PySDM_examples.Arabas_et_al_2025.make_particulator 

 1import numpy as np
 2
 3from PySDM import Builder, Formulae
 4from PySDM import products as PySDM_products
 5from PySDM.backends import CPU
 6from PySDM.dynamics import Freezing
 7from PySDM.environments import Box
 8from PySDM.initialisation.sampling.spectro_glacial_sampling import (
 9    SpectroGlacialSampling,
10)
11
12A_VALUE_LARGER_THAN_ONE = 44
13
14
15def make_particulator(
16    *,
17    constants,
18    n_sd,
19    dt,
20    initial_temperature,
21    singular,
22    seed,
23    shima_T_fz,
24    ABIFM_spec,
25    droplet_volume,
26    total_particle_number,
27    volume,
28    thaw=False,
29):
30    formulae_ctor_args = {
31        "seed": seed,
32        "constants": constants,
33        "freezing_temperature_spectrum": shima_T_fz,
34        "heterogeneous_ice_nucleation_rate": "ABIFM",
35        "particle_shape_and_density": "MixedPhaseSpheres",
36    }
37    formulae = Formulae(**formulae_ctor_args)
38    backend = CPU(formulae, override_jit_flags={"parallel": False})
39
40    attributes = {
41        "signed water mass": np.ones(n_sd) * droplet_volume * formulae.constants.rho_w
42    }
43
44    sampling = SpectroGlacialSampling(
45        freezing_temperature_spectrum=formulae.freezing_temperature_spectrum,
46        insoluble_surface_spectrum=ABIFM_spec,
47    )
48    if singular:
49        (
50            attributes["freezing temperature"],
51            _,
52            attributes["multiplicity"],
53        ) = sampling.sample(backend=backend, n_sd=n_sd)
54        immersion_freezing_flag = "singular"
55    else:
56        (
57            _,
58            attributes["immersed surface area"],
59            attributes["multiplicity"],
60        ) = sampling.sample(backend=backend, n_sd=n_sd)
61        immersion_freezing_flag = "time-dependent"
62    if thaw:
63        thaw_flag = "instantaneous"
64    else:
65        thaw_flag = None
66    attributes["multiplicity"] *= total_particle_number
67
68    builder = Builder(n_sd=n_sd, backend=backend, environment=Box(dt, volume))
69
70    env = builder.particulator.environment
71    env["T"] = initial_temperature
72    env["RH"] = A_VALUE_LARGER_THAN_ONE
73    env["rhod"] = 1.0
74
75    builder.add_dynamic(
76        Freezing(immersion_freezing=immersion_freezing_flag, thaw=thaw_flag)
77    )
78    builder.request_attribute("volume")
79
80    return builder.build(
81        attributes=attributes,
82        products=(
83            PySDM_products.Time(name="t"),
84            PySDM_products.AmbientTemperature(name="T"),
85            PySDM_products.SpecificIceWaterContent(name="qi"),
86        ),
87    )
A_VALUE_LARGER_THAN_ONE = 44
def make_particulator( *, constants, n_sd, dt, initial_temperature, singular, seed, shima_T_fz, ABIFM_spec, droplet_volume, total_particle_number, volume, thaw=False): 
16def make_particulator(
17    *,
18    constants,
19    n_sd,
20    dt,
21    initial_temperature,
22    singular,
23    seed,
24    shima_T_fz,
25    ABIFM_spec,
26    droplet_volume,
27    total_particle_number,
28    volume,
29    thaw=False,
30):
31    formulae_ctor_args = {
32        "seed": seed,
33        "constants": constants,
34        "freezing_temperature_spectrum": shima_T_fz,
35        "heterogeneous_ice_nucleation_rate": "ABIFM",
36        "particle_shape_and_density": "MixedPhaseSpheres",
37    }
38    formulae = Formulae(**formulae_ctor_args)
39    backend = CPU(formulae, override_jit_flags={"parallel": False})
40
41    attributes = {
42        "signed water mass": np.ones(n_sd) * droplet_volume * formulae.constants.rho_w
43    }
44
45    sampling = SpectroGlacialSampling(
46        freezing_temperature_spectrum=formulae.freezing_temperature_spectrum,
47        insoluble_surface_spectrum=ABIFM_spec,
48    )
49    if singular:
50        (
51            attributes["freezing temperature"],
52            _,
53            attributes["multiplicity"],
54        ) = sampling.sample(backend=backend, n_sd=n_sd)
55        immersion_freezing_flag = "singular"
56    else:
57        (
58            _,
59            attributes["immersed surface area"],
60            attributes["multiplicity"],
61        ) = sampling.sample(backend=backend, n_sd=n_sd)
62        immersion_freezing_flag = "time-dependent"
63    if thaw:
64        thaw_flag = "instantaneous"
65    else:
66        thaw_flag = None
67    attributes["multiplicity"] *= total_particle_number
68
69    builder = Builder(n_sd=n_sd, backend=backend, environment=Box(dt, volume))
70
71    env = builder.particulator.environment
72    env["T"] = initial_temperature
73    env["RH"] = A_VALUE_LARGER_THAN_ONE
74    env["rhod"] = 1.0
75
76    builder.add_dynamic(
77        Freezing(immersion_freezing=immersion_freezing_flag, thaw=thaw_flag)
78    )
79    builder.request_attribute("volume")
80
81    return builder.build(
82        attributes=attributes,
83        products=(
84            PySDM_products.Time(name="t"),
85            PySDM_products.AmbientTemperature(name="T"),
86            PySDM_products.SpecificIceWaterContent(name="qi"),
87        ),
88    )