_terms(state))

    current_dt = get_sim_timestep(discr, current_state, current_t, current_dt,
                                  current_cfl, eos, t_final, constant_cfl)

    current_step, current_t, current_state = \
        advance_state(rhs=my_rhs, timestepper=timestepper,
                      pre_step_callback=my_pre_step,
                      post_step_callback=my_post_step, dt=current_dt,
                      state=current_state, t=current_t, t_final=t_final)

    # Dump the final data
    if rank == 0:
        logger.info("Checkpointing final state ...")

    final_dv = eos.dependent_vars(current_state)
    final_dm = eos.get_production_rates(current_state)
    ts_field, cfl, dt = my_get_timestep(t=current_t,
                                        dt=current_dt,
                                        state=current_state)
    my_write_viz(step=current_step,
                 t=current_t,
                 dt=dt,
                 state=current_state,
                 dv=final_dv,
                 production_rates=final_dm,
                 ts_field=ts_field,
                 cfl=cfl)
    my_write_status(dt=dt, cfl=cfl)
    my_write_restart(step=current_step, t=current_t, state=current_state)

    if logmgr:
        logmgr.close()
    elif use_profiling:
        print(actx.tabulate_profiling_data())

    finish_tol = 1e-16
    assert np.abs(current_t - t_final) < finish_tol