tpmslab 0.3.0__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 (80) hide show
  1. tpmslab-0.3.0/.zenodo.json +24 -0
  2. tpmslab-0.3.0/CHANGELOG.md +32 -0
  3. tpmslab-0.3.0/CITATION.cff +13 -0
  4. tpmslab-0.3.0/LICENSE +21 -0
  5. tpmslab-0.3.0/MANIFEST.in +12 -0
  6. tpmslab-0.3.0/PKG-INFO +220 -0
  7. tpmslab-0.3.0/README.md +188 -0
  8. tpmslab-0.3.0/THIRD_PARTY_NOTICES.md +22 -0
  9. tpmslab-0.3.0/benchmarks/density_study.py +84 -0
  10. tpmslab-0.3.0/benchmarks/release_reference.py +109 -0
  11. tpmslab-0.3.0/benchmarks/revision_study.py +151 -0
  12. tpmslab-0.3.0/benchmarks/run_benchmarks.py +85 -0
  13. tpmslab-0.3.0/benchmarks/verify_comsol.py +30 -0
  14. tpmslab-0.3.0/benchmarks/verify_solid_fluid.py +28 -0
  15. tpmslab-0.3.0/docs/METHOD.md +81 -0
  16. tpmslab-0.3.0/docs/QUICKSTART_EN.md +95 -0
  17. tpmslab-0.3.0/docs/QUICKSTART_ZH.md +53 -0
  18. tpmslab-0.3.0/docs/RELEASE_NOTES_v0.3.0.md +24 -0
  19. tpmslab-0.3.0/docs/SOLID_FLUID.md +31 -0
  20. tpmslab-0.3.0/docs/VALIDATION.md +28 -0
  21. tpmslab-0.3.0/docs/VERIFICATION.md +110 -0
  22. tpmslab-0.3.0/docs/VERSION_0.3.0.md +67 -0
  23. tpmslab-0.3.0/docs/lattgen_reference.m +72 -0
  24. tpmslab-0.3.0/examples/graded_gyroid.json +32 -0
  25. tpmslab-0.3.0/examples/graded_gyroid.py +13 -0
  26. tpmslab-0.3.0/examples/gyroid_graded.json +31 -0
  27. tpmslab-0.3.0/examples/primitive_graded.json +31 -0
  28. tpmslab-0.3.0/examples/solid_fluid.json +33 -0
  29. tpmslab-0.3.0/examples/solid_fluid_api.py +38 -0
  30. tpmslab-0.3.0/licenses/LattGen-MIT.txt +21 -0
  31. tpmslab-0.3.0/pyproject.toml +46 -0
  32. tpmslab-0.3.0/setup.cfg +4 -0
  33. tpmslab-0.3.0/src/tpmslab/__init__.py +30 -0
  34. tpmslab-0.3.0/src/tpmslab/__main__.py +3 -0
  35. tpmslab-0.3.0/src/tpmslab/cli.py +63 -0
  36. tpmslab-0.3.0/src/tpmslab/comsol.py +250 -0
  37. tpmslab-0.3.0/src/tpmslab/comsol_audit.py +128 -0
  38. tpmslab-0.3.0/src/tpmslab/comsol_dual.py +165 -0
  39. tpmslab-0.3.0/src/tpmslab/families.json +119 -0
  40. tpmslab-0.3.0/src/tpmslab/io.py +72 -0
  41. tpmslab-0.3.0/src/tpmslab/model.py +258 -0
  42. tpmslab-0.3.0/src/tpmslab/multidomain.py +196 -0
  43. tpmslab-0.3.0/src/tpmslab/py.typed +0 -0
  44. tpmslab-0.3.0/src/tpmslab/quality.py +46 -0
  45. tpmslab-0.3.0/src/tpmslab/static/app.js +30 -0
  46. tpmslab-0.3.0/src/tpmslab/static/index.html +16 -0
  47. tpmslab-0.3.0/src/tpmslab/static/style.css +3 -0
  48. tpmslab-0.3.0/src/tpmslab/static/vendor/OrbitControls.js +1523 -0
  49. tpmslab-0.3.0/src/tpmslab/static/vendor/THREE-LICENSE.txt +21 -0
  50. tpmslab-0.3.0/src/tpmslab/static/vendor/three.module.js +54155 -0
  51. tpmslab-0.3.0/src/tpmslab/verification.py +57 -0
  52. tpmslab-0.3.0/src/tpmslab/volume.py +310 -0
  53. tpmslab-0.3.0/src/tpmslab/web.py +302 -0
  54. tpmslab-0.3.0/src/tpmslab.egg-info/PKG-INFO +220 -0
  55. tpmslab-0.3.0/src/tpmslab.egg-info/SOURCES.txt +78 -0
  56. tpmslab-0.3.0/src/tpmslab.egg-info/dependency_links.txt +1 -0
  57. tpmslab-0.3.0/src/tpmslab.egg-info/entry_points.txt +2 -0
  58. tpmslab-0.3.0/src/tpmslab.egg-info/requires.txt +17 -0
  59. tpmslab-0.3.0/src/tpmslab.egg-info/top_level.txt +1 -0
  60. tpmslab-0.3.0/tests/test_core.py +117 -0
  61. tpmslab-0.3.0/tests/test_multidomain.py +92 -0
  62. tpmslab-0.3.0/tests/test_package.py +96 -0
  63. tpmslab-0.3.0/tests/test_verification.py +67 -0
  64. tpmslab-0.3.0/validation/README.md +44 -0
  65. tpmslab-0.3.0/validation/checksums.json +18 -0
  66. tpmslab-0.3.0/validation/code_commit.json +4 -0
  67. tpmslab-0.3.0/validation/density/density_results.json +404 -0
  68. tpmslab-0.3.0/validation/environment.json +23 -0
  69. tpmslab-0.3.0/validation/existing_Diamond_audit/audit.json +35 -0
  70. tpmslab-0.3.0/validation/existing_Gyroid_audit/audit.json +35 -0
  71. tpmslab-0.3.0/validation/existing_Primitive_Schwartz_audit/audit.json +35 -0
  72. tpmslab-0.3.0/validation/historical_windows_checksums.json +17 -0
  73. tpmslab-0.3.0/validation/performance_summary.csv +5 -0
  74. tpmslab-0.3.0/validation/provenance.json +72 -0
  75. tpmslab-0.3.0/validation/quality_summary.csv +5 -0
  76. tpmslab-0.3.0/validation/reference_configs/Diamond.json +33 -0
  77. tpmslab-0.3.0/validation/reference_configs/Gyroid.json +33 -0
  78. tpmslab-0.3.0/validation/reference_configs/Primitive_Schwartz.json +33 -0
  79. tpmslab-0.3.0/validation/refinement_summary.csv +10 -0
  80. tpmslab-0.3.0/validation/summary.json +606 -0
@@ -0,0 +1,24 @@
1
+ {
2
+ "title": "TPMS Lab v0.3.0",
3
+ "version": "0.3.0",
4
+ "upload_type": "software",
5
+ "description": "Python package for graded complementary solid and pore-fluid meshes with shared interfaces, connected-domain metadata and optional verified COMSOL workflows. Source, tests, examples and numerical validation records are included.",
6
+ "creators": [
7
+ {
8
+ "name": "Chen, Xin",
9
+ "affiliation": "McGill University"
10
+ },
11
+ {
12
+ "name": "Akbarzadeh, Abdolhamid",
13
+ "affiliation": "McGill University"
14
+ }
15
+ ],
16
+ "license": "MIT",
17
+ "keywords": [
18
+ "TPMS",
19
+ "graded lattices",
20
+ "volume meshes",
21
+ "COMSOL",
22
+ "Python"
23
+ ]
24
+ }
@@ -0,0 +1,32 @@
1
+ # Changelog
2
+
3
+ ## 0.3.0
4
+
5
+ - Package the verified complementary solid/fluid workflow and independent audits.
6
+ - Include density, refinement, interface, channel and performance records with provenance.
7
+ - Retain the validated numerical implementation from commit 686b783e0385.
8
+ - Clarify geometry/solver response stability and local quality-strategy limitations.
9
+ - Add isolated-wheel reference checks, exact-commit release preparation and public version documentation.
10
+ - Preserve historical validation provenance; GitHub publication and DOI registration remain separate records.
11
+
12
+
13
+ ## 0.3.0rc1 — solid and pore-fluid domains
14
+
15
+ - Add complementary solid/fluid meshes with shared interface vertices and faces.
16
+ - Preserve independently connected solid and fluid domains, phase arrays and named boundaries.
17
+ - Add fluid preview, domain metadata and optional COMSOL named selections.
18
+ - Verify three fixed-wall pore-flow examples in COMSOL; deformation-coupled FSI is not implemented.
19
+ - Add analytical partition and multi-family interface regression tests.
20
+
21
+ ## 0.2.0rc1 — local release candidate
22
+
23
+ - Introduce src-layout packaging, public Python API and command-line commands.
24
+ - Keep Flask and the browser interface optional; COMSOL remains optional.
25
+ - Add conservative interior-fan selection with unchanged external boundary.
26
+ - Add quality-tail diagnostics, deterministic mesh/boundary fingerprints,
27
+ environment records and file-integrity manifests.
28
+ - Normalize configuration lists to immutable tuples and apply phase controls
29
+ consistently in the field helper.
30
+ - Include reproducible comparisons, automated tests and release documentation.
31
+
32
+ No PyPI release has been made; earlier rc entries describe local release candidates.
@@ -0,0 +1,13 @@
1
+ cff-version: 1.2.0
2
+ message: "Please cite the exact software version used."
3
+ type: software
4
+ title: "TPMS Lab"
5
+ version: "0.3.0"
6
+ authors:
7
+ - family-names: Chen
8
+ given-names: Xin
9
+ - family-names: Akbarzadeh
10
+ given-names: Abdolhamid
11
+ repository-code: "https://github.com/Slight1211/TPMSLab"
12
+ license: MIT
13
+ abstract: "A Python package for graded complementary solid and pore-fluid meshes with connected-domain metadata and optional verified COMSOL workflows."
tpmslab-0.3.0/LICENSE ADDED
@@ -0,0 +1,21 @@
1
+ MIT License
2
+
3
+ Copyright (c) 2026 TPMS Lab contributors
4
+
5
+ Permission is hereby granted, free of charge, to any person obtaining a copy
6
+ of this software and associated documentation files (the "Software"), to deal
7
+ in the Software without restriction, including without limitation the rights
8
+ to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
9
+ copies of the Software, and to permit persons to whom the Software is
10
+ furnished to do so, subject to the following conditions:
11
+
12
+ The above copyright notice and this permission notice shall be included in all
13
+ copies or substantial portions of the Software.
14
+
15
+ THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
16
+ IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
17
+ FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
18
+ AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
19
+ LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
20
+ OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
21
+ SOFTWARE.
@@ -0,0 +1,12 @@
1
+ include README.md LICENSE CHANGELOG.md THIRD_PARTY_NOTICES.md
2
+ recursive-include licenses *.txt
3
+ recursive-include docs *.md *.m
4
+ recursive-include examples *.json *.py
5
+ recursive-include tests *.py
6
+ recursive-include benchmarks *.py
7
+
8
+ exclude docs/RELEASE_CHECKLIST.md
9
+ prune paper
10
+
11
+ recursive-include validation *.json *.csv *.md
12
+ include CITATION.cff .zenodo.json
tpmslab-0.3.0/PKG-INFO ADDED
@@ -0,0 +1,220 @@
1
+ Metadata-Version: 2.4
2
+ Name: tpmslab
3
+ Version: 0.3.0
4
+ Summary: Direct conforming volume meshes for graded implicit TPMS lattices
5
+ License-Expression: MIT
6
+ Keywords: TPMS,finite-element,meshing,graded-lattice,COMSOL
7
+ Classifier: Development Status :: 4 - Beta
8
+ Classifier: Intended Audience :: Science/Research
9
+ Classifier: Programming Language :: Python :: 3
10
+ Classifier: Programming Language :: Python :: 3.11
11
+ Classifier: Programming Language :: Python :: 3.12
12
+ Classifier: Topic :: Scientific/Engineering
13
+ Requires-Python: >=3.11
14
+ Description-Content-Type: text/markdown
15
+ License-File: LICENSE
16
+ License-File: licenses/LattGen-MIT.txt
17
+ Requires-Dist: numpy<3,>=1.26
18
+ Requires-Dist: scipy<2,>=1.11
19
+ Requires-Dist: trimesh<6,>=4
20
+ Provides-Extra: web
21
+ Requires-Dist: flask<4,>=3.1; extra == "web"
22
+ Provides-Extra: test
23
+ Requires-Dist: pytest<10,>=8; extra == "test"
24
+ Requires-Dist: flask<4,>=3.1; extra == "test"
25
+ Provides-Extra: dev
26
+ Requires-Dist: pytest<10,>=8; extra == "dev"
27
+ Requires-Dist: flask<4,>=3.1; extra == "dev"
28
+ Requires-Dist: build>=1.2; extra == "dev"
29
+ Requires-Dist: twine>=6; extra == "dev"
30
+ Requires-Dist: ruff>=0.12; extra == "dev"
31
+ Dynamic: license-file
32
+
33
+ # TPMS Lab
34
+
35
+ [English quick start](docs/QUICKSTART_EN.md) | [中文使用说明](docs/QUICKSTART_ZH.md)
36
+
37
+ An installable Python toolkit for graded TPMS-derived **solid and complementary pore-fluid volume meshes**.
38
+ Version 0.3.0. This repository is public. Source, tests, examples and versioned
39
+ reproducibility records are distributed together. Use an exact commit or the
40
+ `v0.3.0` tag, rather than a changing `main`, for reproducible work.
41
+
42
+ [Version and installation details](docs/VERSION_0.3.0.md) |
43
+ [GitHub releases](https://github.com/Slight1211/TPMSLab/releases)
44
+
45
+ A public source repository, a GitHub Release, a Zenodo archive and a PyPI upload
46
+ are separate records. Cite a DOI only after the archive is actually published.
47
+ No PyPI release has been made.
48
+
49
+ ## Install
50
+
51
+ Use Python 3.11 or newer. From this source directory:
52
+
53
+ ```sh
54
+ python -m pip install .
55
+ # Optional local browser interface
56
+ python -m pip install ".[web]"
57
+ ```
58
+
59
+ Build a wheel locally with `python -m build` (requires the `build` package). The core does not require Flask, COMSOL, MATLAB,
60
+ OpenCascade, a CAD import licence or a graphics display. COMSOL model creation
61
+ and solving require a separate compatible COMSOL installation and licence.
62
+
63
+ ## Python API
64
+
65
+ ```python
66
+ from tpmslab import Config, generate, save_model
67
+
68
+ mesh = generate(Config(family="Gyroid", resolution=16,
69
+ density_start=0.25, density_end=0.50,
70
+ gradient="linear", quality_strategy="quality_fan"))
71
+ print(mesh["report"]["actual_density"])
72
+ save_model(mesh, "gyroid_result") # destination must not exist
73
+ ```
74
+
75
+ `generate` also accepts a dictionary. `list_families()` returns formula metadata.
76
+ Coordinates are millimetres; array connectivity is zero-based. The returned
77
+ mapping contains `points`, `tetra`, `boundary`, `boundary_ids`, `domains`,
78
+ `surface` (a trimesh object) and `report`. This API may change before
79
+ 1.0. Configuration objects normalize sequence fields to immutable tuples.
80
+
81
+ ## Command line
82
+
83
+ ```sh
84
+ tpmslab init-config params.json
85
+ tpmslab generate --config params.json --out result
86
+ tpmslab families
87
+ tpmslab web --output local_models
88
+ # Requires licensed COMSOL on Windows:
89
+ tpmslab generate --config params.json --out solved_result --solve
90
+ ```
91
+
92
+ Export includes `mesh.nas` (CTETRA volume elements and labelled boundary
93
+ triangles), `mesh.npz`, `preview.stl`, parameters, diagnostics, environment and a
94
+ SHA-256 manifest. Existing output directories are rejected. A failed export
95
+ can leave a partial directory; choose a new destination after addressing the
96
+ error. STL is only a boundary preview. The optional bridge imports the volume
97
+ mesh, creates an MPH and reopens it to check the embedded element count.
98
+ Set `COMSOL_BIN` to the folder containing `comsolbatch.exe` and
99
+ `comsolcompile.exe` if automatic Windows detection fails.
100
+
101
+ ## Method and limits
102
+
103
+ The library samples trigonometric level-set approximations, calibrates density
104
+ against a 56 cubed periodic-cell sample and clips a six-tetrahedra-per-voxel
105
+ background mesh. Sheet structures use two separate interpolated inequalities;
106
+ they do not have constant physical wall thickness. Shared intersections and
107
+ canonical face diagonals form a conforming tetrahedral volume mesh. Material
108
+ volume, boundary closure, face incidence and orientation are checked before
109
+ export. The result is a piecewise-planar solid domain, **not editable smooth
110
+ STEP/NURBS CAD**. Mesh generation can reject difficult parameter combinations.
111
+
112
+ `quality_fan` compares the original pulling fan with an interior-centroid fan
113
+ for poor cut cells and accepts only a better worst mean-ratio quality while
114
+ preserving boundary triangles and volume. This increases element count and can
115
+ reduce median quality. It provides no angle bound, global optimization or
116
+ finite-element convergence guarantee. `pulling` retains the baseline method.
117
+
118
+ There are 29 reference labels (27 distinct expressions, with aliases), eight
119
+ density profiles, sheet and two network modes, phase controls, and a restricted
120
+ custom-formula parser. Built-in formulas are adapted from LattGen; see
121
+ `THIRD_PARTY_NOTICES.md`. They are not claimed as new TPMS families or exact
122
+ minimal surfaces. Density targets are periodic-cell calibrations, not guaranteed
123
+ finite-specimen volume fractions. Current bounds: box domains, 1–6 cells per
124
+ axis, 8–64 samples per cell and at most 200,000 background voxels. The built-in
125
+ static demo is limited to 180,000 tetrahedra and connected material. Top/bottom
126
+ contact, constraints and convergence must be checked for a research model.
127
+
128
+ ## Development and reproduction
129
+
130
+ ```sh
131
+ python -m pip install ".[dev]"
132
+ python -m pytest
133
+ python -m ruff check src tests benchmarks
134
+ python -m build
135
+ python -m twine check dist/*
136
+ python benchmarks/run_benchmarks.py --out benchmark_results
137
+ ```
138
+
139
+ See `docs/METHOD.md`, `docs/SOLID_FLUID.md` and `docs/VALIDATION.md`.
140
+ The CI matrix is configured for Windows/Linux and Python 3.11/3.12; configuring
141
+ CI does not mean those jobs have run. The measured local environment is Windows
142
+ and Python 3.12. Optional COMSOL validation is separate from the open test suite.
143
+
144
+ ## Licence and attribution
145
+
146
+ MIT. See `LICENSE`, `THIRD_PARTY_NOTICES.md` and `licenses/` for the
147
+ package licence and third-party formula and browser-library notices.
148
+
149
+ ## Solid and pore-fluid domains (0.3)
150
+
151
+ ```python
152
+ from tpmslab import Config, generate, save_model
153
+ from tpmslab.comsol import build_mph
154
+
155
+ mesh = generate(Config(domain_mode="solid_fluid", family="Gyroid", resolution=12))
156
+ folder = save_model(mesh, "solid_fluid_gyroid")
157
+ # Optional, licensed COMSOL: verifies selections, each domain volume and saved mesh.
158
+ build_mph(folder, mesh["report"], solve=False)
159
+ # solve=True instead runs the fixed-wall pore-flow demonstration described below.
160
+ ```
161
+
162
+ In the browser, select **固体 + 孔隙流体(共享界面)** under **计算域**.
163
+ The phase selector switches the preview between solid and pore fluid.
164
+ The default remains solid-only for compatibility. The JSON/CLI parameter is
165
+ `"domain_mode": "solid_fluid"`.
166
+
167
+ Both phases partition the same bounding box. They use shared cut-edge vertices
168
+ and identical interface triangles. For sheet structures the two complementary
169
+ inequalities are meshed separately, allowing disconnected labyrinths to remain
170
+ separate domains. Connectivity is determined by shared tetrahedron faces.
171
+ The combined mesh is checked for positive volumes, opposite adjacent-face
172
+ orientation, complete interface matching and total volume conservation.
173
+
174
+ `phase_ids` is one value per tetrahedron (1=solid, 2=fluid); `domains` identifies
175
+ individual connected domains. `interface` is oriented out of the solid.
176
+ `boundary` includes the outer boundary AND the solid-fluid interface once.
177
+ Additional arrays are `solid_boundary` and `fluid_boundary`. `surface` and
178
+ `preview.stl` continue to show the solid; `fluid_surface` and `fluid_preview.stl`
179
+ show the pore fluid. The NPZ retains all phase and boundary arrays. `domains.json`
180
+ records domain-to-phase and boundary-name mappings. Report `volume_mm3` remains
181
+ solid volume; `total_mesh_volume_mm3` includes both phases.
182
+
183
+ NASTRAN PSOLID property IDs are `100 + domain_id`. Boundary PIDs 2–7 are solid
184
+ xmin/xmax/ymin/ymax/zmin/zmax; 12–17 are the corresponding fluid faces; PID 8
185
+ is the shared interface. PIDs are NOT COMSOL entity numbers. The bridge resolves
186
+ imported PID selections and creates `solid_domains`, `fluid_domains`, individual
187
+ connected-domain selections, `solid_fluid_interface`, and the nonempty exterior
188
+ face selections. It assigns demonstration solid/fluid materials separately.
189
+ An unsolved export requires no CFD physics interface and is a starting point
190
+ for the user's physics setup.
191
+
192
+ For dual-domain models, `solve=True` runs stationary **creeping flow only in the
193
+ fluid**, with fixed no-slip solid walls, pressure 0.01 Pa at fluid_zmin and 0 Pa
194
+ at fluid_zmax, and no-slip on other fluid exterior faces. Density is 1000 kg/m³
195
+ and viscosity 0.001 Pa·s. Every fluid component must reach both Z faces; otherwise
196
+ the automatic demo is refused while unsolved export remains available. This
197
+ requires the corresponding COMSOL physics licence. It reports inlet/outlet
198
+ flow and relative imbalance (the smoke-test threshold is 5%, not an accuracy
199
+ claim). It is **not deformation-coupled FSI**, not conjugate heat transfer, and
200
+ not a validated permeability prediction. Boundary layers, external reservoirs,
201
+ mesh convergence and realistic boundary conditions remain user responsibilities.
202
+ See `docs/SOLID_FLUID.md` for validation and reproducibility.
203
+
204
+ ## Solid–fluid quick start
205
+
206
+ Run [the Python example](examples/solid_fluid_api.py). Installation, exported
207
+ files and optional COMSOL calculations are documented in the
208
+ [English quick start](docs/QUICKSTART_EN.md) and
209
+ [中文使用说明](docs/QUICKSTART_ZH.md).
210
+
211
+ ## Independent verification
212
+
213
+ See [Verification and reproducible studies](docs/VERIFICATION.md) for density realization, independent interface incidence and area audits, channel-wise COMSOL flux checks, and refinement/performance scripts. `quality_fan` is optional local worst-element mitigation, not a general quality or solver-speed guarantee.
214
+
215
+ ## Reproducibility records
216
+
217
+ See [validation/README.md](validation/README.md) for the numerical records,
218
+ configuration provenance and reproduction commands corresponding to the verified
219
+ workflow. The package provides mesh-defined simulation domains, not smooth CAD
220
+ reconstruction or coupled FSI.
@@ -0,0 +1,188 @@
1
+ # TPMS Lab
2
+
3
+ [English quick start](docs/QUICKSTART_EN.md) | [中文使用说明](docs/QUICKSTART_ZH.md)
4
+
5
+ An installable Python toolkit for graded TPMS-derived **solid and complementary pore-fluid volume meshes**.
6
+ Version 0.3.0. This repository is public. Source, tests, examples and versioned
7
+ reproducibility records are distributed together. Use an exact commit or the
8
+ `v0.3.0` tag, rather than a changing `main`, for reproducible work.
9
+
10
+ [Version and installation details](docs/VERSION_0.3.0.md) |
11
+ [GitHub releases](https://github.com/Slight1211/TPMSLab/releases)
12
+
13
+ A public source repository, a GitHub Release, a Zenodo archive and a PyPI upload
14
+ are separate records. Cite a DOI only after the archive is actually published.
15
+ No PyPI release has been made.
16
+
17
+ ## Install
18
+
19
+ Use Python 3.11 or newer. From this source directory:
20
+
21
+ ```sh
22
+ python -m pip install .
23
+ # Optional local browser interface
24
+ python -m pip install ".[web]"
25
+ ```
26
+
27
+ Build a wheel locally with `python -m build` (requires the `build` package). The core does not require Flask, COMSOL, MATLAB,
28
+ OpenCascade, a CAD import licence or a graphics display. COMSOL model creation
29
+ and solving require a separate compatible COMSOL installation and licence.
30
+
31
+ ## Python API
32
+
33
+ ```python
34
+ from tpmslab import Config, generate, save_model
35
+
36
+ mesh = generate(Config(family="Gyroid", resolution=16,
37
+ density_start=0.25, density_end=0.50,
38
+ gradient="linear", quality_strategy="quality_fan"))
39
+ print(mesh["report"]["actual_density"])
40
+ save_model(mesh, "gyroid_result") # destination must not exist
41
+ ```
42
+
43
+ `generate` also accepts a dictionary. `list_families()` returns formula metadata.
44
+ Coordinates are millimetres; array connectivity is zero-based. The returned
45
+ mapping contains `points`, `tetra`, `boundary`, `boundary_ids`, `domains`,
46
+ `surface` (a trimesh object) and `report`. This API may change before
47
+ 1.0. Configuration objects normalize sequence fields to immutable tuples.
48
+
49
+ ## Command line
50
+
51
+ ```sh
52
+ tpmslab init-config params.json
53
+ tpmslab generate --config params.json --out result
54
+ tpmslab families
55
+ tpmslab web --output local_models
56
+ # Requires licensed COMSOL on Windows:
57
+ tpmslab generate --config params.json --out solved_result --solve
58
+ ```
59
+
60
+ Export includes `mesh.nas` (CTETRA volume elements and labelled boundary
61
+ triangles), `mesh.npz`, `preview.stl`, parameters, diagnostics, environment and a
62
+ SHA-256 manifest. Existing output directories are rejected. A failed export
63
+ can leave a partial directory; choose a new destination after addressing the
64
+ error. STL is only a boundary preview. The optional bridge imports the volume
65
+ mesh, creates an MPH and reopens it to check the embedded element count.
66
+ Set `COMSOL_BIN` to the folder containing `comsolbatch.exe` and
67
+ `comsolcompile.exe` if automatic Windows detection fails.
68
+
69
+ ## Method and limits
70
+
71
+ The library samples trigonometric level-set approximations, calibrates density
72
+ against a 56 cubed periodic-cell sample and clips a six-tetrahedra-per-voxel
73
+ background mesh. Sheet structures use two separate interpolated inequalities;
74
+ they do not have constant physical wall thickness. Shared intersections and
75
+ canonical face diagonals form a conforming tetrahedral volume mesh. Material
76
+ volume, boundary closure, face incidence and orientation are checked before
77
+ export. The result is a piecewise-planar solid domain, **not editable smooth
78
+ STEP/NURBS CAD**. Mesh generation can reject difficult parameter combinations.
79
+
80
+ `quality_fan` compares the original pulling fan with an interior-centroid fan
81
+ for poor cut cells and accepts only a better worst mean-ratio quality while
82
+ preserving boundary triangles and volume. This increases element count and can
83
+ reduce median quality. It provides no angle bound, global optimization or
84
+ finite-element convergence guarantee. `pulling` retains the baseline method.
85
+
86
+ There are 29 reference labels (27 distinct expressions, with aliases), eight
87
+ density profiles, sheet and two network modes, phase controls, and a restricted
88
+ custom-formula parser. Built-in formulas are adapted from LattGen; see
89
+ `THIRD_PARTY_NOTICES.md`. They are not claimed as new TPMS families or exact
90
+ minimal surfaces. Density targets are periodic-cell calibrations, not guaranteed
91
+ finite-specimen volume fractions. Current bounds: box domains, 1–6 cells per
92
+ axis, 8–64 samples per cell and at most 200,000 background voxels. The built-in
93
+ static demo is limited to 180,000 tetrahedra and connected material. Top/bottom
94
+ contact, constraints and convergence must be checked for a research model.
95
+
96
+ ## Development and reproduction
97
+
98
+ ```sh
99
+ python -m pip install ".[dev]"
100
+ python -m pytest
101
+ python -m ruff check src tests benchmarks
102
+ python -m build
103
+ python -m twine check dist/*
104
+ python benchmarks/run_benchmarks.py --out benchmark_results
105
+ ```
106
+
107
+ See `docs/METHOD.md`, `docs/SOLID_FLUID.md` and `docs/VALIDATION.md`.
108
+ The CI matrix is configured for Windows/Linux and Python 3.11/3.12; configuring
109
+ CI does not mean those jobs have run. The measured local environment is Windows
110
+ and Python 3.12. Optional COMSOL validation is separate from the open test suite.
111
+
112
+ ## Licence and attribution
113
+
114
+ MIT. See `LICENSE`, `THIRD_PARTY_NOTICES.md` and `licenses/` for the
115
+ package licence and third-party formula and browser-library notices.
116
+
117
+ ## Solid and pore-fluid domains (0.3)
118
+
119
+ ```python
120
+ from tpmslab import Config, generate, save_model
121
+ from tpmslab.comsol import build_mph
122
+
123
+ mesh = generate(Config(domain_mode="solid_fluid", family="Gyroid", resolution=12))
124
+ folder = save_model(mesh, "solid_fluid_gyroid")
125
+ # Optional, licensed COMSOL: verifies selections, each domain volume and saved mesh.
126
+ build_mph(folder, mesh["report"], solve=False)
127
+ # solve=True instead runs the fixed-wall pore-flow demonstration described below.
128
+ ```
129
+
130
+ In the browser, select **固体 + 孔隙流体(共享界面)** under **计算域**.
131
+ The phase selector switches the preview between solid and pore fluid.
132
+ The default remains solid-only for compatibility. The JSON/CLI parameter is
133
+ `"domain_mode": "solid_fluid"`.
134
+
135
+ Both phases partition the same bounding box. They use shared cut-edge vertices
136
+ and identical interface triangles. For sheet structures the two complementary
137
+ inequalities are meshed separately, allowing disconnected labyrinths to remain
138
+ separate domains. Connectivity is determined by shared tetrahedron faces.
139
+ The combined mesh is checked for positive volumes, opposite adjacent-face
140
+ orientation, complete interface matching and total volume conservation.
141
+
142
+ `phase_ids` is one value per tetrahedron (1=solid, 2=fluid); `domains` identifies
143
+ individual connected domains. `interface` is oriented out of the solid.
144
+ `boundary` includes the outer boundary AND the solid-fluid interface once.
145
+ Additional arrays are `solid_boundary` and `fluid_boundary`. `surface` and
146
+ `preview.stl` continue to show the solid; `fluid_surface` and `fluid_preview.stl`
147
+ show the pore fluid. The NPZ retains all phase and boundary arrays. `domains.json`
148
+ records domain-to-phase and boundary-name mappings. Report `volume_mm3` remains
149
+ solid volume; `total_mesh_volume_mm3` includes both phases.
150
+
151
+ NASTRAN PSOLID property IDs are `100 + domain_id`. Boundary PIDs 2–7 are solid
152
+ xmin/xmax/ymin/ymax/zmin/zmax; 12–17 are the corresponding fluid faces; PID 8
153
+ is the shared interface. PIDs are NOT COMSOL entity numbers. The bridge resolves
154
+ imported PID selections and creates `solid_domains`, `fluid_domains`, individual
155
+ connected-domain selections, `solid_fluid_interface`, and the nonempty exterior
156
+ face selections. It assigns demonstration solid/fluid materials separately.
157
+ An unsolved export requires no CFD physics interface and is a starting point
158
+ for the user's physics setup.
159
+
160
+ For dual-domain models, `solve=True` runs stationary **creeping flow only in the
161
+ fluid**, with fixed no-slip solid walls, pressure 0.01 Pa at fluid_zmin and 0 Pa
162
+ at fluid_zmax, and no-slip on other fluid exterior faces. Density is 1000 kg/m³
163
+ and viscosity 0.001 Pa·s. Every fluid component must reach both Z faces; otherwise
164
+ the automatic demo is refused while unsolved export remains available. This
165
+ requires the corresponding COMSOL physics licence. It reports inlet/outlet
166
+ flow and relative imbalance (the smoke-test threshold is 5%, not an accuracy
167
+ claim). It is **not deformation-coupled FSI**, not conjugate heat transfer, and
168
+ not a validated permeability prediction. Boundary layers, external reservoirs,
169
+ mesh convergence and realistic boundary conditions remain user responsibilities.
170
+ See `docs/SOLID_FLUID.md` for validation and reproducibility.
171
+
172
+ ## Solid–fluid quick start
173
+
174
+ Run [the Python example](examples/solid_fluid_api.py). Installation, exported
175
+ files and optional COMSOL calculations are documented in the
176
+ [English quick start](docs/QUICKSTART_EN.md) and
177
+ [中文使用说明](docs/QUICKSTART_ZH.md).
178
+
179
+ ## Independent verification
180
+
181
+ See [Verification and reproducible studies](docs/VERIFICATION.md) for density realization, independent interface incidence and area audits, channel-wise COMSOL flux checks, and refinement/performance scripts. `quality_fan` is optional local worst-element mitigation, not a general quality or solver-speed guarantee.
182
+
183
+ ## Reproducibility records
184
+
185
+ See [validation/README.md](validation/README.md) for the numerical records,
186
+ configuration provenance and reproduction commands corresponding to the verified
187
+ workflow. The package provides mesh-defined simulation domains, not smooth CAD
188
+ reconstruction or coupled FSI.
@@ -0,0 +1,22 @@
1
+ # Third-party notices
2
+
3
+ The formula registry is adapted from Hilda Chris-Amadin and Osezua Ibhadode,
4
+ LattGen: A TPMS lattice generation tool, Software Impacts 21 (2024), 100665,
5
+ https://doi.org/10.1016/j.simpa.2024.100665.
6
+ Source: https://github.com/SoftwareImpacts/SIMPAC-2024-10 .
7
+ The repository MIT notice is preserved in licenses/LattGen-MIT.txt.
8
+ The 29 source labels include two duplicate-expression aliases; the paper's
9
+ reported family count should not be used to claim 29 distinct new families.
10
+ Reference functions are in docs/lattgen_reference.m where available.
11
+
12
+ Three.js r169 and OrbitControls are redistributed under MIT. Full notice:
13
+ src/tpmslab/static/vendor/THREE-LICENSE.txt. Source: https://github.com/mrdoob/three.js .
14
+
15
+ NumPy, SciPy, trimesh and optional Flask are dependencies installed separately;
16
+ their upstream licences remain applicable. COMSOL is proprietary software,
17
+ installed and licensed separately. No COMSOL executable is redistributed.
18
+
19
+ The direct cut-volume workflow was informed by the user's earlier TPMS cut-mesh
20
+ validation scripts. Provenance and contributor authorship require maintainer
21
+ review before public release. No novelty claim is made for clipping,
22
+ pulling triangulation, centroid fans or the supplied level-set functions.
@@ -0,0 +1,84 @@
1
+ """Density realization and exact grid-aligned slab volumes for reference specimens."""
2
+
3
+ import argparse
4
+ from dataclasses import replace
5
+ import json
6
+ from pathlib import Path
7
+ import numpy as np
8
+ from tpmslab import Config, generate
9
+ from tpmslab.model import raw_field
10
+ from tpmslab.verification import audit_interface
11
+
12
+
13
+ def load_mesh(folder):
14
+ a = np.load(Path(folder) / "mesh.npz")
15
+ return dict(
16
+ points=a["points_mm"],
17
+ tetra=a["tetrahedra"],
18
+ phase_ids=a["phase_ids"],
19
+ interface=a["interface"],
20
+ domains=a["domain_ids"],
21
+ )
22
+
23
+
24
+ def geometry_record(model, config):
25
+ p = model["points"][model["tetra"]]
26
+ v = (
27
+ np.abs(
28
+ np.einsum("ij,ij->i", p[:, 1] - p[:, 0], np.cross(p[:, 2] - p[:, 0], p[:, 3] - p[:, 0]))
29
+ )
30
+ / 6
31
+ )
32
+ solid = model["phase_ids"] == 1
33
+ n = config.resolution * config.cells[2]
34
+ z = np.clip(np.floor(p[:, :, 2].mean(axis=1) / config.size[2] * n).astype(int), 0, n - 1)
35
+ bins = np.bincount(z[solid], weights=v[solid], minlength=n)
36
+ expected = (config.density_start + config.density_end) / 2
37
+ result = dict(
38
+ family=config.family,
39
+ resolution=config.resolution,
40
+ target_average=expected,
41
+ mesh_density=float(v[solid].sum() / np.prod(config.size)),
42
+ slab_z_mm=((np.arange(n) + 0.5) * config.size[2] / n).tolist(),
43
+ slab_density=(bins / (np.prod(config.size) / n)).tolist(),
44
+ audit=audit_interface(model),
45
+ )
46
+ result["relative_target_deviation"] = (result["mesh_density"] - expected) / expected
47
+ return result
48
+
49
+
50
+ def field_reference(config, n):
51
+ # Independent midpoint integration of the unlinearized implicit field;
52
+ # it uses the same threshold calibration, not the tetrahedral mesh.
53
+ x = (np.arange(n) + 0.5) * config.size[0] / n
54
+ y = (np.arange(n) + 0.5) * config.size[1] / n
55
+ count = 0
56
+ for z in (np.arange(n) + 0.5) * config.size[2] / n:
57
+ count += np.count_nonzero(raw_field(config, x[:, None], y[None, :], z) >= 0)
58
+ return count / n**3
59
+
60
+
61
+ def main():
62
+ p = argparse.ArgumentParser()
63
+ p.add_argument("--source", type=Path)
64
+ p.add_argument("--out", type=Path, required=True)
65
+ args = p.parse_args()
66
+ args.out.mkdir(parents=True, exist_ok=False)
67
+ records = []
68
+ for family in ["Gyroid", "Primitive Schwartz", "Diamond"]:
69
+ c = Config(family=family, domain_mode="solid_fluid", resolution=12)
70
+ model = load_mesh(args.source / family.replace(" ", "_")) if args.source else generate(c)
71
+ r = geometry_record(model, c)
72
+ r["implicit_midpoint_128"] = field_reference(c, 128)
73
+ r["implicit_midpoint_256"] = field_reference(c, 256)
74
+ records.append(r)
75
+ for lo, hi in [(0.125, 0.375), (0.375, 0.625)]:
76
+ cc = replace(c, density_start=lo, density_end=hi)
77
+ m = generate(cc)
78
+ records.append(geometry_record(m, cc))
79
+ print("DENSITY", family, flush=True)
80
+ (args.out / "density_results.json").write_text(json.dumps(records, indent=2), "utf8")
81
+
82
+
83
+ if __name__ == "__main__":
84
+ main()