matterviz 0.3.6 → 0.4.0

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 (926) hide show
  1. package/dist/EmptyState.svelte.d.ts +9 -0
  2. package/dist/FilePicker.svelte +360 -0
  3. package/dist/FilePicker.svelte.d.ts +17 -0
  4. package/dist/Icon.svelte +44 -0
  5. package/dist/Icon.svelte.d.ts +13 -0
  6. package/dist/MillerIndexInput.svelte +66 -0
  7. package/dist/MillerIndexInput.svelte.d.ts +7 -0
  8. package/dist/api/mp.d.ts +6 -0
  9. package/dist/api/mp.js +22 -0
  10. package/dist/api/optimade.d.ts +45 -0
  11. package/dist/api/optimade.js +141 -0
  12. package/dist/app.css +244 -0
  13. package/dist/brillouin/BrillouinZone.svelte +554 -0
  14. package/dist/brillouin/BrillouinZone.svelte.d.ts +84 -0
  15. package/dist/brillouin/BrillouinZoneControls.svelte +144 -0
  16. package/dist/brillouin/BrillouinZoneControls.svelte.d.ts +17 -0
  17. package/dist/brillouin/BrillouinZoneExportPane.svelte +146 -0
  18. package/dist/brillouin/BrillouinZoneExportPane.svelte.d.ts +15 -0
  19. package/dist/brillouin/BrillouinZoneInfoPane.svelte +146 -0
  20. package/dist/brillouin/BrillouinZoneInfoPane.svelte.d.ts +13 -0
  21. package/dist/brillouin/BrillouinZoneScene.svelte +522 -0
  22. package/dist/brillouin/BrillouinZoneScene.svelte.d.ts +49 -0
  23. package/dist/brillouin/BrillouinZoneTooltip.svelte +83 -0
  24. package/dist/brillouin/BrillouinZoneTooltip.svelte.d.ts +8 -0
  25. package/dist/brillouin/compute.d.ts +17 -0
  26. package/dist/brillouin/compute.js +422 -0
  27. package/dist/brillouin/index.d.ts +8 -0
  28. package/dist/brillouin/index.js +7 -0
  29. package/dist/brillouin/types.d.ts +43 -0
  30. package/dist/brillouin/types.js +1 -0
  31. package/dist/chempot-diagram/ChemPotDiagram.svelte +328 -0
  32. package/dist/chempot-diagram/ChemPotDiagram.svelte.d.ts +13 -0
  33. package/dist/chempot-diagram/ChemPotDiagram2D.svelte +843 -0
  34. package/dist/chempot-diagram/ChemPotDiagram2D.svelte.d.ts +16 -0
  35. package/dist/chempot-diagram/ChemPotDiagram3D.svelte +3191 -0
  36. package/dist/chempot-diagram/ChemPotDiagram3D.svelte.d.ts +16 -0
  37. package/dist/chempot-diagram/ChemPotScene3D.svelte.d.ts +7 -0
  38. package/dist/chempot-diagram/async-compute.svelte.d.ts +3 -0
  39. package/dist/chempot-diagram/async-compute.svelte.js +80 -0
  40. package/dist/chempot-diagram/chempot-worker.d.ts +1 -0
  41. package/dist/chempot-diagram/chempot-worker.js +12 -0
  42. package/dist/chempot-diagram/color.d.ts +10 -0
  43. package/dist/chempot-diagram/color.js +32 -0
  44. package/dist/chempot-diagram/compute.d.ts +48 -0
  45. package/dist/chempot-diagram/compute.js +804 -0
  46. package/dist/chempot-diagram/index.d.ts +6 -0
  47. package/dist/chempot-diagram/index.js +6 -0
  48. package/dist/chempot-diagram/pointer.d.ts +16 -0
  49. package/dist/chempot-diagram/pointer.js +40 -0
  50. package/dist/chempot-diagram/temperature.d.ts +15 -0
  51. package/dist/chempot-diagram/temperature.js +34 -0
  52. package/dist/chempot-diagram/types.d.ts +81 -0
  53. package/dist/chempot-diagram/types.js +28 -0
  54. package/dist/colors/index.d.ts +47 -0
  55. package/dist/colors/index.js +204 -0
  56. package/dist/composition/BarChart.svelte +297 -0
  57. package/dist/composition/BarChart.svelte.d.ts +39 -0
  58. package/dist/composition/BubbleChart.svelte +218 -0
  59. package/dist/composition/BubbleChart.svelte.d.ts +28 -0
  60. package/dist/composition/Composition.svelte +165 -0
  61. package/dist/composition/Composition.svelte.d.ts +15 -0
  62. package/dist/composition/Formula.svelte +268 -0
  63. package/dist/composition/Formula.svelte.d.ts +19 -0
  64. package/dist/composition/FormulaFilter.svelte +1263 -0
  65. package/dist/composition/FormulaFilter.svelte.d.ts +51 -0
  66. package/dist/composition/PieChart.svelte +324 -0
  67. package/dist/composition/PieChart.svelte.d.ts +37 -0
  68. package/dist/composition/chem-sys.d.ts +8 -0
  69. package/dist/composition/chem-sys.js +85 -0
  70. package/dist/composition/format.d.ts +15 -0
  71. package/dist/composition/format.js +111 -0
  72. package/dist/composition/index.d.ts +21 -0
  73. package/dist/composition/index.js +15 -0
  74. package/dist/composition/parse.d.ts +56 -0
  75. package/dist/composition/parse.js +486 -0
  76. package/dist/constants.d.ts +29 -0
  77. package/dist/constants.js +99 -0
  78. package/dist/controls.d.ts +14 -0
  79. package/dist/controls.js +30 -0
  80. package/dist/convex-hull/ConvexHull.svelte +157 -0
  81. package/dist/convex-hull/ConvexHull.svelte.d.ts +13 -0
  82. package/dist/convex-hull/ConvexHull2D.svelte +827 -0
  83. package/dist/convex-hull/ConvexHull2D.svelte.d.ts +11 -0
  84. package/dist/convex-hull/ConvexHull3D.svelte +1801 -0
  85. package/dist/convex-hull/ConvexHull3D.svelte.d.ts +8 -0
  86. package/dist/convex-hull/ConvexHull4D.svelte +1394 -0
  87. package/dist/convex-hull/ConvexHull4D.svelte.d.ts +8 -0
  88. package/dist/convex-hull/ConvexHullControls.svelte +535 -0
  89. package/dist/convex-hull/ConvexHullControls.svelte.d.ts +48 -0
  90. package/dist/convex-hull/ConvexHullInfoPane.svelte +125 -0
  91. package/dist/convex-hull/ConvexHullInfoPane.svelte.d.ts +20 -0
  92. package/dist/convex-hull/ConvexHullStats.svelte +929 -0
  93. package/dist/convex-hull/ConvexHullStats.svelte.d.ts +17 -0
  94. package/dist/convex-hull/ConvexHullTooltip.svelte +131 -0
  95. package/dist/convex-hull/ConvexHullTooltip.svelte.d.ts +33 -0
  96. package/dist/convex-hull/GasPressureControls.svelte +247 -0
  97. package/dist/convex-hull/GasPressureControls.svelte.d.ts +11 -0
  98. package/dist/convex-hull/StructurePopup.svelte +151 -0
  99. package/dist/convex-hull/StructurePopup.svelte.d.ts +18 -0
  100. package/dist/convex-hull/TemperatureSlider.svelte +140 -0
  101. package/dist/convex-hull/TemperatureSlider.svelte.d.ts +8 -0
  102. package/dist/convex-hull/barycentric-coords.d.ts +18 -0
  103. package/dist/convex-hull/barycentric-coords.js +182 -0
  104. package/dist/convex-hull/demo-temperature.d.ts +6 -0
  105. package/dist/convex-hull/demo-temperature.js +38 -0
  106. package/dist/convex-hull/gas-thermodynamics.d.ts +16 -0
  107. package/dist/convex-hull/gas-thermodynamics.js +306 -0
  108. package/dist/convex-hull/helpers.d.ts +117 -0
  109. package/dist/convex-hull/helpers.js +718 -0
  110. package/dist/convex-hull/index.d.ts +119 -0
  111. package/dist/convex-hull/index.js +58 -0
  112. package/dist/convex-hull/thermodynamics.d.ts +67 -0
  113. package/dist/convex-hull/thermodynamics.js +1757 -0
  114. package/dist/convex-hull/types.d.ts +162 -0
  115. package/dist/convex-hull/types.js +36 -0
  116. package/dist/coordination/CoordinationBarPlot.svelte +311 -0
  117. package/dist/coordination/CoordinationBarPlot.svelte.d.ts +30 -0
  118. package/dist/coordination/calc-coordination.d.ts +15 -0
  119. package/dist/coordination/calc-coordination.js +63 -0
  120. package/dist/coordination/index.d.ts +8 -0
  121. package/dist/coordination/index.js +7 -0
  122. package/dist/effects.svelte.d.ts +12 -0
  123. package/dist/effects.svelte.js +37 -0
  124. package/dist/element/BohrAtom.svelte.d.ts +20 -0
  125. package/dist/element/ElementHeading.svelte +26 -0
  126. package/dist/element/ElementHeading.svelte.d.ts +8 -0
  127. package/dist/element/ElementPhoto.svelte +57 -0
  128. package/dist/element/ElementPhoto.svelte.d.ts +9 -0
  129. package/dist/element/ElementStats.svelte +80 -0
  130. package/dist/element/ElementStats.svelte.d.ts +8 -0
  131. package/dist/element/ElementTile.svelte +484 -0
  132. package/dist/element/ElementTile.svelte.d.ts +29 -0
  133. package/dist/element/Nucleus.svelte.d.ts +17 -0
  134. package/dist/element/data.d.ts +2 -0
  135. package/dist/element/data.js +2 -0
  136. package/dist/element/index.d.ts +8 -0
  137. package/dist/element/index.js +7 -0
  138. package/dist/element/types.d.ts +57 -0
  139. package/dist/element/types.js +1 -0
  140. package/dist/feedback/ClickFeedback.svelte +58 -0
  141. package/dist/feedback/ClickFeedback.svelte.d.ts +12 -0
  142. package/dist/feedback/DragOverlay.svelte +42 -0
  143. package/dist/feedback/DragOverlay.svelte.d.ts +7 -0
  144. package/dist/feedback/Spinner.svelte.d.ts +7 -0
  145. package/dist/feedback/StatusMessage.svelte.d.ts +9 -0
  146. package/dist/feedback/index.d.ts +4 -0
  147. package/dist/feedback/index.js +4 -0
  148. package/dist/fermi-surface/FermiSlice.svelte +197 -0
  149. package/dist/fermi-surface/FermiSlice.svelte.d.ts +24 -0
  150. package/dist/fermi-surface/FermiSurface.svelte +606 -0
  151. package/dist/fermi-surface/FermiSurface.svelte.d.ts +83 -0
  152. package/dist/fermi-surface/FermiSurfaceControls.svelte +448 -0
  153. package/dist/fermi-surface/FermiSurfaceControls.svelte.d.ts +35 -0
  154. package/dist/fermi-surface/FermiSurfaceScene.svelte +797 -0
  155. package/dist/fermi-surface/FermiSurfaceScene.svelte.d.ts +50 -0
  156. package/dist/fermi-surface/FermiSurfaceTooltip.svelte +85 -0
  157. package/dist/fermi-surface/FermiSurfaceTooltip.svelte.d.ts +8 -0
  158. package/dist/fermi-surface/compute.d.ts +5 -0
  159. package/dist/fermi-surface/compute.js +538 -0
  160. package/dist/fermi-surface/constants.d.ts +9 -0
  161. package/dist/fermi-surface/constants.js +27 -0
  162. package/dist/fermi-surface/export.d.ts +5 -0
  163. package/dist/fermi-surface/export.js +51 -0
  164. package/dist/fermi-surface/index.d.ts +12 -0
  165. package/dist/fermi-surface/index.js +13 -0
  166. package/dist/fermi-surface/marching-cubes.d.ts +2 -0
  167. package/dist/fermi-surface/marching-cubes.js +2 -0
  168. package/dist/fermi-surface/parse.d.ts +2 -0
  169. package/dist/fermi-surface/parse.js +494 -0
  170. package/dist/fermi-surface/symmetry.d.ts +3 -0
  171. package/dist/fermi-surface/symmetry.js +46 -0
  172. package/dist/fermi-surface/types.d.ts +111 -0
  173. package/dist/fermi-surface/types.js +4 -0
  174. package/dist/heatmap-matrix/HeatmapMatrix.svelte +1547 -0
  175. package/dist/heatmap-matrix/HeatmapMatrix.svelte.d.ts +110 -0
  176. package/dist/heatmap-matrix/HeatmapMatrixControls.svelte +225 -0
  177. package/dist/heatmap-matrix/HeatmapMatrixControls.svelte.d.ts +30 -0
  178. package/dist/heatmap-matrix/index.d.ts +53 -0
  179. package/dist/heatmap-matrix/index.js +100 -0
  180. package/dist/heatmap-matrix/shared.d.ts +2 -0
  181. package/dist/heatmap-matrix/shared.js +4 -0
  182. package/dist/icons.d.ts +569 -0
  183. package/dist/icons.js +648 -0
  184. package/dist/index.d.ts +39 -0
  185. package/dist/index.js +39 -0
  186. package/dist/io/decompress.d.ts +11 -0
  187. package/dist/io/decompress.js +76 -0
  188. package/dist/io/export.d.ts +16 -0
  189. package/dist/io/export.js +338 -0
  190. package/dist/io/fetch.d.ts +5 -0
  191. package/dist/io/fetch.js +43 -0
  192. package/dist/io/file-drop.d.ts +7 -0
  193. package/dist/io/file-drop.js +42 -0
  194. package/dist/io/index.d.ts +7 -0
  195. package/dist/io/index.js +6 -0
  196. package/dist/io/is-binary.d.ts +1 -0
  197. package/dist/io/is-binary.js +20 -0
  198. package/dist/io/types.d.ts +8 -0
  199. package/dist/io/types.js +1 -0
  200. package/dist/io/url-drop.d.ts +2 -0
  201. package/dist/io/url-drop.js +154 -0
  202. package/dist/isosurface/Isosurface.svelte +285 -0
  203. package/dist/isosurface/Isosurface.svelte.d.ts +8 -0
  204. package/dist/isosurface/IsosurfaceControls.svelte +277 -0
  205. package/dist/isosurface/IsosurfaceControls.svelte.d.ts +9 -0
  206. package/dist/isosurface/index.d.ts +5 -0
  207. package/dist/isosurface/index.js +6 -0
  208. package/dist/isosurface/parse.d.ts +6 -0
  209. package/dist/isosurface/parse.js +552 -0
  210. package/dist/isosurface/slice.d.ts +11 -0
  211. package/dist/isosurface/slice.js +141 -0
  212. package/dist/isosurface/types.d.ts +56 -0
  213. package/dist/isosurface/types.js +227 -0
  214. package/dist/keyboard.d.ts +3 -0
  215. package/dist/keyboard.js +23 -0
  216. package/dist/labels.d.ts +53 -0
  217. package/dist/labels.js +278 -0
  218. package/dist/layout/FullscreenToggle.svelte +50 -0
  219. package/dist/layout/FullscreenToggle.svelte.d.ts +7 -0
  220. package/dist/layout/InfoCard.svelte +120 -0
  221. package/dist/layout/InfoCard.svelte.d.ts +21 -0
  222. package/dist/layout/InfoTag.svelte +185 -0
  223. package/dist/layout/InfoTag.svelte.d.ts +19 -0
  224. package/dist/layout/PropertyFilter.svelte +247 -0
  225. package/dist/layout/PropertyFilter.svelte.d.ts +24 -0
  226. package/dist/layout/SettingsSection.svelte +148 -0
  227. package/dist/layout/SettingsSection.svelte.d.ts +17 -0
  228. package/dist/layout/SubpageGrid.svelte +82 -0
  229. package/dist/layout/SubpageGrid.svelte.d.ts +14 -0
  230. package/dist/layout/fullscreen.d.ts +9 -0
  231. package/dist/layout/fullscreen.js +53 -0
  232. package/dist/layout/index.d.ts +10 -0
  233. package/dist/layout/index.js +8 -0
  234. package/dist/layout/json-tree/JsonNode.svelte +548 -0
  235. package/dist/layout/json-tree/JsonNode.svelte.d.ts +11 -0
  236. package/dist/layout/json-tree/JsonTree.svelte +1230 -0
  237. package/dist/layout/json-tree/JsonTree.svelte.d.ts +6 -0
  238. package/dist/layout/json-tree/JsonValue.svelte.d.ts +9 -0
  239. package/dist/layout/json-tree/index.d.ts +3 -0
  240. package/dist/layout/json-tree/index.js +3 -0
  241. package/dist/layout/json-tree/types.d.ts +74 -0
  242. package/dist/layout/json-tree/types.js +2 -0
  243. package/dist/layout/json-tree/utils.d.ts +29 -0
  244. package/dist/layout/json-tree/utils.js +642 -0
  245. package/dist/marching-cubes.d.ts +14 -0
  246. package/dist/marching-cubes.js +535 -0
  247. package/dist/math.d.ts +105 -0
  248. package/dist/math.js +920 -0
  249. package/dist/overlays/ContextMenu.svelte +162 -0
  250. package/dist/overlays/ContextMenu.svelte.d.ts +25 -0
  251. package/dist/overlays/CopyButton.svelte +45 -0
  252. package/dist/overlays/CopyButton.svelte.d.ts +8 -0
  253. package/dist/overlays/DragControlTab.svelte +98 -0
  254. package/dist/overlays/DragControlTab.svelte.d.ts +8 -0
  255. package/dist/overlays/DraggablePane.svelte +487 -0
  256. package/dist/overlays/DraggablePane.svelte.d.ts +36 -0
  257. package/dist/overlays/InfoPaneCards.svelte +149 -0
  258. package/dist/overlays/InfoPaneCards.svelte.d.ts +22 -0
  259. package/dist/overlays/index.d.ts +3 -0
  260. package/dist/overlays/index.js +3 -0
  261. package/dist/periodic-table/PeriodicTable.svelte +480 -0
  262. package/dist/periodic-table/PeriodicTable.svelte.d.ts +55 -0
  263. package/dist/periodic-table/PeriodicTableControls.svelte +557 -0
  264. package/dist/periodic-table/PeriodicTableControls.svelte.d.ts +24 -0
  265. package/dist/periodic-table/PropertySelect.svelte +38 -0
  266. package/dist/periodic-table/PropertySelect.svelte.d.ts +13 -0
  267. package/dist/periodic-table/TableInset.svelte.d.ts +9 -0
  268. package/dist/periodic-table/index.d.ts +10 -0
  269. package/dist/periodic-table/index.js +4 -0
  270. package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte +1092 -0
  271. package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte.d.ts +44 -0
  272. package/dist/phase-diagram/PhaseDiagramControls.svelte +444 -0
  273. package/dist/phase-diagram/PhaseDiagramControls.svelte.d.ts +30 -0
  274. package/dist/phase-diagram/PhaseDiagramEditorPane.svelte +127 -0
  275. package/dist/phase-diagram/PhaseDiagramEditorPane.svelte.d.ts +15 -0
  276. package/dist/phase-diagram/PhaseDiagramExportPane.svelte +184 -0
  277. package/dist/phase-diagram/PhaseDiagramExportPane.svelte.d.ts +19 -0
  278. package/dist/phase-diagram/PhaseDiagramTooltip.svelte +391 -0
  279. package/dist/phase-diagram/PhaseDiagramTooltip.svelte.d.ts +16 -0
  280. package/dist/phase-diagram/TdbInfoPanel.svelte +203 -0
  281. package/dist/phase-diagram/TdbInfoPanel.svelte.d.ts +12 -0
  282. package/dist/phase-diagram/build-diagram.d.ts +11 -0
  283. package/dist/phase-diagram/build-diagram.js +160 -0
  284. package/dist/phase-diagram/colors.d.ts +35 -0
  285. package/dist/phase-diagram/colors.js +51 -0
  286. package/dist/phase-diagram/diagram-input.d.ts +29 -0
  287. package/dist/phase-diagram/diagram-input.js +3 -0
  288. package/dist/phase-diagram/index.d.ts +13 -0
  289. package/dist/phase-diagram/index.js +11 -0
  290. package/dist/phase-diagram/parse.d.ts +55 -0
  291. package/dist/phase-diagram/parse.js +273 -0
  292. package/dist/phase-diagram/svg-to-diagram.d.ts +2 -0
  293. package/dist/phase-diagram/svg-to-diagram.js +867 -0
  294. package/dist/phase-diagram/types.d.ts +93 -0
  295. package/dist/phase-diagram/types.js +1 -0
  296. package/dist/phase-diagram/utils.d.ts +118 -0
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  298. package/dist/plot/bar/BarPlot.svelte +1755 -0
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  300. package/dist/plot/bar/BarPlotControls.svelte +67 -0
  301. package/dist/plot/bar/BarPlotControls.svelte.d.ts +18 -0
  302. package/dist/plot/bar/SpacegroupBarPlot.svelte +293 -0
  303. package/dist/plot/bar/SpacegroupBarPlot.svelte.d.ts +9 -0
  304. package/dist/plot/bar/data.d.ts +40 -0
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  306. package/dist/plot/bar/geometry.d.ts +39 -0
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  308. package/dist/plot/bar/index.d.ts +3 -0
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  310. package/dist/plot/box/BoxPlot.svelte +1462 -0
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  312. package/dist/plot/box/BoxPlotControls.svelte +109 -0
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  314. package/dist/plot/box/Violin.svelte +14 -0
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  318. package/dist/plot/box/index.d.ts +5 -0
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  320. package/dist/plot/box/kde.d.ts +16 -0
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  322. package/dist/plot/box/quantile.d.ts +3 -0
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  324. package/dist/plot/core/auto-place.d.ts +43 -0
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  326. package/dist/plot/core/axis-utils.d.ts +46 -0
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  328. package/dist/plot/core/components/AxisLabel.svelte +51 -0
  329. package/dist/plot/core/components/AxisLabel.svelte.d.ts +16 -0
  330. package/dist/plot/core/components/ColorBar.svelte +724 -0
  331. package/dist/plot/core/components/ColorBar.svelte.d.ts +31 -0
  332. package/dist/plot/core/components/ColorScaleSelect.svelte +55 -0
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  334. package/dist/plot/core/components/ControlPane.svelte +46 -0
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@@ -1,614 +0,0 @@
1
- // Marching Cubes algorithm for isosurface extraction
2
- // Based on the classic algorithm by Lorensen & Cline (1987)
3
- import type { Matrix3x3, Vec3 } from '$lib/math'
4
-
5
- const wrap_grid_idx = (val: number, dim: number) => ((val % dim) + dim) % dim
6
- const clamp_grid_idx = (val: number, max: number) => Math.max(0, Math.min(val, max))
7
-
8
- // Edge table: for each cube configuration (256 cases), which edges are intersected
9
- // Each bit indicates whether that edge has an intersection
10
- // oxfmt-ignore
11
- const EDGE_TABLE: number[] = [
12
- 0x0, 0x109, 0x203, 0x30a, 0x406, 0x50f, 0x605, 0x70c, 0x80c, 0x905, 0xa0f, 0xb06, 0xc0a,
13
- 0xd03, 0xe09, 0xf00, 0x190, 0x99, 0x393, 0x29a, 0x596, 0x49f, 0x795, 0x69c, 0x99c,
14
- 0x895, 0xb9f, 0xa96, 0xd9a, 0xc93, 0xf99, 0xe90, 0x230, 0x339, 0x33, 0x13a, 0x636,
15
- 0x73f, 0x435, 0x53c, 0xa3c, 0xb35, 0x83f, 0x936, 0xe3a, 0xf33, 0xc39, 0xd30, 0x3a0,
16
- 0x2a9, 0x1a3, 0xaa, 0x7a6, 0x6af, 0x5a5, 0x4ac, 0xbac, 0xaa5, 0x9af, 0x8a6, 0xfaa,
17
- 0xea3, 0xda9, 0xca0, 0x460, 0x569, 0x663, 0x76a, 0x66, 0x16f, 0x265, 0x36c, 0xc6c,
18
- 0xd65, 0xe6f, 0xf66, 0x86a, 0x963, 0xa69, 0xb60, 0x5f0, 0x4f9, 0x7f3, 0x6fa, 0x1f6,
19
- 0xff, 0x3f5, 0x2fc, 0xdfc, 0xcf5, 0xfff, 0xef6, 0x9fa, 0x8f3, 0xbf9, 0xaf0, 0x650,
20
- 0x759, 0x453, 0x55a, 0x256, 0x35f, 0x55, 0x15c, 0xe5c, 0xf55, 0xc5f, 0xd56, 0xa5a,
21
- 0xb53, 0x859, 0x950, 0x7c0, 0x6c9, 0x5c3, 0x4ca, 0x3c6, 0x2cf, 0x1c5, 0xcc, 0xfcc,
22
- 0xec5, 0xdcf, 0xcc6, 0xbca, 0xac3, 0x9c9, 0x8c0, 0x8c0, 0x9c9, 0xac3, 0xbca, 0xcc6,
23
- 0xdcf, 0xec5, 0xfcc, 0xcc, 0x1c5, 0x2cf, 0x3c6, 0x4ca, 0x5c3, 0x6c9, 0x7c0, 0x950,
24
- 0x859, 0xb53, 0xa5a, 0xd56, 0xc5f, 0xf55, 0xe5c, 0x15c, 0x55, 0x35f, 0x256, 0x55a,
25
- 0x453, 0x759, 0x650, 0xaf0, 0xbf9, 0x8f3, 0x9fa, 0xef6, 0xfff, 0xcf5, 0xdfc, 0x2fc,
26
- 0x3f5, 0xff, 0x1f6, 0x6fa, 0x7f3, 0x4f9, 0x5f0, 0xb60, 0xa69, 0x963, 0x86a, 0xf66,
27
- 0xe6f, 0xd65, 0xc6c, 0x36c, 0x265, 0x16f, 0x66, 0x76a, 0x663, 0x569, 0x460, 0xca0,
28
- 0xda9, 0xea3, 0xfaa, 0x8a6, 0x9af, 0xaa5, 0xbac, 0x4ac, 0x5a5, 0x6af, 0x7a6, 0xaa,
29
- 0x1a3, 0x2a9, 0x3a0, 0xd30, 0xc39, 0xf33, 0xe3a, 0x936, 0x83f, 0xb35, 0xa3c, 0x53c,
30
- 0x435, 0x73f, 0x636, 0x13a, 0x33, 0x339, 0x230, 0xe90, 0xf99, 0xc93, 0xd9a, 0xa96,
31
- 0xb9f, 0x895, 0x99c, 0x69c, 0x795, 0x49f, 0x596, 0x29a, 0x393, 0x99, 0x190, 0xf00,
32
- 0xe09, 0xd03, 0xc0a, 0xb06, 0xa0f, 0x905, 0x80c, 0x70c, 0x605, 0x50f, 0x406, 0x30a,
33
- 0x203, 0x109, 0x0,
34
- ]
35
- // Triangle table: for each cube configuration, list of edge triplets forming triangles
36
- // -1 marks the end of the triangle list for that configuration
37
- const TRI_TABLE: number[][] = [
38
- [],
39
- [0, 8, 3],
40
- [0, 1, 9],
41
- [1, 8, 3, 9, 8, 1],
42
- [1, 2, 10],
43
- [0, 8, 3, 1, 2, 10],
44
- [9, 2, 10, 0, 2, 9],
45
- [2, 8, 3, 2, 10, 8, 10, 9, 8],
46
- [3, 11, 2],
47
- [0, 11, 2, 8, 11, 0],
48
- [1, 9, 0, 2, 3, 11],
49
- [1, 11, 2, 1, 9, 11, 9, 8, 11],
50
- [3, 10, 1, 11, 10, 3],
51
- [0, 10, 1, 0, 8, 10, 8, 11, 10],
52
- [3, 9, 0, 3, 11, 9, 11, 10, 9],
53
- [9, 8, 10, 10, 8, 11],
54
- [4, 7, 8],
55
- [4, 3, 0, 7, 3, 4],
56
- [0, 1, 9, 8, 4, 7],
57
- [4, 1, 9, 4, 7, 1, 7, 3, 1],
58
- [1, 2, 10, 8, 4, 7],
59
- [3, 4, 7, 3, 0, 4, 1, 2, 10],
60
- [9, 2, 10, 9, 0, 2, 8, 4, 7],
61
- [2, 10, 9, 2, 9, 7, 2, 7, 3, 7, 9, 4],
62
- [8, 4, 7, 3, 11, 2],
63
- [11, 4, 7, 11, 2, 4, 2, 0, 4],
64
- [9, 0, 1, 8, 4, 7, 2, 3, 11],
65
- [4, 7, 11, 9, 4, 11, 9, 11, 2, 9, 2, 1],
66
- [3, 10, 1, 3, 11, 10, 7, 8, 4],
67
- [1, 11, 10, 1, 4, 11, 1, 0, 4, 7, 11, 4],
68
- [4, 7, 8, 9, 0, 11, 9, 11, 10, 11, 0, 3],
69
- [4, 7, 11, 4, 11, 9, 9, 11, 10],
70
- [9, 5, 4],
71
- [9, 5, 4, 0, 8, 3],
72
- [0, 5, 4, 1, 5, 0],
73
- [8, 5, 4, 8, 3, 5, 3, 1, 5],
74
- [1, 2, 10, 9, 5, 4],
75
- [3, 0, 8, 1, 2, 10, 4, 9, 5],
76
- [5, 2, 10, 5, 4, 2, 4, 0, 2],
77
- [2, 10, 5, 3, 2, 5, 3, 5, 4, 3, 4, 8],
78
- [9, 5, 4, 2, 3, 11],
79
- [0, 11, 2, 0, 8, 11, 4, 9, 5],
80
- [0, 5, 4, 0, 1, 5, 2, 3, 11],
81
- [2, 1, 5, 2, 5, 8, 2, 8, 11, 4, 8, 5],
82
- [10, 3, 11, 10, 1, 3, 9, 5, 4],
83
- [4, 9, 5, 0, 8, 1, 8, 10, 1, 8, 11, 10],
84
- [5, 4, 0, 5, 0, 11, 5, 11, 10, 11, 0, 3],
85
- [5, 4, 8, 5, 8, 10, 10, 8, 11],
86
- [9, 7, 8, 5, 7, 9],
87
- [9, 3, 0, 9, 5, 3, 5, 7, 3],
88
- [0, 7, 8, 0, 1, 7, 1, 5, 7],
89
- [1, 5, 3, 3, 5, 7],
90
- [9, 7, 8, 9, 5, 7, 10, 1, 2],
91
- [10, 1, 2, 9, 5, 0, 5, 3, 0, 5, 7, 3],
92
- [8, 0, 2, 8, 2, 5, 8, 5, 7, 10, 5, 2],
93
- [2, 10, 5, 2, 5, 3, 3, 5, 7],
94
- [7, 9, 5, 7, 8, 9, 3, 11, 2],
95
- [9, 5, 7, 9, 7, 2, 9, 2, 0, 2, 7, 11],
96
- [2, 3, 11, 0, 1, 8, 1, 7, 8, 1, 5, 7],
97
- [11, 2, 1, 11, 1, 7, 7, 1, 5],
98
- [9, 5, 8, 8, 5, 7, 10, 1, 3, 10, 3, 11],
99
- [5, 7, 0, 5, 0, 9, 7, 11, 0, 1, 0, 10, 11, 10, 0],
100
- [11, 10, 0, 11, 0, 3, 10, 5, 0, 8, 0, 7, 5, 7, 0],
101
- [11, 10, 5, 7, 11, 5],
102
- [10, 6, 5],
103
- [0, 8, 3, 5, 10, 6],
104
- [9, 0, 1, 5, 10, 6],
105
- [1, 8, 3, 1, 9, 8, 5, 10, 6],
106
- [1, 6, 5, 2, 6, 1],
107
- [1, 6, 5, 1, 2, 6, 3, 0, 8],
108
- [9, 6, 5, 9, 0, 6, 0, 2, 6],
109
- [5, 9, 8, 5, 8, 2, 5, 2, 6, 3, 2, 8],
110
- [2, 3, 11, 10, 6, 5],
111
- [11, 0, 8, 11, 2, 0, 10, 6, 5],
112
- [0, 1, 9, 2, 3, 11, 5, 10, 6],
113
- [5, 10, 6, 1, 9, 2, 9, 11, 2, 9, 8, 11],
114
- [6, 3, 11, 6, 5, 3, 5, 1, 3],
115
- [0, 8, 11, 0, 11, 5, 0, 5, 1, 5, 11, 6],
116
- [3, 11, 6, 0, 3, 6, 0, 6, 5, 0, 5, 9],
117
- [6, 5, 9, 6, 9, 11, 11, 9, 8],
118
- [5, 10, 6, 4, 7, 8],
119
- [4, 3, 0, 4, 7, 3, 6, 5, 10],
120
- [1, 9, 0, 5, 10, 6, 8, 4, 7],
121
- [10, 6, 5, 1, 9, 7, 1, 7, 3, 7, 9, 4],
122
- [6, 1, 2, 6, 5, 1, 4, 7, 8],
123
- [1, 2, 5, 5, 2, 6, 3, 0, 4, 3, 4, 7],
124
- [8, 4, 7, 9, 0, 5, 0, 6, 5, 0, 2, 6],
125
- [7, 3, 9, 7, 9, 4, 3, 2, 9, 5, 9, 6, 2, 6, 9],
126
- [3, 11, 2, 7, 8, 4, 10, 6, 5],
127
- [5, 10, 6, 4, 7, 2, 4, 2, 0, 2, 7, 11],
128
- [0, 1, 9, 4, 7, 8, 2, 3, 11, 5, 10, 6],
129
- [9, 2, 1, 9, 11, 2, 9, 4, 11, 7, 11, 4, 5, 10, 6],
130
- [8, 4, 7, 3, 11, 5, 3, 5, 1, 5, 11, 6],
131
- [5, 1, 11, 5, 11, 6, 1, 0, 11, 7, 11, 4, 0, 4, 11],
132
- [0, 5, 9, 0, 6, 5, 0, 3, 6, 11, 6, 3, 8, 4, 7],
133
- [6, 5, 9, 6, 9, 11, 4, 7, 9, 7, 11, 9],
134
- [10, 4, 9, 6, 4, 10],
135
- [4, 10, 6, 4, 9, 10, 0, 8, 3],
136
- [10, 0, 1, 10, 6, 0, 6, 4, 0],
137
- [8, 3, 1, 8, 1, 6, 8, 6, 4, 6, 1, 10],
138
- [1, 4, 9, 1, 2, 4, 2, 6, 4],
139
- [3, 0, 8, 1, 2, 9, 2, 4, 9, 2, 6, 4],
140
- [0, 2, 4, 4, 2, 6],
141
- [8, 3, 2, 8, 2, 4, 4, 2, 6],
142
- [10, 4, 9, 10, 6, 4, 11, 2, 3],
143
- [0, 8, 2, 2, 8, 11, 4, 9, 10, 4, 10, 6],
144
- [3, 11, 2, 0, 1, 6, 0, 6, 4, 6, 1, 10],
145
- [6, 4, 1, 6, 1, 10, 4, 8, 1, 2, 1, 11, 8, 11, 1],
146
- [9, 6, 4, 9, 3, 6, 9, 1, 3, 11, 6, 3],
147
- [8, 11, 1, 8, 1, 0, 11, 6, 1, 9, 1, 4, 6, 4, 1],
148
- [3, 11, 6, 3, 6, 0, 0, 6, 4],
149
- [6, 4, 8, 11, 6, 8],
150
- [7, 10, 6, 7, 8, 10, 8, 9, 10],
151
- [0, 7, 3, 0, 10, 7, 0, 9, 10, 6, 7, 10],
152
- [10, 6, 7, 1, 10, 7, 1, 7, 8, 1, 8, 0],
153
- [10, 6, 7, 10, 7, 1, 1, 7, 3],
154
- [1, 2, 6, 1, 6, 8, 1, 8, 9, 8, 6, 7],
155
- [2, 6, 9, 2, 9, 1, 6, 7, 9, 0, 9, 3, 7, 3, 9],
156
- [7, 8, 0, 7, 0, 6, 6, 0, 2],
157
- [7, 3, 2, 6, 7, 2],
158
- [2, 3, 11, 10, 6, 8, 10, 8, 9, 8, 6, 7],
159
- [2, 0, 7, 2, 7, 11, 0, 9, 7, 6, 7, 10, 9, 10, 7],
160
- [1, 8, 0, 1, 7, 8, 1, 10, 7, 6, 7, 10, 2, 3, 11],
161
- [11, 2, 1, 11, 1, 7, 10, 6, 1, 6, 7, 1],
162
- [8, 9, 6, 8, 6, 7, 9, 1, 6, 11, 6, 3, 1, 3, 6],
163
- [0, 9, 1, 11, 6, 7],
164
- [7, 8, 0, 7, 0, 6, 3, 11, 0, 11, 6, 0],
165
- [7, 11, 6],
166
- [7, 6, 11],
167
- [3, 0, 8, 11, 7, 6],
168
- [0, 1, 9, 11, 7, 6],
169
- [8, 1, 9, 8, 3, 1, 11, 7, 6],
170
- [10, 1, 2, 6, 11, 7],
171
- [1, 2, 10, 3, 0, 8, 6, 11, 7],
172
- [2, 9, 0, 2, 10, 9, 6, 11, 7],
173
- [6, 11, 7, 2, 10, 3, 10, 8, 3, 10, 9, 8],
174
- [7, 2, 3, 6, 2, 7],
175
- [7, 0, 8, 7, 6, 0, 6, 2, 0],
176
- [2, 7, 6, 2, 3, 7, 0, 1, 9],
177
- [1, 6, 2, 1, 8, 6, 1, 9, 8, 8, 7, 6],
178
- [10, 7, 6, 10, 1, 7, 1, 3, 7],
179
- [10, 7, 6, 1, 7, 10, 1, 8, 7, 1, 0, 8],
180
- [0, 3, 7, 0, 7, 10, 0, 10, 9, 6, 10, 7],
181
- [7, 6, 10, 7, 10, 8, 8, 10, 9],
182
- [6, 8, 4, 11, 8, 6],
183
- [3, 6, 11, 3, 0, 6, 0, 4, 6],
184
- [8, 6, 11, 8, 4, 6, 9, 0, 1],
185
- [9, 4, 6, 9, 6, 3, 9, 3, 1, 11, 3, 6],
186
- [6, 8, 4, 6, 11, 8, 2, 10, 1],
187
- [1, 2, 10, 3, 0, 11, 0, 6, 11, 0, 4, 6],
188
- [4, 11, 8, 4, 6, 11, 0, 2, 9, 2, 10, 9],
189
- [10, 9, 3, 10, 3, 2, 9, 4, 3, 11, 3, 6, 4, 6, 3],
190
- [8, 2, 3, 8, 4, 2, 4, 6, 2],
191
- [0, 4, 2, 4, 6, 2],
192
- [1, 9, 0, 2, 3, 4, 2, 4, 6, 4, 3, 8],
193
- [1, 9, 4, 1, 4, 2, 2, 4, 6],
194
- [8, 1, 3, 8, 6, 1, 8, 4, 6, 6, 10, 1],
195
- [10, 1, 0, 10, 0, 6, 6, 0, 4],
196
- [4, 6, 3, 4, 3, 8, 6, 10, 3, 0, 3, 9, 10, 9, 3],
197
- [10, 9, 4, 6, 10, 4],
198
- [4, 9, 5, 7, 6, 11],
199
- [0, 8, 3, 4, 9, 5, 11, 7, 6],
200
- [5, 0, 1, 5, 4, 0, 7, 6, 11],
201
- [11, 7, 6, 8, 3, 4, 3, 5, 4, 3, 1, 5],
202
- [9, 5, 4, 10, 1, 2, 7, 6, 11],
203
- [6, 11, 7, 1, 2, 10, 0, 8, 3, 4, 9, 5],
204
- [7, 6, 11, 5, 4, 10, 4, 2, 10, 4, 0, 2],
205
- [3, 4, 8, 3, 5, 4, 3, 2, 5, 10, 5, 2, 11, 7, 6],
206
- [7, 2, 3, 7, 6, 2, 5, 4, 9],
207
- [9, 5, 4, 0, 8, 6, 0, 6, 2, 6, 8, 7],
208
- [3, 6, 2, 3, 7, 6, 1, 5, 0, 5, 4, 0],
209
- [6, 2, 8, 6, 8, 7, 2, 1, 8, 4, 8, 5, 1, 5, 8],
210
- [9, 5, 4, 10, 1, 6, 1, 7, 6, 1, 3, 7],
211
- [1, 6, 10, 1, 7, 6, 1, 0, 7, 8, 7, 0, 9, 5, 4],
212
- [4, 0, 10, 4, 10, 5, 0, 3, 10, 6, 10, 7, 3, 7, 10],
213
- [7, 6, 10, 7, 10, 8, 5, 4, 10, 4, 8, 10],
214
- [6, 9, 5, 6, 11, 9, 11, 8, 9],
215
- [3, 6, 11, 0, 6, 3, 0, 5, 6, 0, 9, 5],
216
- [0, 11, 8, 0, 5, 11, 0, 1, 5, 5, 6, 11],
217
- [6, 11, 3, 6, 3, 5, 5, 3, 1],
218
- [1, 2, 10, 9, 5, 11, 9, 11, 8, 11, 5, 6],
219
- [0, 11, 3, 0, 6, 11, 0, 9, 6, 5, 6, 9, 1, 2, 10],
220
- [11, 8, 5, 11, 5, 6, 8, 0, 5, 10, 5, 2, 0, 2, 5],
221
- [6, 11, 3, 6, 3, 5, 2, 10, 3, 10, 5, 3],
222
- [5, 8, 9, 5, 2, 8, 5, 6, 2, 3, 8, 2],
223
- [9, 5, 6, 9, 6, 0, 0, 6, 2],
224
- [1, 5, 8, 1, 8, 0, 5, 6, 8, 3, 8, 2, 6, 2, 8],
225
- [1, 5, 6, 2, 1, 6],
226
- [1, 3, 6, 1, 6, 10, 3, 8, 6, 5, 6, 9, 8, 9, 6],
227
- [10, 1, 0, 10, 0, 6, 9, 5, 0, 5, 6, 0],
228
- [0, 3, 8, 5, 6, 10],
229
- [10, 5, 6],
230
- [11, 5, 10, 7, 5, 11],
231
- [11, 5, 10, 11, 7, 5, 8, 3, 0],
232
- [5, 11, 7, 5, 10, 11, 1, 9, 0],
233
- [10, 7, 5, 10, 11, 7, 9, 8, 1, 8, 3, 1],
234
- [11, 1, 2, 11, 7, 1, 7, 5, 1],
235
- [0, 8, 3, 1, 2, 7, 1, 7, 5, 7, 2, 11],
236
- [9, 7, 5, 9, 2, 7, 9, 0, 2, 2, 11, 7],
237
- [7, 5, 2, 7, 2, 11, 5, 9, 2, 3, 2, 8, 9, 8, 2],
238
- [2, 5, 10, 2, 3, 5, 3, 7, 5],
239
- [8, 2, 0, 8, 5, 2, 8, 7, 5, 10, 2, 5],
240
- [9, 0, 1, 5, 10, 3, 5, 3, 7, 3, 10, 2],
241
- [9, 8, 2, 9, 2, 1, 8, 7, 2, 10, 2, 5, 7, 5, 2],
242
- [1, 3, 5, 3, 7, 5],
243
- [0, 8, 7, 0, 7, 1, 1, 7, 5],
244
- [9, 0, 3, 9, 3, 5, 5, 3, 7],
245
- [9, 8, 7, 5, 9, 7],
246
- [5, 8, 4, 5, 10, 8, 10, 11, 8],
247
- [5, 0, 4, 5, 11, 0, 5, 10, 11, 11, 3, 0],
248
- [0, 1, 9, 8, 4, 10, 8, 10, 11, 10, 4, 5],
249
- [10, 11, 4, 10, 4, 5, 11, 3, 4, 9, 4, 1, 3, 1, 4],
250
- [2, 5, 1, 2, 8, 5, 2, 11, 8, 4, 5, 8],
251
- [0, 4, 11, 0, 11, 3, 4, 5, 11, 2, 11, 1, 5, 1, 11],
252
- [0, 2, 5, 0, 5, 9, 2, 11, 5, 4, 5, 8, 11, 8, 5],
253
- [9, 4, 5, 2, 11, 3],
254
- [2, 5, 10, 3, 5, 2, 3, 4, 5, 3, 8, 4],
255
- [5, 10, 2, 5, 2, 4, 4, 2, 0],
256
- [3, 10, 2, 3, 5, 10, 3, 8, 5, 4, 5, 8, 0, 1, 9],
257
- [5, 10, 2, 5, 2, 4, 1, 9, 2, 9, 4, 2],
258
- [8, 4, 5, 8, 5, 3, 3, 5, 1],
259
- [0, 4, 5, 1, 0, 5],
260
- [8, 4, 5, 8, 5, 3, 9, 0, 5, 0, 3, 5],
261
- [9, 4, 5],
262
- [4, 11, 7, 4, 9, 11, 9, 10, 11],
263
- [0, 8, 3, 4, 9, 7, 9, 11, 7, 9, 10, 11],
264
- [1, 10, 11, 1, 11, 4, 1, 4, 0, 7, 4, 11],
265
- [3, 1, 4, 3, 4, 8, 1, 10, 4, 7, 4, 11, 10, 11, 4],
266
- [4, 11, 7, 9, 11, 4, 9, 2, 11, 9, 1, 2],
267
- [9, 7, 4, 9, 11, 7, 9, 1, 11, 2, 11, 1, 0, 8, 3],
268
- [11, 7, 4, 11, 4, 2, 2, 4, 0],
269
- [11, 7, 4, 11, 4, 2, 8, 3, 4, 3, 2, 4],
270
- [2, 9, 10, 2, 7, 9, 2, 3, 7, 7, 4, 9],
271
- [9, 10, 7, 9, 7, 4, 10, 2, 7, 8, 7, 0, 2, 0, 7],
272
- [3, 7, 10, 3, 10, 2, 7, 4, 10, 1, 10, 0, 4, 0, 10],
273
- [1, 10, 2, 8, 7, 4],
274
- [4, 9, 1, 4, 1, 7, 7, 1, 3],
275
- [4, 9, 1, 4, 1, 7, 0, 8, 1, 8, 7, 1],
276
- [4, 0, 3, 7, 4, 3],
277
- [4, 8, 7],
278
- [9, 10, 8, 10, 11, 8],
279
- [3, 0, 9, 3, 9, 11, 11, 9, 10],
280
- [0, 1, 10, 0, 10, 8, 8, 10, 11],
281
- [3, 1, 10, 11, 3, 10],
282
- [1, 2, 11, 1, 11, 9, 9, 11, 8],
283
- [3, 0, 9, 3, 9, 11, 1, 2, 9, 2, 11, 9],
284
- [0, 2, 11, 8, 0, 11],
285
- [3, 2, 11],
286
- [2, 3, 8, 2, 8, 10, 10, 8, 9],
287
- [9, 10, 2, 0, 9, 2],
288
- [2, 3, 8, 2, 8, 10, 0, 1, 8, 1, 10, 8],
289
- [1, 10, 2],
290
- [1, 3, 8, 9, 1, 8],
291
- [0, 9, 1],
292
- [0, 3, 8],
293
- [],
294
- ]
295
-
296
- // Vertex positions for the 8 corners of a unit cube - flat arrays for speed
297
- // Format: [x0,y0,z0, x1,y1,z1, ...] - access as CUBE_VERTS_X[i], etc.
298
- const CUBE_VERTS_X = new Int8Array([0, 1, 1, 0, 0, 1, 1, 0])
299
- const CUBE_VERTS_Y = new Int8Array([0, 0, 1, 1, 0, 0, 1, 1])
300
- const CUBE_VERTS_Z = new Int8Array([0, 0, 0, 0, 1, 1, 1, 1])
301
-
302
- // Edge definitions: pairs of vertex indices for each of 12 edges
303
- // Flattened for direct access: edge i has vertices EDGE_V1[i] and EDGE_V2[i]
304
- const EDGE_V1 = new Uint8Array([0, 1, 2, 3, 4, 5, 6, 7, 0, 1, 2, 3])
305
- const EDGE_V2 = new Uint8Array([1, 2, 3, 0, 5, 6, 7, 4, 4, 5, 6, 7])
306
-
307
- export interface MarchingCubesResult {
308
- vertices: Vec3[]
309
- faces: number[][] // triangles as arrays of 3 vertex indices
310
- normals: Vec3[]
311
- }
312
-
313
- export interface MarchingCubesOptions {
314
- // Whether to apply periodic boundary conditions (wrap around grid edges)
315
- periodic?: boolean
316
- // Interpolation for smoother surfaces (linear interpolation on edges)
317
- interpolate?: boolean
318
- // Whether to center the grid at the origin (shift by -0.5 in fractional coords)
319
- // Default true for proper Brillouin zone visualization centered at Γ point
320
- centered?: boolean
321
- // Whether to compute per-vertex normals via central differences on the grid.
322
- // Default true. Set false to skip (caller can use geometry.computeVertexNormals() instead).
323
- normals?: boolean
324
- }
325
-
326
- // Compute gradient (normal) at a grid point using central differences
327
- function compute_gradient(
328
- grid: number[][][],
329
- ix: number,
330
- iy: number,
331
- iz: number,
332
- nx: number,
333
- ny: number,
334
- nz: number,
335
- periodic: boolean,
336
- ): Vec3 {
337
- // Wrap for periodic, clamp for non-periodic boundaries
338
- const [ix_w, iy_w, iz_w] = periodic
339
- ? [wrap_grid_idx(ix, nx), wrap_grid_idx(iy, ny), wrap_grid_idx(iz, nz)]
340
- : [clamp_grid_idx(ix, nx - 1), clamp_grid_idx(iy, ny - 1), clamp_grid_idx(iz, nz - 1)]
341
- const [ix_m, ix_p] = periodic
342
- ? [wrap_grid_idx(ix - 1, nx), wrap_grid_idx(ix + 1, nx)]
343
- : [Math.max(0, ix - 1), Math.min(nx - 1, ix + 1)]
344
- const [iy_m, iy_p] = periodic
345
- ? [wrap_grid_idx(iy - 1, ny), wrap_grid_idx(iy + 1, ny)]
346
- : [Math.max(0, iy - 1), Math.min(ny - 1, iy + 1)]
347
- const [iz_m, iz_p] = periodic
348
- ? [wrap_grid_idx(iz - 1, nz), wrap_grid_idx(iz + 1, nz)]
349
- : [Math.max(0, iz - 1), Math.min(nz - 1, iz + 1)]
350
-
351
- const dx = (grid[ix_p][iy_w][iz_w] - grid[ix_m][iy_w][iz_w]) * 0.5
352
- const dy = (grid[ix_w][iy_p][iz_w] - grid[ix_w][iy_m][iz_w]) * 0.5
353
- const dz = (grid[ix_w][iy_w][iz_p] - grid[ix_w][iy_w][iz_m]) * 0.5
354
-
355
- const len_sq = dx * dx + dy * dy + dz * dz
356
- if (len_sq < 1e-20) return [0, 0, 1]
357
- const inv_len = 1 / Math.sqrt(len_sq)
358
- return [-dx * inv_len, -dy * inv_len, -dz * inv_len]
359
- }
360
-
361
- // Main marching cubes algorithm (optimized version)
362
- export function marching_cubes(
363
- grid: number[][][],
364
- iso_value: number,
365
- k_lattice: Matrix3x3,
366
- options: MarchingCubesOptions = {},
367
- ): MarchingCubesResult {
368
- const {
369
- periodic = true,
370
- interpolate = true,
371
- centered = true,
372
- normals: compute_norms = true,
373
- } = options
374
- // When centered=true, shift fractional coordinates by -0.5 so the grid is
375
- // centered at the origin (Γ point). This is needed for proper BZ visualization.
376
- const center_offset = centered ? 0.5 : 0
377
-
378
- const nx = grid.length
379
- const ny = grid[0]?.length || 0
380
- const nz = grid[0]?.[0]?.length || 0
381
-
382
- if (nx < 2 || ny < 2 || nz < 2) {
383
- return { vertices: [], faces: [], normals: [] }
384
- }
385
-
386
- const vertices: Vec3[] = []
387
- const faces: number[][] = []
388
- const normals: Vec3[] = []
389
-
390
- // Precompute grid dimension products for flattening and cache keys
391
- const ny_nz = ny * nz
392
- const max_flat = nx * ny_nz // for computing cache keys
393
- // Use numeric cache key - safe for grids up to ~300³ (2^53 / 2 / max_flat)
394
- // For much larger grids (>30M cells), consider switching to Map<string, number>
395
- // with keys like `${flat1},${flat2}` or Map<bigint, number> to avoid
396
- // Number.MAX_SAFE_INTEGER limits. The current approach is faster for typical grids.
397
- if (max_flat > 30_000_000) {
398
- console.warn(`Grid size ${nx}×${ny}×${nz} may cause cache key overflow`)
399
- }
400
- const vertex_cache = new Map<number, number>()
401
-
402
- // Precompute k_lattice values for faster coordinate transform
403
- const [kx0, kx1, kx2] = k_lattice[0]
404
- const [ky0, ky1, ky2] = k_lattice[1]
405
- const [kz0, kz1, kz2] = k_lattice[2]
406
-
407
- // Precompute inverse grid sizes for fractional coordinate conversion.
408
- // Non-periodic grids: n points span [0,1] with spacing 1/(n-1) — endpoints at 0 and 1.
409
- // Periodic grids: n points span [0,1) with spacing 1/n — point n wraps back to 0.
410
- const inv_nx = 1 / (periodic ? nx : nx - 1)
411
- const inv_ny = 1 / (periodic ? ny : ny - 1)
412
- const inv_nz = 1 / (periodic ? nz : nz - 1)
413
-
414
- // Get or create vertex on an edge (fully optimized with flat array lookups)
415
- const get_vertex_on_edge = (
416
- ix: number,
417
- iy: number,
418
- iz: number,
419
- edge_idx: number,
420
- cube_values: number[],
421
- ): number => {
422
- // Use flat arrays instead of destructuring
423
- const v1_idx = EDGE_V1[edge_idx]
424
- const v2_idx = EDGE_V2[edge_idx]
425
- const ox1 = CUBE_VERTS_X[v1_idx]
426
- const oy1 = CUBE_VERTS_Y[v1_idx]
427
- const oz1 = CUBE_VERTS_Z[v1_idx]
428
- const ox2 = CUBE_VERTS_X[v2_idx]
429
- const oy2 = CUBE_VERTS_Y[v2_idx]
430
- const oz2 = CUBE_VERTS_Z[v2_idx]
431
-
432
- // Compute wrapped grid positions using safe modulo for periodic boundaries
433
- const g1x = periodic ? wrap_grid_idx(ix + ox1, nx) : ix + ox1
434
- const g1y = periodic ? wrap_grid_idx(iy + oy1, ny) : iy + oy1
435
- const g1z = periodic ? wrap_grid_idx(iz + oz1, nz) : iz + oz1
436
- const g2x = periodic ? wrap_grid_idx(ix + ox2, nx) : ix + ox2
437
- const g2y = periodic ? wrap_grid_idx(iy + oy2, ny) : iy + oy2
438
- const g2z = periodic ? wrap_grid_idx(iz + oz2, nz) : iz + oz2
439
-
440
- // Create numeric cache key (sorted for consistency)
441
- // Safe for grids up to ~300³ before exceeding Number.MAX_SAFE_INTEGER
442
- const flat1 = g1x * ny_nz + g1y * nz + g1z
443
- const flat2 = g2x * ny_nz + g2y * nz + g2z
444
- const cache_key = flat1 < flat2 ? flat1 * max_flat + flat2 : flat2 * max_flat + flat1
445
-
446
- const cached = vertex_cache.get(cache_key)
447
- if (cached !== undefined) return cached
448
-
449
- // Compute vertex position
450
- const v1 = cube_values[v1_idx]
451
- const v2 = cube_values[v2_idx]
452
-
453
- let fx: number, fy: number, fz: number
454
- if (interpolate) {
455
- const f1x = (ix + ox1) * inv_nx - center_offset
456
- const f1y = (iy + oy1) * inv_ny - center_offset
457
- const f1z = (iz + oz1) * inv_nz - center_offset
458
- const f2x = (ix + ox2) * inv_nx - center_offset
459
- const f2y = (iy + oy2) * inv_ny - center_offset
460
- const f2z = (iz + oz2) * inv_nz - center_offset
461
- const dv = v2 - v1
462
- if (Math.abs(dv) < 1e-10) {
463
- fx = f1x
464
- fy = f1y
465
- fz = f1z
466
- } else {
467
- const lerp = (iso_value - v1) / dv
468
- fx = f1x + lerp * (f2x - f1x)
469
- fy = f1y + lerp * (f2y - f1y)
470
- fz = f1z + lerp * (f2z - f1z)
471
- }
472
- } else {
473
- fx = (ix + (ox1 + ox2) * 0.5) * inv_nx - center_offset
474
- fy = (iy + (oy1 + oy2) * 0.5) * inv_ny - center_offset
475
- fz = (iz + (oz1 + oz2) * 0.5) * inv_nz - center_offset
476
- }
477
-
478
- // Transform to Cartesian (inlined)
479
- const vert_idx = vertices.length
480
- vertices.push([
481
- fx * kx0 + fy * ky0 + fz * kz0,
482
- fx * kx1 + fy * ky1 + fz * kz1,
483
- fx * kx2 + fy * ky2 + fz * kz2,
484
- ])
485
-
486
- // Compute normal from grid gradient (skip if caller will compute from geometry)
487
- if (compute_norms) {
488
- normals.push(compute_gradient(grid, ix + ox1, iy + oy1, iz + oz1, nx, ny, nz, periodic))
489
- }
490
-
491
- vertex_cache.set(cache_key, vert_idx)
492
- return vert_idx
493
- }
494
-
495
- // Iterate over all cubes in the grid
496
- const max_x = periodic ? nx : nx - 1
497
- const max_y = periodic ? ny : ny - 1
498
- const max_z = periodic ? nz : nz - 1
499
-
500
- // Preallocate cube_values array (reuse across iterations)
501
- const cube_values: number[] = Array(8)
502
-
503
- for (let ix = 0; ix < max_x; ix++) {
504
- const ix_row = grid[ix]
505
- const ix1_row = grid[(ix + 1) % nx]
506
-
507
- for (let iy = 0; iy < max_y; iy++) {
508
- const iy_col = ix_row[iy]
509
- const iy1_col = ix_row[(iy + 1) % ny]
510
- const ix1_iy_col = ix1_row[iy]
511
- const ix1_iy1_col = ix1_row[(iy + 1) % ny]
512
-
513
- for (let iz = 0; iz < max_z; iz++) {
514
- const iz1 = (iz + 1) % nz
515
-
516
- // Get corner values (inlined for speed)
517
- cube_values[0] = iy_col[iz]
518
- cube_values[1] = ix1_iy_col[iz]
519
- cube_values[2] = ix1_iy1_col[iz]
520
- cube_values[3] = iy1_col[iz]
521
- cube_values[4] = iy_col[iz1]
522
- cube_values[5] = ix1_iy_col[iz1]
523
- cube_values[6] = ix1_iy1_col[iz1]
524
- cube_values[7] = iy1_col[iz1]
525
-
526
- // Compute cube index (unrolled for speed)
527
- let cube_index = 0
528
- if (cube_values[0] < iso_value) cube_index |= 1
529
- if (cube_values[1] < iso_value) cube_index |= 2
530
- if (cube_values[2] < iso_value) cube_index |= 4
531
- if (cube_values[3] < iso_value) cube_index |= 8
532
- if (cube_values[4] < iso_value) cube_index |= 16
533
- if (cube_values[5] < iso_value) cube_index |= 32
534
- if (cube_values[6] < iso_value) cube_index |= 64
535
- if (cube_values[7] < iso_value) cube_index |= 128
536
-
537
- // Skip if cube is entirely inside or outside
538
- if (EDGE_TABLE[cube_index] === 0) continue
539
-
540
- // Get triangles for this cube configuration
541
- const tri_list = TRI_TABLE[cube_index]
542
- const tri_len = tri_list.length
543
-
544
- // Create triangles
545
- for (let tri_idx = 0; tri_idx < tri_len; tri_idx += 3) {
546
- const v0 = get_vertex_on_edge(ix, iy, iz, tri_list[tri_idx], cube_values)
547
- const v1 = get_vertex_on_edge(ix, iy, iz, tri_list[tri_idx + 1], cube_values)
548
- const v2 = get_vertex_on_edge(ix, iy, iz, tri_list[tri_idx + 2], cube_values)
549
-
550
- // Skip degenerate triangles
551
- if (v0 !== v1 && v1 !== v2 && v0 !== v2) {
552
- faces.push([v0, v1, v2])
553
- }
554
- }
555
- }
556
- }
557
- }
558
-
559
- return { vertices, faces, normals }
560
- }
561
-
562
- // Compute per-vertex normals from faces using area-weighted averaging
563
- // Uses fan triangulation for N-gon faces (quads, etc.)
564
- export function compute_vertex_normals(vertices: Vec3[], faces: number[][]): Vec3[] {
565
- const normals: Vec3[] = vertices.map(() => [0, 0, 0])
566
- for (const face of faces) {
567
- // Validate face has at least 3 indices and all are within bounds
568
- if (face.length < 3) continue
569
- if (face.some((idx) => idx < 0 || idx >= vertices.length)) continue
570
-
571
- // Fan triangulation: for N vertices, process N-2 triangles (0,1,2), (0,2,3), ...
572
- const v0 = vertices[face[0]]
573
- for (let fan_idx = 1; fan_idx < face.length - 1; fan_idx++) {
574
- const idx1 = face[fan_idx]
575
- const idx2 = face[fan_idx + 1]
576
- const v1 = vertices[idx1]
577
- const v2 = vertices[idx2]
578
-
579
- // Edge vectors
580
- const e1: Vec3 = [v1[0] - v0[0], v1[1] - v0[1], v1[2] - v0[2]]
581
- const e2: Vec3 = [v2[0] - v0[0], v2[1] - v0[1], v2[2] - v0[2]]
582
-
583
- // Cross product (face normal * 2 * area)
584
- const normal: Vec3 = [
585
- e1[1] * e2[2] - e1[2] * e2[1],
586
- e1[2] * e2[0] - e1[0] * e2[2],
587
- e1[0] * e2[1] - e1[1] * e2[0],
588
- ]
589
-
590
- // Add to the 3 vertices of this triangle
591
- normals[face[0]][0] += normal[0]
592
- normals[face[0]][1] += normal[1]
593
- normals[face[0]][2] += normal[2]
594
- normals[idx1][0] += normal[0]
595
- normals[idx1][1] += normal[1]
596
- normals[idx1][2] += normal[2]
597
- normals[idx2][0] += normal[0]
598
- normals[idx2][1] += normal[1]
599
- normals[idx2][2] += normal[2]
600
- }
601
- }
602
-
603
- // Normalize all normals
604
- for (const normal of normals) {
605
- const len = Math.hypot(normal[0], normal[1], normal[2])
606
- if (len > 0) {
607
- normal[0] /= len
608
- normal[1] /= len
609
- normal[2] /= len
610
- }
611
- }
612
-
613
- return normals
614
- }