PySDM 2.105__tar.gz → 2.117__tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (961) hide show
  1. {pysdm-2.105 → pysdm-2.117}/.github/workflows/pdoc.yml +4 -6
  2. {pysdm-2.105 → pysdm-2.117}/.github/workflows/readme_snippets.yml +3 -2
  3. {pysdm-2.105 → pysdm-2.117}/.github/workflows/tests.yml +10 -6
  4. {pysdm-2.105 → pysdm-2.117}/.gitignore +3 -0
  5. {pysdm-2.105 → pysdm-2.117}/PKG-INFO +5 -6
  6. pysdm-2.117/PySDM/attributes/ice/freezing_temperature.py +42 -0
  7. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/impl_numba/methods/__init__.py +1 -0
  8. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/impl_numba/methods/condensation_methods.py +24 -15
  9. pysdm-2.117/PySDM/backends/impl_numba/methods/deposition_methods.py +172 -0
  10. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/impl_numba/methods/freezing_methods.py +31 -12
  11. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/impl_numba/test_helpers/scipy_ode_condensation_solver.py +22 -43
  12. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/impl_thrust_rtc/methods/condensation_methods.py +20 -13
  13. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/impl_thrust_rtc/methods/freezing_methods.py +0 -2
  14. {pysdm-2.105 → pysdm-2.117}/PySDM/backends/numba.py +2 -0
  15. {pysdm-2.105 → pysdm-2.117}/PySDM/dynamics/__init__.py +1 -0
  16. {pysdm-2.105 → pysdm-2.117}/PySDM/dynamics/freezing.py +5 -12
  17. pysdm-2.117/PySDM/dynamics/vapour_deposition_on_ice.py +20 -0
  18. {pysdm-2.105 → pysdm-2.117}/PySDM/environments/kinematic_1d.py +1 -1
  19. {pysdm-2.105 → pysdm-2.117}/PySDM/environments/kinematic_2d.py +1 -1
  20. {pysdm-2.105 → pysdm-2.117}/PySDM/environments/parcel.py +1 -1
  21. {pysdm-2.105 → pysdm-2.117}/PySDM/formulae.py +24 -9
  22. {pysdm-2.105 → pysdm-2.117}/PySDM/initialisation/aerosol_composition/dry_aerosol.py +1 -1
  23. {pysdm-2.105 → pysdm-2.117}/PySDM/particulator.py +29 -10
  24. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/__init__.py +6 -2
  25. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/constants.py +1 -0
  26. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/constants_defaults.py +45 -17
  27. pysdm-2.117/PySDM/physics/diffusion_coordinate/__init__.py +6 -0
  28. pysdm-2.117/PySDM/physics/diffusion_coordinate/water_mass.py +25 -0
  29. pysdm-2.117/PySDM/physics/diffusion_coordinate/water_mass_logarithm.py +32 -0
  30. pysdm-2.117/PySDM/physics/diffusion_ice_capacity/__init__.py +5 -0
  31. pysdm-2.117/PySDM/physics/diffusion_ice_capacity/spherical.py +13 -0
  32. pysdm-2.117/PySDM/physics/diffusion_ice_kinetics/__init__.py +6 -0
  33. pysdm-2.117/PySDM/physics/diffusion_ice_kinetics/neglect.py +24 -0
  34. pysdm-2.117/PySDM/physics/diffusion_ice_kinetics/standard.py +41 -0
  35. pysdm-2.117/PySDM/physics/isotope_kinetic_fractionation_factors/__init__.py +7 -0
  36. pysdm-2.117/PySDM/physics/isotope_kinetic_fractionation_factors/craig_gordon.py +17 -0
  37. pysdm-2.117/PySDM/physics/isotope_kinetic_fractionation_factors/jouzel_and_merlivat_1984.py +21 -0
  38. pysdm-2.117/PySDM/physics/latent_heat_sublimation/__init__.py +5 -0
  39. pysdm-2.117/PySDM/physics/latent_heat_sublimation/murphy_koop_2005.py +19 -0
  40. {pysdm-2.105/PySDM/physics/latent_heat → pysdm-2.117/PySDM/physics/latent_heat_vapourisation}/lowe2019.py +3 -1
  41. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/particle_shape_and_density/liquid_spheres.py +10 -0
  42. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/particle_shape_and_density/mixed_phase_spheres.py +17 -0
  43. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/surface_tension/compressed_film_ruehl.py +1 -1
  44. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/trivia.py +12 -0
  45. {pysdm-2.105 → pysdm-2.117}/PySDM/physics/ventilation/pruppacher_rasmussen_1979.py +2 -2
  46. {pysdm-2.105 → pysdm-2.117}/PySDM/products/aqueous_chemistry/acidity.py +1 -1
  47. {pysdm-2.105 → pysdm-2.117}/PySDM/products/freezing/frozen_particle_concentration.py +1 -1
  48. {pysdm-2.105 → pysdm-2.117}/PySDM/products/impl/moment_product.py +1 -1
  49. {pysdm-2.105 → pysdm-2.117}/PySDM/products/size_spectral/cloud_water_content.py +2 -2
  50. {pysdm-2.105 → pysdm-2.117}/PySDM/products/size_spectral/mean_radius.py +7 -3
  51. {pysdm-2.105 → pysdm-2.117}/PySDM/products/size_spectral/water_mixing_ratio.py +9 -7
  52. {pysdm-2.105 → pysdm-2.117}/PySDM.egg-info/PKG-INFO +5 -6
  53. {pysdm-2.105 → pysdm-2.117}/PySDM.egg-info/SOURCES.txt +54 -28
  54. {pysdm-2.105 → pysdm-2.117}/README.md +1 -1
  55. {pysdm-2.105 → pysdm-2.117}/docs/bibliography.json +107 -17
  56. {pysdm-2.105 → pysdm-2.117}/docs/generate_html.py +1 -0
  57. {pysdm-2.105 → pysdm-2.117}/docs/markdown/pysdm_landing.md +7 -5
  58. {pysdm-2.105 → pysdm-2.117}/docs/templates/index.html.jinja2 +4 -0
  59. pysdm-2.117/examples/PySDM_examples/Abade_and_Albuquerque_2024/fig_2.ipynb +3441 -0
  60. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Abade_and_Albuquerque_2024/settings.py +21 -2
  61. pysdm-2.117/examples/PySDM_examples/Abade_and_Albuquerque_2024/simulation.py +94 -0
  62. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Abdul_Razzak_Ghan_2000/fig_4_kinetic_limitations.ipynb +1 -1
  63. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Abdul_Razzak_Ghan_2000/figs1-5.ipynb +1 -1
  64. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Arabas_and_Shima_2017/settings.py +2 -2
  65. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Arabas_and_Shima_2017/simulation.py +1 -1
  66. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/__init__.py +1 -1
  67. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/aida.ipynb +3 -3
  68. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/copula_hello.ipynb +4 -4
  69. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/fig_2.ipynb +6 -6
  70. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/fig_A2.ipynb +4 -4
  71. pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025/figs_10_and_11_and_animations.ipynb +6468 -0
  72. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/figs_3_and_7_and_8.ipynb +6 -6
  73. pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025/figs_5_and_6.ipynb +27707 -0
  74. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/make_particulator.py +1 -1
  75. {pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023 → pysdm-2.117/examples/PySDM_examples/Arabas_et_al_2025}/plots.py +2 -2
  76. pysdm-2.117/examples/PySDM_examples/Bolin_1958/__init__.py +8 -0
  77. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Gedzelman_and_Arnold_1994/fig_2.ipynb +1 -1
  78. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Grabowski_and_Pawlowska_2023/settings.py +1 -1
  79. pysdm-2.117/examples/PySDM_examples/Kinzer_And_Gunn_1951/__init__.py +4 -0
  80. pysdm-2.117/examples/PySDM_examples/Kinzer_And_Gunn_1951/table_1_and_2.py +192 -0
  81. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Lowe_et_al_2019/settings.py +1 -1
  82. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Morrison_and_Grabowski_2007/cumulus.py +1 -1
  83. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Niedermeier_et_al_2014/settings.py +1 -1
  84. pysdm-2.117/examples/PySDM_examples/Pierchala_et_al_2022/fig_4.ipynb +2008 -0
  85. pysdm-2.117/examples/PySDM_examples/Pruppacher_and_Rasmussen_1979/__init__.py +10 -0
  86. pysdm-2.117/examples/PySDM_examples/Pruppacher_and_Rasmussen_1979/fig_1.ipynb +330 -0
  87. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Rozanski_and_Sonntag_1982/__init__.py +1 -0
  88. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Rozanski_and_Sonntag_1982/figs_4_5_6.ipynb +3291 -3353
  89. pysdm-2.117/examples/PySDM_examples/Rozanski_and_Sonntag_1982/multibox.py +96 -0
  90. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Shipway_and_Hill_2012/settings.py +2 -2
  91. pysdm-2.117/examples/PySDM_examples/Stewart_1975/__init__.py +7 -0
  92. pysdm-2.117/examples/PySDM_examples/Stewart_1975/fig_1.ipynb +304 -0
  93. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Szumowski_et_al_1998/gui_settings.py +1 -1
  94. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Szumowski_et_al_1998/mpdata_2d.py +2 -2
  95. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Yang_et_al_2018/settings.py +1 -1
  96. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/Yang_et_al_2018/simulation.py +1 -1
  97. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/deJong_Azimi/settings1D.py +1 -1
  98. {pysdm-2.105 → pysdm-2.117}/examples/PySDM_examples/deJong_Mackay_et_al_2023/settings1D.py +1 -1
  99. {pysdm-2.105 → pysdm-2.117}/examples/docs/pysdm_examples_landing.md +2 -2
  100. {pysdm-2.105 → pysdm-2.117}/examples/pyproject.toml +1 -1
  101. {pysdm-2.105 → pysdm-2.117}/examples/setup.py +1 -1
  102. pysdm-2.117/pyproject.toml +46 -0
  103. pysdm-2.117/setup.py +78 -0
  104. {pysdm-2.105 → pysdm-2.117}/tests/examples_tests/conftest.py +8 -3
  105. {pysdm-2.105 → pysdm-2.117}/tests/smoke_tests/box/alpert_and_knopf_2016/test_frozen_fraction.py +1 -1
  106. {pysdm-2.105 → pysdm-2.117}/tests/smoke_tests/box/srivastava_1982/test_eq_13.py +3 -3
  107. {pysdm-2.105 → pysdm-2.117}/tests/smoke_tests/kinematic_2d/arabas_et_al_2015/test_freezing.py +1 -1
  108. pysdm-2.117/tests/smoke_tests/no_env/kinzer_and_gunn_1951/test_table_1_and_2.py +22 -0
  109. pysdm-2.117/tests/smoke_tests/no_env/pruppacher_and_rasmussen_1979/test_fig_1.py +51 -0
  110. pysdm-2.117/tests/smoke_tests/no_env/stewart_1975/test_fig_1.py +55 -0
  111. {pysdm-2.105 → pysdm-2.117}/tests/smoke_tests/parcel_b/arabas_and_shima_2017/test_conservation.py +2 -2
  112. {pysdm-2.105 → pysdm-2.117}/tests/smoke_tests/parcel_b/arabas_and_shima_2017/test_displacement.py +7 -1
  113. pysdm-2.117/tests/smoke_tests/parcel_c/abade_and_albuquerque_2024/test_fig_2.py +76 -0
  114. {pysdm-2.105 → pysdm-2.117}/tests/smoke_tests/parcel_d/rozanski_and_sonntag_1982/test_figs_4_5_6.py +6 -0
  115. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_physics_methods.py +1 -1
  116. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_efficiencies.py +1 -1
  117. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/condensation/test_parcel_sanity_checks.py +6 -2
  118. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_immersion_freezing.py +80 -4
  119. pysdm-2.117/tests/unit_tests/dynamics/test_vapour_deposition_on_ice.py +234 -0
  120. pysdm-2.117/tests/unit_tests/physics/__init__.py +0 -0
  121. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_drop_growth.py +4 -3
  122. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_formulae.py +4 -4
  123. pysdm-2.117/tests/unit_tests/physics/test_isotope_kinetic_fractionation_factors.py +114 -0
  124. pysdm-2.117/tests/unit_tests/physics/test_latent_heat.py +70 -0
  125. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_trivia.py +24 -0
  126. pysdm-2.117/tests/unit_tests/products/__init__.py +0 -0
  127. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_mixed_phase_moments.py +8 -6
  128. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_particle_size_spectrum.py +1 -1
  129. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/test_formulae.py +44 -3
  130. {pysdm-2.105 → pysdm-2.117}/tutorials/README.md +15 -1
  131. pysdm-2.117/tutorials/wikipedia/sdm.ipynb +445 -0
  132. pysdm-2.105/.appveyor.yml +0 -42
  133. pysdm-2.105/.github/workflows/projects.yml +0 -19
  134. pysdm-2.105/PySDM/attributes/ice/freezing_temperature.py +0 -12
  135. pysdm-2.105/PySDM/physics/condensation_coordinate/__init__.py +0 -6
  136. pysdm-2.105/PySDM/physics/condensation_coordinate/volume.py +0 -22
  137. pysdm-2.105/PySDM/physics/condensation_coordinate/volume_logarithm.py +0 -27
  138. pysdm-2.105/examples/PySDM_examples/Abade_and_Albuquerque_2024/fig_2.ipynb +0 -1730
  139. pysdm-2.105/examples/PySDM_examples/Abade_and_Albuquerque_2024/simulation.py +0 -48
  140. pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023/figs_10_and_11_and_animations.ipynb +0 -11251
  141. pysdm-2.105/examples/PySDM_examples/Arabas_et_al_2023/figs_5_and_6.ipynb +0 -27314
  142. pysdm-2.105/examples/PySDM_examples/Pierchala_et_al_2022/fig_4.ipynb +0 -209
  143. pysdm-2.105/pyproject.toml +0 -9
  144. pysdm-2.105/setup.py +0 -128
  145. pysdm-2.105/tests/smoke_tests/parcel_c/abade_and_albuquerque_2024/test_fig_2.py +0 -57
  146. pysdm-2.105/tests/unit_tests/physics/test_latent_heat.py +0 -36
  147. {pysdm-2.105 → pysdm-2.117}/.binder/apt.txt +0 -0
  148. {pysdm-2.105 → pysdm-2.117}/.binder/postBuild +0 -0
  149. {pysdm-2.105 → pysdm-2.117}/.binder/requirements.txt +0 -0
  150. {pysdm-2.105 → pysdm-2.117}/.codecov.yml +0 -0
  151. {pysdm-2.105 → pysdm-2.117}/.github/dependabot.yml +0 -0
  152. {pysdm-2.105 → pysdm-2.117}/.github/workflows/cancel.yml +0 -0
  153. {pysdm-2.105 → pysdm-2.117}/.github/workflows/joss.yml +0 -0
  154. {pysdm-2.105 → pysdm-2.117}/.github/workflows/joss_paper.yml +0 -0
  155. {pysdm-2.105 → pysdm-2.117}/.github/workflows/pypi.yml +0 -0
  156. {pysdm-2.105 → pysdm-2.117}/.github/workflows/stale.yml +0 -0
  157. {pysdm-2.105 → pysdm-2.117}/.gitmodules +0 -0
  158. {pysdm-2.105 → pysdm-2.117}/.pre-commit-config.yaml +0 -0
  159. {pysdm-2.105 → pysdm-2.117}/.zenodo.json +0 -0
  160. {pysdm-2.105 → pysdm-2.117}/LICENSE +0 -0
  161. {pysdm-2.105 → pysdm-2.117}/PySDM/__init__.py +0 -0
  162. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/__init__.py +0 -0
  163. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/chemistry/__init__.py +0 -0
  164. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/chemistry/acidity.py +0 -0
  165. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/chemistry/concentration.py +0 -0
  166. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/chemistry/hydrogen_ion_concentration.py +0 -0
  167. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/ice/__init__.py +0 -0
  168. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/ice/cooling_rate.py +0 -0
  169. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/ice/immersed_surface_area.py +0 -0
  170. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/__init__.py +0 -0
  171. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/attribute.py +0 -0
  172. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/attribute_registry.py +0 -0
  173. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/base_attribute.py +0 -0
  174. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/cell_attribute.py +0 -0
  175. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/derived_attribute.py +0 -0
  176. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/dummy_attribute.py +0 -0
  177. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/extensive_attribute.py +0 -0
  178. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/intensive_attribute.py +0 -0
  179. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/maximum_attribute.py +0 -0
  180. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/impl/mole_amount.py +0 -0
  181. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/isotopes/__init__.py +0 -0
  182. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/isotopes/delta.py +0 -0
  183. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/isotopes/moles.py +0 -0
  184. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/numerics/__init__.py +0 -0
  185. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/numerics/cell_id.py +0 -0
  186. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/numerics/cell_origin.py +0 -0
  187. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/numerics/position_in_cell.py +0 -0
  188. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/__init__.py +0 -0
  189. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/area.py +0 -0
  190. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/critical_supersaturation.py +0 -0
  191. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/critical_volume.py +0 -0
  192. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/dry_radius.py +0 -0
  193. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/dry_volume.py +0 -0
  194. {pysdm-2.105 → pysdm-2.117}/PySDM/attributes/physics/equilibrium_supersaturation.py +0 -0
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  863. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/storage/test_basic_ops.py +0 -0
  864. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/storage/test_index.py +0 -0
  865. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/storage/test_setitem.py +0 -0
  866. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_collisions_methods.py +0 -0
  867. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_ctor_defaults.py +0 -0
  868. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_fake_thrust.py +0 -0
  869. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_isotope_methods.py +0 -0
  870. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_moments_methods.py +0 -0
  871. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_oxidation.py +0 -0
  872. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_pair_methods.py +0 -0
  873. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_seeding_methods.py +0 -0
  874. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/backends/test_toms748.py +0 -0
  875. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/conftest.py +0 -0
  876. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dummy_environment.py +0 -0
  877. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dummy_particulator.py +0 -0
  878. {pysdm-2.105/tests/unit_tests/dynamics/displacement → pysdm-2.117/tests/unit_tests/dynamics}/__init__.py +0 -0
  879. {pysdm-2.105/tests/unit_tests/environments → pysdm-2.117/tests/unit_tests/dynamics/collisions}/__init__.py +0 -0
  880. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/conftest.py +0 -0
  881. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_croupiers.py +0 -0
  882. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_defaults.py +0 -0
  883. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_fragmentations.py +0 -0
  884. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_kernels.py +0 -0
  885. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_sdm_breakup.py +0 -0
  886. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_sdm_multi_cell.py +0 -0
  887. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/collisions/test_sdm_single_cell.py +0 -0
  888. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/condensation/test_diagnostics.py +0 -0
  889. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/condensation/test_ventilation.py +0 -0
  890. {pysdm-2.105/tests/unit_tests/exporters → pysdm-2.117/tests/unit_tests/dynamics/displacement}/__init__.py +0 -0
  891. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/displacement/displacement_settings.py +0 -0
  892. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/displacement/test_advection.py +0 -0
  893. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/displacement/test_courant_product.py +0 -0
  894. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/displacement/test_sedimentation.py +0 -0
  895. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_eulerian_advection.py +0 -0
  896. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_impl_register_dynamic.py +0 -0
  897. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_isotopic_fractionation.py +0 -0
  898. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_relaxed_velocity.py +0 -0
  899. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_seeding.py +0 -0
  900. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/dynamics/test_terminal_velocity.py +0 -0
  901. {pysdm-2.105/tests/unit_tests/impl → pysdm-2.117/tests/unit_tests/environments}/__init__.py +0 -0
  902. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/environments/test_impl.py +0 -0
  903. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/environments/test_moist.py +0 -0
  904. {pysdm-2.105/tests/unit_tests/initialisation → pysdm-2.117/tests/unit_tests/exporters}/__init__.py +0 -0
  905. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/exporters/test_vtk_exporter.py +0 -0
  906. {pysdm-2.105/tests/unit_tests/physics → pysdm-2.117/tests/unit_tests/impl}/__init__.py +0 -0
  907. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/impl/test_camel_case.py +0 -0
  908. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/impl/test_mesh.py +0 -0
  909. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/impl/test_moments.py +0 -0
  910. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/impl/test_particle_attributes.py +0 -0
  911. {pysdm-2.105/tests/unit_tests/products → pysdm-2.117/tests/unit_tests/initialisation}/__init__.py +0 -0
  912. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_aerosol_init.py +0 -0
  913. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_discretise_multiplicities.py +0 -0
  914. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_equilibrate_wet_radii.py +0 -0
  915. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_init_fall_momenta.py +0 -0
  916. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_spatial_discretisation.py +0 -0
  917. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_spectra_lognormal.py +0 -0
  918. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_spectral_discretisation.py +0 -0
  919. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/initialisation/test_spectro_glacial_discretisation.py +0 -0
  920. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_accommodation_coefficients.py +0 -0
  921. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_air_dynamic_viscosity.py +0 -0
  922. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_bulk_phase_partitioning.py +0 -0
  923. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_constants.py +0 -0
  924. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_dimensional_analysis.py +0 -0
  925. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_fake_unit_registry.py +0 -0
  926. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_fragmentation_functions.py +0 -0
  927. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_freezing_temperature_spectra.py +0 -0
  928. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_hydrostatics_var_g.py +0 -0
  929. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_hygroscopicity_fierce_diagrams.py +0 -0
  930. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_isotope_diffusivity_ratios.py +0 -0
  931. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_isotope_equilibrium_fractionation_factors.py +0 -0
  932. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_isotope_meteoric_water_line.py +0 -0
  933. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_isotope_ratio_evolution.py +0 -0
  934. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_isotope_relaxation_timescale.py +0 -0
  935. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_isotope_temperature_inference.py +0 -0
  936. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_optical.py +0 -0
  937. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_particle_shape_and_density.py +0 -0
  938. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_saturation_vapour_pressure.py +0 -0
  939. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_spectra.py +0 -0
  940. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_spectra_top_hat.py +0 -0
  941. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_surface_tension.py +0 -0
  942. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_thermal_conductivity.py +0 -0
  943. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/physics/test_ventilation_coefficient.py +0 -0
  944. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_ambient_relative_humidity.py +0 -0
  945. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_arbitrary_moment.py +0 -0
  946. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_averaged_terminal_velocity.py +0 -0
  947. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_collision_rates.py +0 -0
  948. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_concentration_product.py +0 -0
  949. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_cooling_rate.py +0 -0
  950. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_effective_radii.py +0 -0
  951. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_impl.py +0 -0
  952. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_parcel_liquid_water_path.py +0 -0
  953. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_particle_size_product.py +0 -0
  954. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/products/test_surface_precipitation.py +0 -0
  955. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/test_builder.py +0 -0
  956. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/test_imports.py +0 -0
  957. {pysdm-2.105 → pysdm-2.117}/tests/unit_tests/test_particulator.py +0 -0
  958. {pysdm-2.105 → pysdm-2.117}/tutorials/collisions/collection_droplet.svg +0 -0
  959. {pysdm-2.105 → pysdm-2.117}/tutorials/collisions/collisions_playground.ipynb +0 -0
  960. {pysdm-2.105 → pysdm-2.117}/tutorials/condensation/condensation_playground.ipynb +0 -0
  961. {pysdm-2.105 → pysdm-2.117}/tutorials/condensation/kohler_curve.svg +0 -0
@@ -26,13 +26,11 @@ jobs:
26
26
  - uses: actions/setup-python@v5.0.0
27
27
  with:
28
28
  python-version: "3.12"
29
- - run: |
30
- pip install pdoc nbformat gitpython
31
- pip install -e .
32
- pip install -e examples
29
+ - run: pip install pdoc nbformat gitpython
30
+ - run: pip install -e .
31
+ - run: pip install -e examples
32
+ - run: python -We docs/generate_html.py . .
33
33
 
34
- python -We docs/generate_html.py . .
35
-
36
34
  - if: ${{ github.ref == 'refs/heads/main' && matrix.platform == 'ubuntu-latest' }}
37
35
  uses: JamesIves/github-pages-deploy-action@4.1.1
38
36
  with:
@@ -43,7 +43,7 @@ jobs:
43
43
  readme.png
44
44
 
45
45
  julia:
46
- runs-on: ubuntu-latest
46
+ runs-on: macos-latest
47
47
  steps:
48
48
  - uses: actions/checkout@v4.1.6
49
49
  - uses: actions/setup-python@v5.0.0
@@ -52,8 +52,9 @@ jobs:
52
52
  - run: pip install -e .
53
53
  - run: pip install pytest-codeblocks pytest
54
54
  - run: python -c "import pytest_codeblocks; code=pytest_codeblocks.extract_from_file('docs/markdown/pysdm_landing.md'); f=open('readme.jl', 'w'); f.writelines(block.code for block in code if block.syntax=='Julia'); f.close()"
55
- - uses: julia-actions/setup-julia@v1.9.6
55
+ - uses: julia-actions/setup-julia@v2
56
56
  - run: cat -n readme.jl
57
+ - run: echo PYTHON=`which python` >> $GITHUB_ENV
57
58
  - run: julia readme.jl
58
59
  - run: sed -i -e 's/CPU/GPU/g' readme.jl
59
60
  - run: julia readme.jl
@@ -128,7 +128,7 @@ jobs:
128
128
  test-suite: "unit_tests/!(dynamics)"
129
129
  fail-fast: false
130
130
  runs-on: ${{ matrix.platform }}
131
- timeout-minutes: ${{ startsWith(matrix.platform, 'windows-') && 35 || 30 }}
131
+ timeout-minutes: ${{ startsWith(matrix.platform, 'windows-') && 40 || 30 }}
132
132
  steps:
133
133
  - uses: actions/checkout@v4.1.6
134
134
  with:
@@ -213,7 +213,7 @@ jobs:
213
213
  matrix:
214
214
  platform: [ubuntu-24.04, macos-13, windows-latest]
215
215
  python-version: ["3.9", "3.12"]
216
- test-suite: [ "chemistry_freezing_extraterrestrial", "isotopes", "condensation_a", "condensation_b", "condensation_c", "coagulation", "breakup", "multi-process_a", "multi-process_b", "multi-process_c", "multi-process_d", "multi-process_e"]
216
+ test-suite: [ "chemistry_extraterrestrial", "freezing", "isotopes", "condensation_a", "condensation_b", "condensation_c", "coagulation", "breakup", "multi-process_a", "multi-process_b", "multi-process_c", "multi-process_d", "multi-process_e"]
217
217
  fail-fast: false
218
218
  runs-on: ${{ matrix.platform }}
219
219
  timeout-minutes: 35
@@ -267,8 +267,12 @@ jobs:
267
267
  pvpython --version
268
268
  pvpython -c "from paraview import simple"
269
269
 
270
- - env:
271
- GITHUB_TOKEN: ${{ secrets.GITHUB_TOKEN }}
272
- run: |
270
+ - run: |
273
271
  python -m pytest --durations=10 -v -p no:unraisableexception -We tests/examples_tests/test_tests_completeness.py
274
- python -m pytest --durations=10 -v -p no:unraisableexception -We tests/examples_tests/test_run* --suite ${{ matrix.test-suite }}
272
+
273
+ # TODO #1207
274
+ - if: startsWith(matrix.platform, 'macos-13')
275
+ run: python -m pytest --durations=10 -v -p no:unraisableexception -We tests/examples_tests/test_run* -k "not Rozanski_and_Sonntag_1982" --suite ${{ matrix.test-suite }}
276
+
277
+ - if: ( ! startsWith(matrix.platform, 'macos-13') )
278
+ run: python -m pytest --durations=10 -v -p no:unraisableexception -We tests/examples_tests/test_run* --suite ${{ matrix.test-suite }}
@@ -4,6 +4,9 @@ PySDM_examples/utils/temporary_files/*
4
4
  *.pkl
5
5
  *.vtu
6
6
  *.vts
7
+ *.svg
8
+ *.gif
9
+ *.ipynb.badges.md
7
10
 
8
11
  # Byte-compiled / optimized / DLL files
9
12
  __pycache__/
@@ -1,10 +1,8 @@
1
1
  Metadata-Version: 2.1
2
2
  Name: PySDM
3
- Version: 2.105
3
+ Version: 2.117
4
4
  Summary: Pythonic particle-based (super-droplet) warm-rain/aqueous-chemistry cloud microphysics package with box, parcel & 1D/2D prescribed-flow examples in Python, Julia and Matlab
5
- Home-page: https://github.com/open-atmos/PySDM
6
- Author: https://github.com/open-atmos/PySDM/graphs/contributors
7
- Author-email: sylwester.arabas@agh.edu.pl
5
+ Author-email: "https://github.com/open-atmos/PySDM/graphs/contributors" <sylwester.arabas@agh.edu.pl>
8
6
  License: GPL-3.0
9
7
  Project-URL: Tracker, https://github.com/open-atmos/PySDM/issues
10
8
  Project-URL: Documentation, https://open-atmos.github.io/PySDM
@@ -20,6 +18,7 @@ Classifier: Topic :: Scientific/Engineering :: Atmospheric Science
20
18
  Classifier: Topic :: Scientific/Engineering :: Mathematics
21
19
  Classifier: Topic :: Scientific/Engineering :: Physics
22
20
  Classifier: Topic :: Software Development :: Libraries
21
+ Requires-Python: >=3.8
23
22
  Description-Content-Type: text/markdown
24
23
  License-File: LICENSE
25
24
  Requires-Dist: ThrustRTC==0.3.20
@@ -40,7 +39,7 @@ Requires-Dist: pyrcel; extra == "tests"
40
39
  Requires-Dist: jupyter-core<5.0.0; extra == "tests"
41
40
  Requires-Dist: ipywidgets!=8.0.3; extra == "tests"
42
41
 
43
- # <img src="https://raw.githubusercontent.com/open-atmos/PySDM/main/docs/logos/pysdm_logo.png" width=100 height=146 alt="pysdm logo">
42
+ # <img src="https://raw.githubusercontent.com/open-atmos/PySDM/main/docs/logos/pysdm_logo.svg" width=100 height=146 alt="pysdm logo">
44
43
 
45
44
  [![Python 3](https://img.shields.io/static/v1?label=Python&logo=Python&color=3776AB&message=3)](https://www.python.org/)
46
45
  [![LLVM](https://img.shields.io/static/v1?label=LLVM&logo=LLVM&color=gold&message=Numba)](https://numba.pydata.org)
@@ -75,7 +74,7 @@ Currently, the development is focused on atmospheric cloud physics
75
74
  to represent aerosol/cloud/rain microphysics.
76
75
  The package features a Pythonic high-performance implementation of the
77
76
  Super-Droplet Method (SDM) Monte-Carlo algorithm for representing collisional growth
78
- ([Shima et al. 2009](https://rmets.onlinelibrary.wiley.com/doi/abs/10.1002/qj.441)), hence the name.
77
+ ([Shima et al. 2009](https://doi.org/10.1002/qj.441)), hence the name.
79
78
 
80
79
  PySDM documentation is maintained at: [https://open-atmos.github.io/PySDM](https://open-atmos.github.io/PySDM)
81
80
 
@@ -0,0 +1,42 @@
1
+ """
2
+ particle freezing temperature
3
+ """
4
+
5
+ from PySDM.attributes.impl import MaximumAttribute, register_attribute
6
+ from ..impl import DerivedAttribute
7
+
8
+
9
+ @register_attribute()
10
+ class FreezingTemperature(MaximumAttribute):
11
+ """singular variant: assigned at initialisation, modified through collisions only"""
12
+
13
+ def __init__(self, builder):
14
+ super().__init__(builder, name="freezing temperature")
15
+
16
+
17
+ @register_attribute()
18
+ class TemperatureOfLastFreezing(DerivedAttribute):
19
+ """time-dependent variant: assigned upon freezing"""
20
+
21
+ def __init__(self, builder):
22
+ assert "Freezing" in builder.particulator.dynamics
23
+ assert not builder.particulator.dynamics["Freezing"].singular
24
+ self.signed_water_mass = builder.get_attribute("signed water mass")
25
+ self.cell_id = builder.get_attribute("cell id")
26
+ super().__init__(
27
+ builder,
28
+ name="temperature of last freezing",
29
+ dependencies=(self.signed_water_mass, self.cell_id),
30
+ )
31
+ builder.particulator.observers.append(self)
32
+
33
+ def notify(self):
34
+ self.update()
35
+
36
+ def recalculate(self):
37
+ self.particulator.backend.record_freezing_temperatures(
38
+ data=self.data,
39
+ cell_id=self.cell_id.data,
40
+ temperature=self.particulator.environment["T"],
41
+ signed_water_mass=self.signed_water_mass.data,
42
+ )
@@ -13,3 +13,4 @@ from .pair_methods import PairMethods
13
13
  from .physics_methods import PhysicsMethods
14
14
  from .terminal_velocity_methods import TerminalVelocityMethods
15
15
  from .seeding_methods import SeedingMethods
16
+ from .deposition_methods import DepositionMethods
@@ -290,7 +290,7 @@ class CondensationMethods(BackendMethods):
290
290
  rhod, T, water_vapour_mixing_ratio
291
291
  )
292
292
  pv = formulae.state_variable_triplet__pv(p, water_vapour_mixing_ratio)
293
- lv = formulae.latent_heat__lv(T)
293
+ lv = formulae.latent_heat_vapourisation__lv(T)
294
294
  pvs = formulae.saturation_vapour_pressure__pvs_water(T)
295
295
  DTp = formulae.diffusion_thermics__D(T, p)
296
296
  RH = pv / pvs
@@ -390,14 +390,18 @@ class CondensationMethods(BackendMethods):
390
390
  K,
391
391
  ventilation_factor,
392
392
  ):
393
- volume = formulae.condensation_coordinate__volume(x_new)
393
+ if x_new > formulae.diffusion_coordinate__x_max():
394
+ return x_old - x_new
395
+ mass_new = formulae.diffusion_coordinate__mass(x_new)
396
+ volume_new = formulae.particle_shape_and_density__mass_to_volume(mass_new)
397
+ r_new = formulae.trivia__radius(volume_new)
394
398
  RH_eq = formulae.hygroscopicity__RH_eq(
395
- formulae.trivia__radius(volume),
399
+ r_new,
396
400
  temperature,
397
401
  kappa,
398
402
  rd3,
399
403
  formulae.surface_tension__sigma(
400
- temperature, volume, formulae.constants.PI_4_3 * rd3, f_org
404
+ temperature, volume_new, formulae.constants.PI_4_3 * rd3, f_org
401
405
  ),
402
406
  )
403
407
  r_dr_dt = formulae.drop_growth__r_dr_dt(
@@ -410,10 +414,11 @@ class CondensationMethods(BackendMethods):
410
414
  K,
411
415
  ventilation_factor,
412
416
  )
417
+ dm_dt = formulae.particle_shape_and_density__dm_dt(r=r_new, r_dr_dt=r_dr_dt)
413
418
  return (
414
419
  x_old
415
420
  - x_new
416
- + timestep * formulae.condensation_coordinate__dx_dt(x_new, r_dr_dt)
421
+ + timestep * formulae.diffusion_coordinate__dx_dt(mass_new, dm_dt)
417
422
  )
418
423
 
419
424
  @numba.njit(**jit_flags)
@@ -440,15 +445,17 @@ class CondensationMethods(BackendMethods):
440
445
  lambdaK = formulae.diffusion_kinetics__lambdaK(T, p)
441
446
  lambdaD = formulae.diffusion_kinetics__lambdaD(DTp, T)
442
447
  for drop in cell_idx:
448
+ if attributes.water_mass[drop] <= 0:
449
+ continue
443
450
  v_drop = formulae.particle_shape_and_density__mass_to_volume(
444
451
  attributes.water_mass[drop]
445
452
  )
446
- if v_drop <= 0:
447
- continue
448
- x_old = formulae.condensation_coordinate__x(v_drop)
453
+ x_old = formulae.diffusion_coordinate__x(attributes.water_mass[drop])
449
454
  r_old = formulae.trivia__radius(v_drop)
450
- x_insane = formulae.condensation_coordinate__x(
451
- attributes.vdry[drop] / 100
455
+ x_insane = formulae.diffusion_coordinate__x(
456
+ formulae.particle_shape_and_density__volume_to_mass(
457
+ attributes.vdry[drop] / 100
458
+ )
452
459
  )
453
460
  rd3 = attributes.vdry[drop] / formulae.constants.PI_4_3
454
461
  sgm = formulae.surface_tension__sigma(
@@ -492,8 +499,12 @@ class CondensationMethods(BackendMethods):
492
499
  Kr,
493
500
  ventilation_factor,
494
501
  )
495
- dx_old = timestep * formulae.condensation_coordinate__dx_dt(
496
- x_old, r_dr_dt_old
502
+ mass_old = formulae.diffusion_coordinate__mass(x_old)
503
+ dm_dt_old = formulae.particle_shape_and_density__dm_dt(
504
+ r=r_old, r_dr_dt=r_dr_dt_old
505
+ )
506
+ dx_old = timestep * formulae.diffusion_coordinate__dx_dt(
507
+ mass_old, dm_dt_old
497
508
  )
498
509
  else:
499
510
  dx_old = 0.0
@@ -561,9 +572,7 @@ class CondensationMethods(BackendMethods):
561
572
  else:
562
573
  x_new = x_old
563
574
 
564
- mass_new = formulae.particle_shape_and_density__volume_to_mass(
565
- formulae.condensation_coordinate__volume(x_new)
566
- )
575
+ mass_new = formulae.diffusion_coordinate__mass(x_new)
567
576
  mass_cr = formulae.particle_shape_and_density__volume_to_mass(
568
577
  attributes.v_cr[drop]
569
578
  )
@@ -0,0 +1,172 @@
1
+ """basic water vapor deposition on ice for CPU backend, for Howell factor see:
2
+ [Howell 1949](https://doi.org/10.1175/1520-0469(1949)006%3C0134:TGOCDI%3E2.0.CO;2)
3
+ """
4
+
5
+ from functools import cached_property
6
+ import numba
7
+ import numpy as np
8
+ from PySDM.backends.impl_common.backend_methods import BackendMethods
9
+
10
+
11
+ class DepositionMethods(BackendMethods): # pylint:disable=too-few-public-methods
12
+ @cached_property
13
+ def _deposition(self):
14
+ assert self.formulae.particle_shape_and_density.supports_mixed_phase()
15
+
16
+ formulae = self.formulae_flattened
17
+
18
+ @numba.njit(**{**self.default_jit_flags, **{"parallel": False}})
19
+ def body( # pylint: disable=too-many-arguments
20
+ *,
21
+ multiplicity,
22
+ signed_water_mass,
23
+ current_temperature,
24
+ current_total_pressure,
25
+ current_relative_humidity,
26
+ current_water_activity,
27
+ current_vapour_mixing_ratio,
28
+ current_dry_air_density,
29
+ current_dry_potential_temperature,
30
+ cell_volume,
31
+ time_step,
32
+ cell_id,
33
+ reynolds_number,
34
+ schmidt_number,
35
+ # to be modified
36
+ predicted_vapour_mixing_ratio,
37
+ predicted_dry_potential_temperature,
38
+ ):
39
+ # pylint: disable=too-many-locals
40
+ n_sd = len(signed_water_mass)
41
+ for i in range(n_sd):
42
+ if not formulae.trivia__unfrozen(signed_water_mass[i]):
43
+ ice_mass = -signed_water_mass[i]
44
+ cid = cell_id[i]
45
+
46
+ radius = formulae.particle_shape_and_density__mass_to_radius(
47
+ signed_water_mass[i]
48
+ )
49
+
50
+ diameter = radius * 2.0
51
+
52
+ temperature = current_temperature[cid]
53
+ pressure = current_total_pressure[cid]
54
+ rho = current_dry_air_density[cid]
55
+ pvs_ice = formulae.saturation_vapour_pressure__pvs_ice(temperature)
56
+ latent_heat_sub = formulae.latent_heat_sublimation__ls(temperature)
57
+
58
+ capacity = formulae.diffusion_ice_capacity__capacity(diameter)
59
+
60
+ ventilation_factor = formulae.ventilation__ventilation_coefficient(
61
+ sqrt_re_times_cbrt_sc=formulae.trivia__sqrt_re_times_cbrt_sc(
62
+ Re=reynolds_number[i],
63
+ Sc=schmidt_number[cid],
64
+ )
65
+ )
66
+
67
+ Dv_const = formulae.diffusion_thermics__D(temperature, pressure)
68
+ lambdaD = formulae.diffusion_ice_kinetics__lambdaD(
69
+ temperature, pressure
70
+ )
71
+ diffusion_coefficient = formulae.diffusion_ice_kinetics__D(
72
+ Dv_const, radius, lambdaD, temperature
73
+ )
74
+
75
+ Ka_const = formulae.diffusion_thermics__K(temperature, pressure)
76
+ lambdaK = formulae.diffusion_ice_kinetics__lambdaK(
77
+ temperature, pressure
78
+ )
79
+ thermal_conductivity = formulae.diffusion_ice_kinetics__K(
80
+ Ka_const, radius, lambdaK, temperature, rho
81
+ )
82
+ saturation_ratio_ice = (
83
+ current_relative_humidity[cid] / current_water_activity[cid]
84
+ )
85
+
86
+ if saturation_ratio_ice == 1:
87
+ continue
88
+
89
+ howell_factor_x_diffcoef_x_rhovsice_x_icess = (
90
+ formulae.drop_growth__r_dr_dt(
91
+ RH_eq=1,
92
+ T=temperature,
93
+ RH=saturation_ratio_ice,
94
+ lv=latent_heat_sub,
95
+ pvs=pvs_ice,
96
+ D=diffusion_coefficient,
97
+ K=thermal_conductivity,
98
+ ventilation_factor=ventilation_factor,
99
+ )
100
+ * formulae.constants.rho_w
101
+ )
102
+
103
+ dm_dt = (
104
+ 4
105
+ * np.pi
106
+ * capacity
107
+ * howell_factor_x_diffcoef_x_rhovsice_x_icess
108
+ )
109
+
110
+ delta_rv_i = (
111
+ -dm_dt * multiplicity[i] * time_step / (cell_volume * rho)
112
+ )
113
+ if -delta_rv_i > current_vapour_mixing_ratio[cid]:
114
+ assert False
115
+ predicted_vapour_mixing_ratio[cid] += delta_rv_i
116
+
117
+ predicted_dry_potential_temperature[cid] += (
118
+ formulae.state_variable_triplet__dthd_dt(
119
+ rhod=current_dry_air_density[cid],
120
+ thd=current_dry_potential_temperature[cid],
121
+ T=temperature,
122
+ d_water_vapour_mixing_ratio__dt=delta_rv_i / time_step,
123
+ lv=latent_heat_sub,
124
+ )
125
+ * time_step
126
+ )
127
+
128
+ x_old = formulae.diffusion_coordinate__x(ice_mass)
129
+ dx_dt_old = formulae.diffusion_coordinate__dx_dt(ice_mass, dm_dt)
130
+ x_new = formulae.trivia__explicit_euler(x_old, time_step, dx_dt_old)
131
+ signed_water_mass[i] = -formulae.diffusion_coordinate__mass(x_new)
132
+
133
+ return body
134
+
135
+ def deposition( # pylint: disable=too-many-locals
136
+ self,
137
+ *,
138
+ multiplicity,
139
+ signed_water_mass,
140
+ current_temperature,
141
+ current_total_pressure,
142
+ current_relative_humidity,
143
+ current_water_activity,
144
+ current_vapour_mixing_ratio,
145
+ current_dry_air_density,
146
+ current_dry_potential_temperature,
147
+ cell_volume,
148
+ time_step,
149
+ cell_id,
150
+ reynolds_number,
151
+ schmidt_number,
152
+ predicted_vapour_mixing_ratio,
153
+ predicted_dry_potential_temperature,
154
+ ):
155
+ self._deposition(
156
+ multiplicity=multiplicity.data,
157
+ signed_water_mass=signed_water_mass.data,
158
+ current_temperature=current_temperature.data,
159
+ current_total_pressure=current_total_pressure.data,
160
+ current_relative_humidity=current_relative_humidity.data,
161
+ current_water_activity=current_water_activity.data,
162
+ current_vapour_mixing_ratio=current_vapour_mixing_ratio.data,
163
+ current_dry_air_density=current_dry_air_density.data,
164
+ current_dry_potential_temperature=current_dry_potential_temperature.data,
165
+ cell_volume=cell_volume,
166
+ time_step=time_step,
167
+ cell_id=cell_id.data,
168
+ reynolds_number=reynolds_number.data,
169
+ schmidt_number=schmidt_number.data,
170
+ predicted_vapour_mixing_ratio=predicted_vapour_mixing_ratio.data,
171
+ predicted_dry_potential_temperature=predicted_dry_potential_temperature.data,
172
+ )
@@ -2,7 +2,10 @@
2
2
  CPU implementation of backend methods for freezing (singular and time-dependent immersion freezing)
3
3
  """
4
4
 
5
+ from functools import cached_property
6
+
5
7
  import numba
8
+ import numpy as np
6
9
 
7
10
  from PySDM.backends.impl_common.backend_methods import BackendMethods
8
11
 
@@ -56,7 +59,7 @@ class FreezingMethods(BackendMethods):
56
59
  prob_zero_events = self.formulae.trivia.poissonian_avoidance_function
57
60
 
58
61
  @numba.njit(**self.default_jit_flags)
59
- def freeze_time_dependent_body( # pylint: disable=unused-argument,too-many-arguments
62
+ def freeze_time_dependent_body( # pylint: disable=too-many-arguments
60
63
  rand,
61
64
  attributes,
62
65
  timestep,
@@ -64,8 +67,6 @@ class FreezingMethods(BackendMethods):
64
67
  a_w_ice,
65
68
  temperature,
66
69
  relative_humidity,
67
- record_freezing_temperature,
68
- freezing_temperature,
69
70
  thaw,
70
71
  ):
71
72
  n_sd = len(attributes.signed_water_mass)
@@ -88,8 +89,6 @@ class FreezingMethods(BackendMethods):
88
89
  )
89
90
  if rand[i] < prob:
90
91
  _freeze(attributes.signed_water_mass, i)
91
- # if record_freezing_temperature:
92
- # freezing_temperature[i] = temperature[cell_id]
93
92
 
94
93
  self.freeze_time_dependent_body = freeze_time_dependent_body
95
94
 
@@ -117,9 +116,7 @@ class FreezingMethods(BackendMethods):
117
116
  a_w_ice,
118
117
  temperature,
119
118
  relative_humidity,
120
- record_freezing_temperature,
121
- freezing_temperature,
122
- thaw: bool
119
+ thaw: bool,
123
120
  ):
124
121
  self.freeze_time_dependent_body(
125
122
  rand.data,
@@ -132,9 +129,31 @@ class FreezingMethods(BackendMethods):
132
129
  a_w_ice.data,
133
130
  temperature.data,
134
131
  relative_humidity.data,
135
- record_freezing_temperature=record_freezing_temperature,
136
- freezing_temperature=(
137
- freezing_temperature.data if record_freezing_temperature else None
138
- ),
139
132
  thaw=thaw,
140
133
  )
134
+
135
+ @cached_property
136
+ def _record_freezing_temperatures_body(self):
137
+ ff = self.formulae_flattened
138
+
139
+ @numba.njit(**{**self.default_jit_flags, "fastmath": False})
140
+ def body(data, cell_id, temperature, signed_water_mass):
141
+ for drop_id in numba.prange(len(data)): # pylint: disable=not-an-iterable
142
+ if ff.trivia__unfrozen(signed_water_mass[drop_id]):
143
+ if data[drop_id] > 0:
144
+ data[drop_id] = np.nan
145
+ else:
146
+ if np.isnan(data[drop_id]):
147
+ data[drop_id] = temperature[cell_id[drop_id]]
148
+
149
+ return body
150
+
151
+ def record_freezing_temperatures(
152
+ self, *, data, cell_id, temperature, signed_water_mass
153
+ ):
154
+ self._record_freezing_temperatures_body(
155
+ data=data.data,
156
+ cell_id=cell_id.data,
157
+ temperature=temperature.data,
158
+ signed_water_mass=signed_water_mass.data,
159
+ )
@@ -92,15 +92,7 @@ def _make_solve(formulae): # pylint: disable=too-many-statements,too-many-local
92
92
 
93
93
  @numba.njit(**{**JIT_FLAGS, **{"parallel": False}})
94
94
  def _liquid_water_mixing_ratio(n, x, m_d_mean):
95
- return (
96
- np.sum(
97
- n
98
- * jit_formulae.particle_shape_and_density__volume_to_mass(
99
- jit_formulae.condensation_coordinate__volume(x)
100
- )
101
- )
102
- / m_d_mean
103
- )
95
+ return np.sum(n * jit_formulae.diffusion_coordinate__mass(x)) / m_d_mean
104
96
 
105
97
  @numba.njit(**{**JIT_FLAGS, **{"parallel": False}})
106
98
  def _impl( # pylint: disable=too-many-arguments,too-many-locals
@@ -133,8 +125,10 @@ def _make_solve(formulae): # pylint: disable=too-many-statements,too-many-local
133
125
  diffusivity=DTp,
134
126
  density=air_density,
135
127
  )
128
+ sum_n_dm_dt = 0
136
129
  for i, x_i in enumerate(x):
137
- v = jit_formulae.condensation_coordinate__volume(x_i)
130
+ m = jit_formulae.diffusion_coordinate__mass(x_i)
131
+ v = jit_formulae.particle_shape_and_density__mass_to_volume(m)
138
132
  r = jit_formulae.trivia__radius(v)
139
133
  Dr = jit_formulae.diffusion_kinetics__D(DTp, r, lambdaD)
140
134
  Kr = jit_formulae.diffusion_kinetics__K(KTp, r, lambdaK)
@@ -145,34 +139,23 @@ def _make_solve(formulae): # pylint: disable=too-many-statements,too-many-local
145
139
  )
146
140
  )
147
141
  sgm = jit_formulae.surface_tension__sigma(T, v, dry_volume[i], f_org[i])
148
- dy_dt[idx_x + i] = jit_formulae.condensation_coordinate__dx_dt(
149
- x_i,
150
- jit_formulae.drop_growth__r_dr_dt(
151
- jit_formulae.hygroscopicity__RH_eq(
152
- r, T, kappa[i], dry_volume[i] / PI_4_3, sgm
153
- ),
154
- T,
155
- RH,
156
- lv,
157
- pvs,
158
- Dr,
159
- Kr,
160
- ventilation_factor,
142
+ r_dr_dt = jit_formulae.drop_growth__r_dr_dt(
143
+ jit_formulae.hygroscopicity__RH_eq(
144
+ r, T, kappa[i], dry_volume[i] / PI_4_3, sgm
161
145
  ),
146
+ T,
147
+ RH,
148
+ lv,
149
+ pvs,
150
+ Dr,
151
+ Kr,
152
+ ventilation_factor,
162
153
  )
163
- d_water_vapour_mixing_ratio__dt = (
164
- dot_water_vapour_mixing_ratio
165
- - np.sum(
166
- n
167
- * jit_formulae.particle_shape_and_density__volume_to_mass(
168
- jit_formulae.condensation_coordinate__volume(x)
169
- )
170
- * dy_dt[idx_x:]
171
- )
172
- / m_d_mean
173
- )
154
+ dm_dt = jit_formulae.particle_shape_and_density__dm_dt(r, r_dr_dt)
155
+ dy_dt[idx_x + i] = jit_formulae.diffusion_coordinate__dx_dt(m, dm_dt)
156
+ sum_n_dm_dt += n[i] * dm_dt
174
157
  dy_dt[idx_thd] = dot_thd + jit_formulae.state_variable_triplet__dthd_dt(
175
- rhod, thd, T, d_water_vapour_mixing_ratio__dt, lv
158
+ rhod, thd, T, dot_water_vapour_mixing_ratio - sum_n_dm_dt / m_d_mean, lv
176
159
  )
177
160
 
178
161
  @numba.njit(**{**JIT_FLAGS, **{"parallel": False}})
@@ -228,7 +211,7 @@ def _make_solve(formulae): # pylint: disable=too-many-statements,too-many-local
228
211
  air_dynamic_viscosity,
229
212
  rhod,
230
213
  pvs,
231
- jit_formulae.latent_heat__lv(T),
214
+ jit_formulae.latent_heat_vapourisation__lv(T),
232
215
  )
233
216
  return dy_dt
234
217
 
@@ -251,10 +234,8 @@ def _make_solve(formulae): # pylint: disable=too-many-statements,too-many-local
251
234
  n_sd_in_cell = len(cell_idx)
252
235
  y0 = np.empty(n_sd_in_cell + idx_x)
253
236
  y0[idx_thd] = thd
254
- y0[idx_x:] = jit_formulae.condensation_coordinate__x(
255
- jit_formulae.particle_shape_and_density__mass_to_volume(
256
- attributes.water_mass[cell_idx]
257
- )
237
+ y0[idx_x:] = jit_formulae.diffusion_coordinate__x(
238
+ attributes.water_mass[cell_idx]
258
239
  )
259
240
  total_water_mixing_ratio = (
260
241
  water_vapour_mixing_ratio
@@ -301,9 +282,7 @@ def _make_solve(formulae): # pylint: disable=too-many-statements,too-many-local
301
282
  m_new = 0
302
283
  for i in range(n_sd_in_cell):
303
284
  attributes.water_mass[cell_idx[i]] = (
304
- jit_formulae.particle_shape_and_density__volume_to_mass(
305
- jit_formulae.condensation_coordinate__volume(y1[idx_x + i])
306
- )
285
+ jit_formulae.diffusion_coordinate__mass(y1[idx_x + i])
307
286
  )
308
287
  m_new += (
309
288
  attributes.multiplicity[cell_idx[i]]