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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  671. package/dist/src/lib/element/ElementHeading.svelte +0 -26
  672. package/dist/src/lib/element/ElementPhoto.svelte +0 -57
  673. package/dist/src/lib/element/ElementStats.svelte +0 -80
  674. package/dist/src/lib/element/ElementTile.svelte +0 -484
  675. package/dist/src/lib/element/data.ts +0 -14
  676. package/dist/src/lib/element/index.ts +0 -8
  677. package/dist/src/lib/element/types.ts +0 -62
  678. package/dist/src/lib/feedback/ClickFeedback.svelte +0 -58
  679. package/dist/src/lib/feedback/DragOverlay.svelte +0 -42
  680. package/dist/src/lib/feedback/index.ts +0 -4
  681. package/dist/src/lib/fermi-surface/FermiSlice.svelte +0 -189
  682. package/dist/src/lib/fermi-surface/FermiSurface.svelte +0 -600
  683. package/dist/src/lib/fermi-surface/FermiSurfaceControls.svelte +0 -448
  684. package/dist/src/lib/fermi-surface/FermiSurfaceScene.svelte +0 -794
  685. package/dist/src/lib/fermi-surface/FermiSurfaceTooltip.svelte +0 -111
  686. package/dist/src/lib/fermi-surface/compute.ts +0 -728
  687. package/dist/src/lib/fermi-surface/constants.ts +0 -32
  688. package/dist/src/lib/fermi-surface/export.ts +0 -64
  689. package/dist/src/lib/fermi-surface/index.ts +0 -14
  690. package/dist/src/lib/fermi-surface/marching-cubes.ts +0 -3
  691. package/dist/src/lib/fermi-surface/parse.ts +0 -574
  692. package/dist/src/lib/fermi-surface/symmetry.ts +0 -56
  693. package/dist/src/lib/fermi-surface/types.ts +0 -159
  694. package/dist/src/lib/heatmap-matrix/HeatmapMatrix.svelte +0 -1545
  695. package/dist/src/lib/heatmap-matrix/HeatmapMatrixControls.svelte +0 -225
  696. package/dist/src/lib/heatmap-matrix/index.ts +0 -167
  697. package/dist/src/lib/heatmap-matrix/shared.ts +0 -7
  698. package/dist/src/lib/icons.ts +0 -650
  699. package/dist/src/lib/index.ts +0 -61
  700. package/dist/src/lib/io/decompress.ts +0 -92
  701. package/dist/src/lib/io/export.ts +0 -385
  702. package/dist/src/lib/io/fetch.ts +0 -46
  703. package/dist/src/lib/io/file-drop.ts +0 -51
  704. package/dist/src/lib/io/index.ts +0 -7
  705. package/dist/src/lib/io/is-binary.ts +0 -24
  706. package/dist/src/lib/io/types.ts +0 -8
  707. package/dist/src/lib/io/url-drop.ts +0 -141
  708. package/dist/src/lib/isosurface/Isosurface.svelte +0 -285
  709. package/dist/src/lib/isosurface/IsosurfaceControls.svelte +0 -277
  710. package/dist/src/lib/isosurface/index.ts +0 -7
  711. package/dist/src/lib/isosurface/parse.ts +0 -656
  712. package/dist/src/lib/isosurface/slice.ts +0 -175
  713. package/dist/src/lib/isosurface/types.ts +0 -309
  714. package/dist/src/lib/labels.ts +0 -320
  715. package/dist/src/lib/layout/FullscreenToggle.svelte +0 -50
  716. package/dist/src/lib/layout/InfoCard.svelte +0 -120
  717. package/dist/src/lib/layout/InfoTag.svelte +0 -185
  718. package/dist/src/lib/layout/PropertyFilter.svelte +0 -246
  719. package/dist/src/lib/layout/SettingsSection.svelte +0 -148
  720. package/dist/src/lib/layout/SubpageGrid.svelte +0 -82
  721. package/dist/src/lib/layout/fullscreen.ts +0 -65
  722. package/dist/src/lib/layout/index.ts +0 -11
  723. package/dist/src/lib/layout/json-tree/JsonNode.svelte +0 -548
  724. package/dist/src/lib/layout/json-tree/JsonTree.svelte +0 -1230
  725. package/dist/src/lib/layout/json-tree/index.ts +0 -3
  726. package/dist/src/lib/layout/json-tree/types.ts +0 -126
  727. package/dist/src/lib/layout/json-tree/utils.ts +0 -682
  728. package/dist/src/lib/marching-cubes.ts +0 -614
  729. package/dist/src/lib/math.ts +0 -1081
  730. package/dist/src/lib/overlays/ContextMenu.svelte +0 -162
  731. package/dist/src/lib/overlays/CopyButton.svelte +0 -45
  732. package/dist/src/lib/overlays/DragControlTab.svelte +0 -98
  733. package/dist/src/lib/overlays/DraggablePane.svelte +0 -487
  734. package/dist/src/lib/overlays/InfoPaneCards.svelte +0 -149
  735. package/dist/src/lib/overlays/index.ts +0 -3
  736. package/dist/src/lib/periodic-table/PeriodicTable.svelte +0 -469
  737. package/dist/src/lib/periodic-table/PeriodicTableControls.svelte +0 -557
  738. package/dist/src/lib/periodic-table/PropertySelect.svelte +0 -37
  739. package/dist/src/lib/periodic-table/index.ts +0 -12
  740. package/dist/src/lib/phase-diagram/IsobaricBinaryPhaseDiagram.svelte +0 -1086
  741. package/dist/src/lib/phase-diagram/PhaseDiagramControls.svelte +0 -444
  742. package/dist/src/lib/phase-diagram/PhaseDiagramEditorPane.svelte +0 -126
  743. package/dist/src/lib/phase-diagram/PhaseDiagramExportPane.svelte +0 -184
  744. package/dist/src/lib/phase-diagram/PhaseDiagramTooltip.svelte +0 -391
  745. package/dist/src/lib/phase-diagram/TdbInfoPanel.svelte +0 -203
  746. package/dist/src/lib/phase-diagram/build-diagram.ts +0 -186
  747. package/dist/src/lib/phase-diagram/colors.ts +0 -58
  748. package/dist/src/lib/phase-diagram/diagram-input.ts +0 -40
  749. package/dist/src/lib/phase-diagram/index.ts +0 -13
  750. package/dist/src/lib/phase-diagram/parse.ts +0 -348
  751. package/dist/src/lib/phase-diagram/svg-to-diagram.ts +0 -1023
  752. package/dist/src/lib/phase-diagram/types.ts +0 -144
  753. package/dist/src/lib/phase-diagram/utils.ts +0 -775
  754. package/dist/src/lib/plot/AxisLabel.svelte +0 -51
  755. package/dist/src/lib/plot/BarPlot.svelte +0 -2113
  756. package/dist/src/lib/plot/BarPlotControls.svelte +0 -66
  757. package/dist/src/lib/plot/BinnedScatterPlot.svelte +0 -1114
  758. package/dist/src/lib/plot/ColorBar.svelte +0 -721
  759. package/dist/src/lib/plot/ColorScaleSelect.svelte +0 -54
  760. package/dist/src/lib/plot/ElementScatter.svelte +0 -63
  761. package/dist/src/lib/plot/FillArea.svelte +0 -223
  762. package/dist/src/lib/plot/Histogram.svelte +0 -1558
  763. package/dist/src/lib/plot/HistogramControls.svelte +0 -212
  764. package/dist/src/lib/plot/InteractiveAxisLabel.svelte +0 -96
  765. package/dist/src/lib/plot/Line.svelte +0 -84
  766. package/dist/src/lib/plot/PlotAxis.svelte +0 -169
  767. package/dist/src/lib/plot/PlotControls.svelte +0 -537
  768. package/dist/src/lib/plot/PlotLegend.svelte +0 -569
  769. package/dist/src/lib/plot/PlotTooltip.svelte +0 -67
  770. package/dist/src/lib/plot/PortalSelect.svelte +0 -253
  771. package/dist/src/lib/plot/ReferenceLine.svelte +0 -204
  772. package/dist/src/lib/plot/ReferenceLine3D.svelte +0 -156
  773. package/dist/src/lib/plot/ReferencePlane.svelte +0 -175
  774. package/dist/src/lib/plot/ScatterPlot.svelte +0 -2778
  775. package/dist/src/lib/plot/ScatterPlot3D.svelte +0 -529
  776. package/dist/src/lib/plot/ScatterPlot3DControls.svelte +0 -437
  777. package/dist/src/lib/plot/ScatterPlot3DScene.svelte +0 -912
  778. package/dist/src/lib/plot/ScatterPlotControls.svelte +0 -306
  779. package/dist/src/lib/plot/ScatterPoint.svelte +0 -182
  780. package/dist/src/lib/plot/SpacegroupBarPlot.svelte +0 -293
  781. package/dist/src/lib/plot/Surface3D.svelte +0 -197
  782. package/dist/src/lib/plot/ZeroLines.svelte +0 -97
  783. package/dist/src/lib/plot/ZoomRect.svelte +0 -23
  784. package/dist/src/lib/plot/adaptive-density.ts +0 -316
  785. package/dist/src/lib/plot/auto-place.ts +0 -184
  786. package/dist/src/lib/plot/axis-utils.ts +0 -122
  787. package/dist/src/lib/plot/binned-scatter-types.ts +0 -83
  788. package/dist/src/lib/plot/data-cleaning.ts +0 -1069
  789. package/dist/src/lib/plot/data-transform.ts +0 -69
  790. package/dist/src/lib/plot/defaults.ts +0 -9
  791. package/dist/src/lib/plot/fill-utils.ts +0 -494
  792. package/dist/src/lib/plot/hover-lock.svelte.ts +0 -60
  793. package/dist/src/lib/plot/index.ts +0 -53
  794. package/dist/src/lib/plot/interactions.ts +0 -119
  795. package/dist/src/lib/plot/layout.ts +0 -425
  796. package/dist/src/lib/plot/reference-line.ts +0 -426
  797. package/dist/src/lib/plot/scales.ts +0 -654
  798. package/dist/src/lib/plot/svg.ts +0 -23
  799. package/dist/src/lib/plot/types.ts +0 -1144
  800. package/dist/src/lib/plot/utils/label-placement.ts +0 -541
  801. package/dist/src/lib/plot/utils/series-visibility.ts +0 -140
  802. package/dist/src/lib/plot/utils.ts +0 -11
  803. package/dist/src/lib/rdf/RdfPlot.svelte +0 -247
  804. package/dist/src/lib/rdf/calc-rdf.ts +0 -167
  805. package/dist/src/lib/rdf/index.ts +0 -27
  806. package/dist/src/lib/sanitize.ts +0 -126
  807. package/dist/src/lib/settings.ts +0 -1479
  808. package/dist/src/lib/spectral/Bands.svelte +0 -1040
  809. package/dist/src/lib/spectral/BandsAndDos.svelte +0 -134
  810. package/dist/src/lib/spectral/BrillouinBandsDos.svelte +0 -252
  811. package/dist/src/lib/spectral/Dos.svelte +0 -697
  812. package/dist/src/lib/spectral/helpers.ts +0 -1381
  813. package/dist/src/lib/spectral/index.ts +0 -8
  814. package/dist/src/lib/spectral/types.ts +0 -112
  815. package/dist/src/lib/state.svelte.ts +0 -64
  816. package/dist/src/lib/structure/Arrow.svelte +0 -72
  817. package/dist/src/lib/structure/AtomLegend.svelte +0 -815
  818. package/dist/src/lib/structure/Bond.svelte +0 -140
  819. package/dist/src/lib/structure/CanvasTooltip.svelte +0 -33
  820. package/dist/src/lib/structure/CellSelect.svelte +0 -349
  821. package/dist/src/lib/structure/Cylinder.svelte +0 -45
  822. package/dist/src/lib/structure/Lattice.svelte +0 -196
  823. package/dist/src/lib/structure/Structure.svelte +0 -2248
  824. package/dist/src/lib/structure/StructureControls.svelte +0 -1273
  825. package/dist/src/lib/structure/StructureExportPane.svelte +0 -252
  826. package/dist/src/lib/structure/StructureInfoPane.svelte +0 -737
  827. package/dist/src/lib/structure/StructureScene.svelte +0 -2255
  828. package/dist/src/lib/structure/atom-properties.ts +0 -316
  829. package/dist/src/lib/structure/bond-order-perception.ts +0 -447
  830. package/dist/src/lib/structure/bonding.ts +0 -944
  831. package/dist/src/lib/structure/export.ts +0 -861
  832. package/dist/src/lib/structure/index.ts +0 -291
  833. package/dist/src/lib/structure/label-placement.ts +0 -130
  834. package/dist/src/lib/structure/measure.ts +0 -45
  835. package/dist/src/lib/structure/parse.ts +0 -1705
  836. package/dist/src/lib/structure/partial-occupancy.ts +0 -183
  837. package/dist/src/lib/structure/pbc.ts +0 -164
  838. package/dist/src/lib/structure/supercell.ts +0 -226
  839. package/dist/src/lib/structure/validation.ts +0 -11
  840. package/dist/src/lib/symmetry/SymmetryStats.svelte +0 -226
  841. package/dist/src/lib/symmetry/WyckoffTable.svelte +0 -120
  842. package/dist/src/lib/symmetry/cell-transform.ts +0 -118
  843. package/dist/src/lib/symmetry/index.ts +0 -348
  844. package/dist/src/lib/symmetry/spacegroups.ts +0 -404
  845. package/dist/src/lib/table/HeatmapTable.svelte +0 -1833
  846. package/dist/src/lib/table/ToggleMenu.svelte +0 -385
  847. package/dist/src/lib/table/index.ts +0 -139
  848. package/dist/src/lib/theme/ThemeControl.svelte +0 -53
  849. package/dist/src/lib/theme/index.ts +0 -107
  850. package/dist/src/lib/time.ts +0 -71
  851. package/dist/src/lib/tooltip/TooltipContent.svelte +0 -58
  852. package/dist/src/lib/tooltip/index.ts +0 -2
  853. package/dist/src/lib/tooltip/types.ts +0 -13
  854. package/dist/src/lib/trajectory/Trajectory.svelte +0 -1545
  855. package/dist/src/lib/trajectory/TrajectoryError.svelte +0 -128
  856. package/dist/src/lib/trajectory/TrajectoryExportPane.svelte +0 -357
  857. package/dist/src/lib/trajectory/TrajectoryInfoPane.svelte +0 -313
  858. package/dist/src/lib/trajectory/constants.ts +0 -7
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  860. package/dist/src/lib/trajectory/format-detect.ts +0 -96
  861. package/dist/src/lib/trajectory/frame-reader.ts +0 -456
  862. package/dist/src/lib/trajectory/helpers.ts +0 -217
  863. package/dist/src/lib/trajectory/index.ts +0 -218
  864. package/dist/src/lib/trajectory/parse/ase.ts +0 -109
  865. package/dist/src/lib/trajectory/parse/hdf5.ts +0 -173
  866. package/dist/src/lib/trajectory/parse/index.ts +0 -411
  867. package/dist/src/lib/trajectory/parse/lammps.ts +0 -215
  868. package/dist/src/lib/trajectory/parse/vasp.ts +0 -102
  869. package/dist/src/lib/trajectory/parse/xyz.ts +0 -143
  870. package/dist/src/lib/trajectory/plotting.ts +0 -599
  871. package/dist/src/lib/trajectory/types.ts +0 -13
  872. package/dist/src/lib/utils.ts +0 -56
  873. package/dist/src/lib/xrd/XrdPlot.svelte +0 -615
  874. package/dist/src/lib/xrd/broadening.ts +0 -130
  875. package/dist/src/lib/xrd/calc-xrd.ts +0 -397
  876. package/dist/src/lib/xrd/index.ts +0 -38
  877. package/dist/src/lib/xrd/parse.ts +0 -858
  878. package/dist/webview.js +0 -29421
  879. package/icon.png +0 -0
  880. package/matterviz-0.3.2.vsix +0 -0
  881. package/matterviz-0.3.4.vsix +0 -0
  882. package/matterviz-0.3.5.vsix +0 -0
  883. package/scripts/sync-config.ts +0 -101
  884. package/src/declarations.d.ts +0 -2
  885. package/src/extension.ts +0 -972
  886. package/src/node-io.ts +0 -65
  887. package/src/types.ts +0 -17
  888. package/src/webview/JsonBrowser.svelte +0 -1079
  889. package/src/webview/PlotPanel.svelte +0 -346
  890. package/src/webview/detect.ts +0 -444
  891. package/src/webview/main.ts +0 -764
  892. package/src/webview/plot-utils.ts +0 -250
  893. package/test-fixtures/all-viz-types.json.gz +0 -0
  894. package/test-fixtures/plot-demo-data.json.gz +0 -0
  895. package/tests/detect.test.ts +0 -604
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  905. package/vite.extension.config.ts +0 -34
  906. /package/dist/{src/lib/EmptyState.svelte → EmptyState.svelte} +0 -0
  907. /package/dist/{src/lib/chempot-diagram → chempot-diagram}/ChemPotScene3D.svelte +0 -0
  908. /package/dist/{src/lib/colors → colors}/alloy-colors.json +0 -0
  909. /package/dist/{src/lib/colors → colors}/dark-mode-colors.json +0 -0
  910. /package/dist/{src/lib/colors → colors}/jmol-colors.json +0 -0
  911. /package/dist/{src/lib/colors → colors}/muted-colors.json +0 -0
  912. /package/dist/{src/lib/colors → colors}/pastel-colors.json +0 -0
  913. /package/dist/{src/lib/colors → colors}/vesta-colors.json +0 -0
  914. /package/dist/{src/lib/element → element}/BohrAtom.svelte +0 -0
  915. /package/dist/{src/lib/element → element}/Nucleus.svelte +0 -0
  916. /package/dist/{src/lib/element → element}/data.json +0 -0
  917. /package/dist/{src/lib/element → element}/data.json.gz +0 -0
  918. /package/dist/{src/lib/element → element}/data.json.gz.d.ts +0 -0
  919. /package/dist/{src/lib/element → element}/data.schema.json +0 -0
  920. /package/dist/{src/lib/element-image-urls.json → element-image-urls.json} +0 -0
  921. /package/dist/{src/lib/feedback → feedback}/Spinner.svelte +0 -0
  922. /package/dist/{src/lib/feedback → feedback}/StatusMessage.svelte +0 -0
  923. /package/dist/{src/lib/layout → layout}/json-tree/JsonValue.svelte +0 -0
  924. /package/dist/{src/lib/periodic-table → periodic-table}/TableInset.svelte +0 -0
  925. /package/dist/{src/lib/theme → theme}/themes.mjs +0 -0
  926. /package/dist/{src/lib/xrd → xrd}/atomic_scattering_params.json +0 -0
@@ -0,0 +1,827 @@
1
+ <script lang="ts">
2
+ import type { D3InterpolateName } from '../colors'
3
+ import type { CompositionType } from '../composition'
4
+ import { normalize_show_controls } from '../controls'
5
+ import { sanitize_html } from '../sanitize'
6
+ import type { ElementSymbol } from '../element'
7
+ import { ClickFeedback, DragOverlay } from '../feedback'
8
+ import Icon from '../Icon.svelte'
9
+ import type { D3SymbolName } from '../labels'
10
+ import { symbol_map } from '../labels'
11
+ import { set_fullscreen_bg, setup_fullscreen_effect } from '../layout'
12
+ import type {
13
+ AxisConfig,
14
+ PointStyle,
15
+ ScatterHandlerEvent,
16
+ ScatterHandlerProps,
17
+ UserContentProps,
18
+ } from '../plot'
19
+ import { ScatterPlot } from '../plot'
20
+ import { DEFAULTS } from '../settings'
21
+ import type { AnyStructure } from '../structure'
22
+ import { SvelteMap } from 'svelte/reactivity'
23
+ import ConvexHullControls from './ConvexHullControls.svelte'
24
+ import ConvexHullInfoPane from './ConvexHullInfoPane.svelte'
25
+ import ConvexHullTooltip from './ConvexHullTooltip.svelte'
26
+ import GasPressureControls from './GasPressureControls.svelte'
27
+ import * as helpers from './helpers'
28
+ import type { BaseConvexHullProps } from './index'
29
+ import { CONVEX_HULL_STYLE, default_controls, default_hull_config } from './index'
30
+ import StructurePopup from './StructurePopup.svelte'
31
+ import TemperatureSlider from './TemperatureSlider.svelte'
32
+ import * as thermo from './thermodynamics'
33
+ import type {
34
+ ConvexHullEntry,
35
+ HighlightStyle,
36
+ HoverData3D,
37
+ PhaseData,
38
+ } from './types'
39
+ import { compute_hull_stability, is_unary_entry } from './helpers'
40
+
41
+ // Binary convex hull rendered as energy vs composition (x in [0, 1])
42
+ let {
43
+ entries = [],
44
+ controls = {},
45
+ config = {},
46
+ on_point_click,
47
+ on_point_hover,
48
+ fullscreen = $bindable(DEFAULTS.convex_hull.binary.fullscreen),
49
+ enable_info_pane = true,
50
+ wrapper = $bindable(),
51
+ label_threshold = 50,
52
+ show_stable = $bindable(DEFAULTS.convex_hull.binary.show_stable),
53
+ show_unstable = $bindable(DEFAULTS.convex_hull.binary.show_unstable),
54
+ color_mode = $bindable(DEFAULTS.convex_hull.binary.color_mode),
55
+ color_scale = $bindable(
56
+ DEFAULTS.convex_hull.binary.color_scale as D3InterpolateName,
57
+ ),
58
+ info_pane_open = $bindable(DEFAULTS.convex_hull.binary.info_pane_open),
59
+ legend_pane_open = $bindable(DEFAULTS.convex_hull.binary.legend_pane_open),
60
+ max_hull_dist_show_phases = $bindable(
61
+ DEFAULTS.convex_hull.binary.max_hull_dist_show_phases,
62
+ ),
63
+ max_hull_dist_show_labels = $bindable(
64
+ DEFAULTS.convex_hull.binary.max_hull_dist_show_labels,
65
+ ),
66
+ show_stable_labels = $bindable(DEFAULTS.convex_hull.binary.show_stable_labels),
67
+ show_unstable_labels = $bindable(
68
+ DEFAULTS.convex_hull.binary.show_unstable_labels,
69
+ ),
70
+ on_file_drop,
71
+ enable_click_selection = true,
72
+ enable_structure_preview = true,
73
+ energy_source_mode = $bindable(`precomputed`),
74
+ phase_stats = $bindable(null),
75
+ display = $bindable({ x_grid: false, y_grid: false }),
76
+ stable_entries = $bindable([]),
77
+ unstable_entries = $bindable([]),
78
+ highlighted_entries = $bindable([]),
79
+ highlight_style = {},
80
+ x_axis = {},
81
+ y_axis = {},
82
+ selected_entry = $bindable(null),
83
+ temperature = $bindable(),
84
+ interpolate_temperature = true,
85
+ max_interpolation_gap = 500,
86
+ gas_config,
87
+ gas_pressures = $bindable({}),
88
+ children,
89
+ tooltip: custom_tooltip,
90
+ ...rest
91
+ }: BaseConvexHullProps<ConvexHullEntry> & {
92
+ highlight_style?: HighlightStyle
93
+ x_axis?: AxisConfig
94
+ y_axis?: AxisConfig
95
+ } = $props()
96
+
97
+ const merged_controls = $derived({ ...default_controls, ...controls })
98
+ const controls_config = $derived(normalize_show_controls(merged_controls.show))
99
+ const merged_config = $derived({
100
+ ...default_hull_config,
101
+ point_size: 6, // Binary diagrams use slightly smaller points
102
+ ...config,
103
+ colors: { ...default_hull_config.colors, ...config.colors },
104
+ margin: { t: 40, r: 40, b: 60, l: 60, ...config.margin },
105
+ })
106
+
107
+ // Merge highlight style with defaults (consistent with 3D/4D)
108
+ const merged_highlight_style = $derived(
109
+ helpers.merge_highlight_style(highlight_style),
110
+ )
111
+
112
+ // Helper to check if entry is highlighted
113
+ const is_highlighted = (entry: ConvexHullEntry): boolean =>
114
+ helpers.is_entry_highlighted(entry, highlighted_entries)
115
+
116
+ // Temperature-dependent free energy support
117
+ const { has_temp_data, available_temperatures } = $derived(
118
+ helpers.analyze_temperature_data(entries),
119
+ )
120
+
121
+ // Initialize or reset temperature when it's undefined or no longer valid
122
+ $effect(() => {
123
+ if (
124
+ has_temp_data &&
125
+ available_temperatures.length > 0 &&
126
+ (temperature === undefined || !available_temperatures.includes(temperature))
127
+ ) temperature = available_temperatures[0]
128
+ })
129
+
130
+ // Filter entries by temperature when in temperature mode
131
+ const temp_filtered_entries = $derived(
132
+ has_temp_data && temperature !== undefined
133
+ ? helpers.filter_entries_at_temperature(entries, temperature, {
134
+ interpolate: interpolate_temperature,
135
+ max_interpolation_gap,
136
+ })
137
+ : entries,
138
+ )
139
+
140
+ // Gas-dependent chemical potential support (corrections based on T, P)
141
+ const {
142
+ entries: gas_corrected_entries,
143
+ analysis: gas_analysis,
144
+ merged_config: merged_gas_config,
145
+ } = $derived(
146
+ helpers.get_gas_corrected_entries(
147
+ temp_filtered_entries,
148
+ gas_config,
149
+ gas_pressures,
150
+ temperature ?? helpers.DEFAULT_GAS_TEMP,
151
+ ),
152
+ )
153
+
154
+ let { // Compute energy mode information
155
+ has_precomputed_e_form,
156
+ has_precomputed_hull,
157
+ can_compute_e_form,
158
+ can_compute_hull,
159
+ energy_mode,
160
+ unary_refs,
161
+ } = $derived(
162
+ helpers.compute_energy_mode_info(
163
+ gas_corrected_entries,
164
+ thermo.find_lowest_energy_unary_refs,
165
+ energy_source_mode,
166
+ ),
167
+ )
168
+
169
+ const effective_entries = $derived(
170
+ helpers.get_effective_entries(
171
+ gas_corrected_entries,
172
+ energy_mode,
173
+ unary_refs,
174
+ thermo.compute_e_form_per_atom,
175
+ ),
176
+ )
177
+
178
+ // Process data and element set
179
+ const pd_data = $derived(thermo.process_hull_entries(effective_entries))
180
+
181
+ const polymorph_stats_map = $derived(
182
+ helpers.compute_all_polymorph_stats(effective_entries),
183
+ ) // Pre-compute polymorph stats once for O(1) tooltip lookups
184
+
185
+ const elements = $derived.by(() => {
186
+ if (pd_data.elements.length > 2) {
187
+ console.error(
188
+ `ConvexHull2D: Dataset contains ${pd_data.elements.length} elements, but binary diagrams require exactly 2. Found: [${
189
+ pd_data.elements.join(`, `)
190
+ }]`,
191
+ )
192
+ return []
193
+ }
194
+ return pd_data.elements
195
+ })
196
+
197
+ // Coordinate computation ----------------------------------------------------
198
+ function compute_binary_coordinates(
199
+ raw_entries: PhaseData[],
200
+ elems: ElementSymbol[],
201
+ ): ConvexHullEntry[] {
202
+ if (elems.length !== 2) return []
203
+ const [el1, el2] = elems
204
+ const coords: ConvexHullEntry[] = []
205
+ for (const entry of raw_entries) {
206
+ // Require formation energy per atom to place along y
207
+ const e_form = entry.e_form_per_atom
208
+ if (typeof e_form !== `number`) continue
209
+ const total = Object.values(entry.composition).reduce((sum, amount) => sum + amount, 0)
210
+ if (total <= 0) continue
211
+ const frac_b = (entry.composition[el2] || 0) / total
212
+ const is_element = is_unary_entry(entry)
213
+ coords.push({ ...entry, x: frac_b, y: e_form, z: 0, is_element })
214
+ }
215
+ // Ensure elemental references at x=0 and x=1 with y=0 to close the hull
216
+ for (const [element, x_coord] of [
217
+ [el1, 0],
218
+ [el2, 1],
219
+ ] as const) {
220
+ if (coords.some((entry) => entry.is_element && entry.x === x_coord)) continue
221
+ coords.push({
222
+ composition: { [element]: 1 } as CompositionType,
223
+ energy: 0,
224
+ entry_id: `synthetic-element:${element}`,
225
+ x: x_coord,
226
+ y: 0,
227
+ z: 0,
228
+ is_element: true,
229
+ })
230
+ }
231
+ return coords
232
+ }
233
+
234
+ const coords_entries = $derived.by(() => {
235
+ if (elements.length !== 2) return []
236
+ try {
237
+ return compute_binary_coordinates(pd_data.entries, elements)
238
+ } catch (error) {
239
+ console.error(`Error computing binary coordinates:`, error)
240
+ return []
241
+ }
242
+ })
243
+
244
+ // Compute hull and enrich entries with e_above_hull (before filtering)
245
+ const { all_enriched_entries, hull_points } = $derived.by(() => {
246
+ if (coords_entries.length === 0) {
247
+ return { all_enriched_entries: [], hull_points: [] }
248
+ }
249
+
250
+ // Build lower hull input: one minimum-energy point per composition x.
251
+ // Excluded entries don't participate in hull construction.
252
+ const min_y_by_x = new SvelteMap<number, number>()
253
+ for (const entry of coords_entries) {
254
+ if (entry.exclude_from_hull) continue
255
+ const current_min_y = min_y_by_x.get(entry.x)
256
+ if (current_min_y === undefined || entry.y < current_min_y) {
257
+ min_y_by_x.set(entry.x, entry.y)
258
+ }
259
+ }
260
+
261
+ const hull_input = [...min_y_by_x].map(([x_coord, min_y]) => ({
262
+ x: x_coord,
263
+ y: min_y,
264
+ }))
265
+ const computed_hull_points = thermo.compute_lower_hull_2d(hull_input)
266
+
267
+ const enriched_entries = coords_entries.map((entry) => {
268
+ const y_hull = thermo.interpolate_hull_2d(computed_hull_points, entry.x)
269
+ const raw_dist = y_hull == null ? 0 : entry.y - y_hull
270
+ return { ...entry, ...compute_hull_stability(raw_dist, entry.exclude_from_hull) }
271
+ })
272
+ return { all_enriched_entries: enriched_entries, hull_points: computed_hull_points }
273
+ })
274
+
275
+ // Auto threshold: show all for few entries, use default for many, interpolate between
276
+ const max_hull_dist_in_data = $derived(
277
+ helpers.calc_max_hull_dist_in_data(all_enriched_entries),
278
+ )
279
+ const auto_default_threshold = $derived(helpers.compute_auto_hull_dist_threshold(
280
+ all_enriched_entries.length,
281
+ max_hull_dist_in_data,
282
+ DEFAULTS.convex_hull.binary.max_hull_dist_show_phases,
283
+ ))
284
+
285
+ const next_auto_threshold = helpers.auto_threshold_reset(
286
+ DEFAULTS.convex_hull.binary.max_hull_dist_show_phases,
287
+ )
288
+ $effect(() => {
289
+ max_hull_dist_show_phases = next_auto_threshold(
290
+ entries,
291
+ max_hull_dist_show_phases,
292
+ auto_default_threshold,
293
+ ) ?? max_hull_dist_show_phases
294
+ })
295
+
296
+ // Filter by threshold; visibility is a view predicate, not entry state.
297
+ const plot_entries = $derived(
298
+ all_enriched_entries.filter((entry) =>
299
+ helpers.entry_is_stable(entry) ||
300
+ (entry.e_above_hull ?? 0) <= max_hull_dist_show_phases
301
+ ),
302
+ )
303
+
304
+ // Update bindable entries arrays when plot_entries change (single pass)
305
+ $effect(() => {
306
+ const stable: ConvexHullEntry[] = []
307
+ const unstable: ConvexHullEntry[] = []
308
+ for (const entry of plot_entries) {
309
+ if (helpers.entry_is_stable(entry)) stable.push(entry)
310
+ else unstable.push(entry)
311
+ }
312
+ stable_entries = stable
313
+ unstable_entries = unstable
314
+ })
315
+
316
+ let reset_counter = $state(0)
317
+ // Drag and drop state (to match 3D/4D components)
318
+ let drag_over = $state(false)
319
+ // Copy feedback state
320
+ let copy_feedback = $state({ visible: false, position: { x: 0, y: 0 } })
321
+
322
+ // Structure popup state
323
+ let structure_popup = $state.raw<{
324
+ open: boolean
325
+ structure: AnyStructure | null
326
+ entry: ConvexHullEntry | null
327
+ place_right: boolean
328
+ }>({
329
+ open: false,
330
+ structure: null,
331
+ entry: null,
332
+ place_right: true,
333
+ })
334
+
335
+ // Axis mapping helpers ------------------------------------------------------
336
+ const x_domain = $derived<[number, number]>([0, 1])
337
+ const y_domain = $derived.by((): [number, number] => {
338
+ const ys = plot_entries.map((entry) => entry.y)
339
+ if (ys.length === 0) return [-1, 0]
340
+ const min_y_data = Math.min(...ys)
341
+ const max_y_data = Math.max(...ys)
342
+ const span = Math.max(1e-9, max_y_data - min_y_data)
343
+ const pad = 0.05 * span
344
+ return [min_y_data - pad, max_y_data + pad]
345
+ })
346
+
347
+ // Build ScatterPlot series --------------------------------------------------
348
+
349
+ // Map MarkerSymbol to D3SymbolName (type-safe via symbol_map lookup)
350
+ const marker_to_d3_symbol = (marker?: string): D3SymbolName | undefined => {
351
+ if (!marker) return undefined
352
+ const name = marker.charAt(0).toUpperCase() + marker.slice(1)
353
+ return name in symbol_map ? (name as D3SymbolName) : undefined
354
+ }
355
+
356
+ // Pre-compute visible entries to avoid redundant filtering
357
+ const visible_entries = $derived(helpers.visible_entries(
358
+ plot_entries,
359
+ show_stable,
360
+ show_unstable,
361
+ ))
362
+
363
+ const scatter_points_series = $derived.by(() => {
364
+ const is_energy_mode = color_mode === `energy`
365
+ const count = visible_entries.length
366
+
367
+ // Single pass: extract x, y, color_values, and point_style simultaneously
368
+ const x_vals: number[] = Array(count)
369
+ const y_vals: number[] = Array(count)
370
+ const color_values: number[] = is_energy_mode ? Array(count) : []
371
+ const point_style: PointStyle[] = Array(count)
372
+
373
+ for (let idx = 0; idx < count; idx++) {
374
+ const entry = visible_entries[idx]
375
+ x_vals[idx] = entry.x
376
+ y_vals[idx] = entry.y
377
+ if (is_energy_mode) color_values[idx] = entry.e_above_hull ?? 0
378
+
379
+ const is_stable = helpers.entry_is_stable(entry)
380
+ const base_radius = entry.size || (is_stable ? 6 : 4)
381
+ const hl = is_highlighted(entry) ? merged_highlight_style : null
382
+
383
+ point_style[idx] = {
384
+ fill: hl?.effect === `color` || hl?.effect === `both`
385
+ ? hl?.color
386
+ : is_energy_mode
387
+ ? undefined
388
+ : merged_config.colors?.[is_stable ? `stable` : `unstable`],
389
+ stroke: is_stable ? `#ffffff` : `#000000`,
390
+ radius: hl?.effect === `size` || hl?.effect === `both`
391
+ ? base_radius * (hl?.size_multiplier ?? 1)
392
+ : base_radius,
393
+ symbol_type: marker_to_d3_symbol(entry.marker),
394
+ is_highlighted: Boolean(hl),
395
+ highlight_effect: hl?.effect,
396
+ highlight_color: hl?.color,
397
+ }
398
+ }
399
+
400
+ return {
401
+ x: x_vals,
402
+ y: y_vals,
403
+ metadata: visible_entries,
404
+ markers: `points` as const,
405
+ point_style,
406
+ ...(is_energy_mode ? { color_values } : {}),
407
+ }
408
+ })
409
+
410
+ const hull_segments_series = $derived.by(() => {
411
+ if (!merged_config.show_hull || hull_points.length < 2) return []
412
+ const segments = []
413
+ for (let idx = 0; idx < hull_points.length - 1; idx++) {
414
+ const p1 = hull_points[idx]
415
+ const p2 = hull_points[idx + 1]
416
+ segments.push({
417
+ x: [p1.x, p2.x] as const,
418
+ y: [p1.y, p2.y] as const,
419
+ markers: `line` as const,
420
+ line_style: {
421
+ stroke: CONVEX_HULL_STYLE.structure_line.color,
422
+ stroke_width: CONVEX_HULL_STYLE.structure_line.line_width,
423
+ line_dash: `${CONVEX_HULL_STYLE.structure_line.dash[0]},${
424
+ CONVEX_HULL_STYLE.structure_line.dash[1]
425
+ }`,
426
+ },
427
+ })
428
+ }
429
+ return segments
430
+ })
431
+
432
+ const scatter_series = $derived([scatter_points_series, ...hull_segments_series])
433
+
434
+ // Map selected_entry to ScatterPlot point index (series_idx: 0 = points series).
435
+ // current_entry() keeps selections pointing at the current plot entry object.
436
+ const selected_scatter_point = $derived.by(() => {
437
+ const entry = selected_entry
438
+ if (!entry) return null
439
+ // match by entry_id (same_entry), not reference: selected_entry may be a proxied/
440
+ // different instance than visible_entries elements when bound to a parent $state
441
+ const idx = visible_entries.findIndex((vis_entry) => helpers.same_entry(vis_entry, entry))
442
+ return idx === -1 ? null : { series_idx: 0, point_idx: idx }
443
+ })
444
+
445
+ // Convex hull statistics - compute internally and expose via bindable prop
446
+ $effect(() => {
447
+ phase_stats = thermo.get_convex_hull_stats(plot_entries, elements, 3)
448
+ })
449
+
450
+ function extract_structure_from_entry(
451
+ entry: ConvexHullEntry,
452
+ ): AnyStructure | null {
453
+ if (!entry.entry_id) return null
454
+ const orig_entry = entries.find((ent) => ent.entry_id === entry.entry_id)
455
+ return orig_entry?.structure as AnyStructure || null
456
+ }
457
+
458
+ function reset_all() {
459
+ fullscreen = DEFAULTS.convex_hull.binary.fullscreen
460
+ info_pane_open = DEFAULTS.convex_hull.binary.info_pane_open
461
+ legend_pane_open = DEFAULTS.convex_hull.binary.legend_pane_open
462
+ color_mode = DEFAULTS.convex_hull.binary.color_mode
463
+ color_scale = DEFAULTS.convex_hull.binary.color_scale as D3InterpolateName
464
+ show_stable = DEFAULTS.convex_hull.binary.show_stable
465
+ show_unstable = DEFAULTS.convex_hull.binary.show_unstable
466
+ show_stable_labels = DEFAULTS.convex_hull.binary.show_stable_labels
467
+ show_unstable_labels = DEFAULTS.convex_hull.binary.show_unstable_labels
468
+ // Use auto-computed threshold based on entry count instead of static default
469
+ max_hull_dist_show_phases = auto_default_threshold
470
+ max_hull_dist_show_labels = DEFAULTS.convex_hull.binary.max_hull_dist_show_labels
471
+ reset_counter += 1
472
+ }
473
+
474
+ // Track whether any settings differ from defaults (to show/hide reset button)
475
+ // Must match all properties that reset_all() resets
476
+ // Use auto_default_threshold for comparison since that's the effective default
477
+ const has_changes_to_reset = $derived(
478
+ fullscreen !== DEFAULTS.convex_hull.binary.fullscreen ||
479
+ info_pane_open !== DEFAULTS.convex_hull.binary.info_pane_open ||
480
+ legend_pane_open !== DEFAULTS.convex_hull.binary.legend_pane_open ||
481
+ color_mode !== DEFAULTS.convex_hull.binary.color_mode ||
482
+ color_scale !== DEFAULTS.convex_hull.binary.color_scale ||
483
+ show_stable !== DEFAULTS.convex_hull.binary.show_stable ||
484
+ show_unstable !== DEFAULTS.convex_hull.binary.show_unstable ||
485
+ show_stable_labels !== DEFAULTS.convex_hull.binary.show_stable_labels ||
486
+ show_unstable_labels !== DEFAULTS.convex_hull.binary.show_unstable_labels ||
487
+ // Compare with auto-computed threshold, with small tolerance for floating point
488
+ Math.abs(max_hull_dist_show_phases - auto_default_threshold) > 0.001 ||
489
+ max_hull_dist_show_labels !==
490
+ DEFAULTS.convex_hull.binary.max_hull_dist_show_labels,
491
+ )
492
+
493
+ // Custom hover tooltip state used with ScatterPlot events
494
+ let hover_data = $state.raw<HoverData3D<ConvexHullEntry> | null>(null)
495
+ $effect(() => {
496
+ const current_selection = helpers.current_entry(selected_entry, plot_entries)
497
+ if (selected_entry && !current_selection) selected_entry = null
498
+ else if (current_selection && !helpers.same_entry(current_selection, selected_entry)) {
499
+ selected_entry = current_selection
500
+ }
501
+ const current_hover = helpers.current_entry(hover_data?.entry, plot_entries)
502
+ if (hover_data?.entry && !current_hover) {
503
+ hover_data = null
504
+ on_point_hover?.(null)
505
+ } else if (hover_data && current_hover && current_hover !== hover_data.entry) {
506
+ hover_data = { ...hover_data, entry: current_hover }
507
+ }
508
+ const current_popup = helpers.current_entry(structure_popup.entry, plot_entries)
509
+ if (structure_popup.open) {
510
+ const structure = current_popup && extract_structure_from_entry(current_popup)
511
+ if (!structure) structure_popup = { open: false, structure: null, entry: null, place_right: true }
512
+ else if (
513
+ current_popup !== structure_popup.entry ||
514
+ structure !== structure_popup.structure
515
+ ) structure_popup = { ...structure_popup, entry: current_popup, structure }
516
+ }
517
+ })
518
+
519
+ const handle_keydown = (event: KeyboardEvent) => {
520
+ const target = event.target
521
+ if (target instanceof HTMLElement && target.tagName.match(/INPUT|TEXTAREA/)) return
522
+ const actions: Record<string, () => void> = {
523
+ b: () => color_mode = color_mode === `stability` ? `energy` : `stability`,
524
+ s: () => show_stable = !show_stable,
525
+ u: () => show_unstable = !show_unstable,
526
+ l: () => show_stable_labels = !show_stable_labels,
527
+ }
528
+ actions[event.key.toLowerCase()]?.()
529
+ }
530
+
531
+ async function handle_file_drop(event: DragEvent): Promise<void> {
532
+ drag_over = false
533
+ const data = await helpers.parse_hull_entries_from_drop(event)
534
+ if (data) on_file_drop?.(data)
535
+ }
536
+
537
+ async function copy_entry_data(
538
+ entry: ConvexHullEntry,
539
+ position: { x: number; y: number },
540
+ ) {
541
+ await helpers.copy_entry_to_clipboard(entry, position, (visible, pos) => {
542
+ copy_feedback.visible = visible
543
+ copy_feedback.position = pos
544
+ })
545
+ }
546
+
547
+ function close_structure_popup() {
548
+ structure_popup = { open: false, structure: null, entry: null, place_right: true }
549
+ selected_entry = null
550
+ }
551
+
552
+ // Track last clicked entry for double-click detection
553
+ let last_clicked_entry: ConvexHullEntry | null = null
554
+ let last_click_time = 0
555
+
556
+ function handle_point_click_internal(data: ScatterHandlerEvent<ConvexHullEntry>) {
557
+ const { metadata: entry, event } = data
558
+ if (!entry) return
559
+
560
+ const now = Date.now()
561
+ const is_double_click = last_clicked_entry === entry &&
562
+ now - last_click_time < 300
563
+
564
+ if (is_double_click) {
565
+ // Double-click: copy to clipboard
566
+ copy_entry_data(entry, { x: event.clientX, y: event.clientY })
567
+ last_clicked_entry = null
568
+ last_click_time = 0
569
+ } else {
570
+ // Single click: select entry and optionally show structure preview
571
+ last_clicked_entry = entry
572
+ last_click_time = now
573
+
574
+ on_point_click?.(entry)
575
+ if (enable_click_selection) {
576
+ selected_entry = entry
577
+ if (enable_structure_preview) {
578
+ const structure = extract_structure_from_entry(entry)
579
+ if (structure) {
580
+ const viewport_width = globalThis.innerWidth
581
+ const click_x = event.clientX
582
+ const space_on_right = viewport_width - click_x
583
+ const space_on_left = click_x
584
+ const place_right = space_on_right >= space_on_left
585
+
586
+ structure_popup = { open: true, structure, entry, place_right }
587
+ event.stopPropagation()
588
+ }
589
+ }
590
+ }
591
+ }
592
+ }
593
+
594
+ // Fullscreen handling
595
+ $effect(() => {
596
+ setup_fullscreen_effect(fullscreen, wrapper)
597
+ set_fullscreen_bg(wrapper, fullscreen, `--hull-2d-bg-fullscreen`)
598
+ })
599
+
600
+ let style = $derived(
601
+ `--hull-stable-color:${merged_config.colors?.stable || `#0072B2`};
602
+ --hull-unstable-color:${merged_config.colors?.unstable || `#E69F00`};
603
+ --hull-edge-color:${merged_config.colors?.edge || `var(--text-color, #212121)`};
604
+ --hull-text-color:${
605
+ merged_config.colors?.annotation || `var(--text-color, #212121)`
606
+ };`,
607
+ )
608
+ </script>
609
+
610
+ <svelte:document
611
+ onfullscreenchange={() => {
612
+ fullscreen = Boolean(document.fullscreenElement)
613
+ }}
614
+ />
615
+
616
+ <!-- Hover tooltip matching 3D/4D style (content only; container handled by ScatterPlot) -->
617
+ {#snippet tooltip(point: ScatterHandlerProps<ConvexHullEntry>)}
618
+ {@const entry = point.metadata}
619
+ {@const entry_highlight = entry && is_highlighted(entry)
620
+ ? merged_highlight_style
621
+ : undefined}
622
+ {#if entry}
623
+ <ConvexHullTooltip
624
+ {entry}
625
+ {polymorph_stats_map}
626
+ highlight_style={entry_highlight}
627
+ tooltip={custom_tooltip}
628
+ />
629
+ {/if}
630
+ {/snippet}
631
+
632
+ {#snippet pd_header_controls()}
633
+ {#if controls_config.mode !== `never` && !structure_popup.open}
634
+ {#if has_changes_to_reset && controls_config.visible(`reset`)}
635
+ <button
636
+ type="button"
637
+ onclick={reset_all}
638
+ title="Reset view and settings"
639
+ class="control-btn reset-camera-btn"
640
+ >
641
+ <Icon icon="Reset" />
642
+ </button>
643
+ {/if}
644
+
645
+ {#if enable_info_pane && phase_stats && controls_config.visible(`info-pane`)}
646
+ <ConvexHullInfoPane
647
+ bind:pane_open={info_pane_open}
648
+ {phase_stats}
649
+ {stable_entries}
650
+ {unstable_entries}
651
+ {show_stable}
652
+ {show_unstable}
653
+ {max_hull_dist_show_phases}
654
+ {max_hull_dist_show_labels}
655
+ {label_threshold}
656
+ toggle_props={{ class: `control-btn info-btn` }}
657
+ />
658
+ {/if}
659
+
660
+ {#if controls_config.visible(`controls`)}
661
+ <ConvexHullControls
662
+ bind:controls_open={legend_pane_open}
663
+ bind:color_mode
664
+ bind:color_scale
665
+ bind:show_stable
666
+ bind:show_unstable
667
+ bind:show_stable_labels
668
+ bind:show_unstable_labels
669
+ bind:max_hull_dist_show_phases
670
+ bind:max_hull_dist_show_labels
671
+ {max_hull_dist_in_data}
672
+ {stable_entries}
673
+ {unstable_entries}
674
+ {merged_controls}
675
+ toggle_props={{ class: `control-btn legend-controls-btn` }}
676
+ bind:energy_source_mode
677
+ {has_precomputed_e_form}
678
+ {can_compute_e_form}
679
+ {has_precomputed_hull}
680
+ {can_compute_hull}
681
+ />
682
+ {/if}
683
+ {/if}
684
+ {/snippet}
685
+
686
+ {#snippet user_content(
687
+ { x_scale_fn, pad, height, y_scale_fn, y_range, width }: UserContentProps,
688
+ )}
689
+ {@const [x0, x1, y0] = [x_scale_fn(0), x_scale_fn(1), y_scale_fn(y_range[0])]}
690
+ {@const stroke = {
691
+ stroke: `var(--scatter-grid-stroke, gray)`,
692
+ 'stroke-width': `var(--scatter-grid-width, 0.4)`,
693
+ 'stroke-dasharray': `var(--scatter-grid-dash, 4)`,
694
+ }}
695
+ <line y1={pad.t} y2={height - pad.b} x1={x0} x2={x0} {...stroke} />
696
+ <line y1={pad.t} y2={height - pad.b} {x1} x2={x1} {...stroke} />
697
+ <line x1={pad.l} x2={width - pad.r} y1={y0} y2={y0} {...stroke} />
698
+ {/snippet}
699
+ {#key reset_counter}
700
+ <ScatterPlot
701
+ {...rest}
702
+ class="convex-hull-2d {rest.class ?? ``} {drag_over ? `dragover` : ``}"
703
+ style={`${style}; ${rest.style ?? ``}`}
704
+ data-has-selection={selected_entry !== null}
705
+ bind:wrapper
706
+ bind:fullscreen
707
+ role="application"
708
+ tabindex={-1}
709
+ onkeydown={handle_keydown}
710
+ ondrop={handle_file_drop}
711
+ ondragover={(event: DragEvent) => {
712
+ event.preventDefault()
713
+ drag_over = true
714
+ }}
715
+ ondragleave={(event: DragEvent) => {
716
+ event.preventDefault()
717
+ drag_over = false
718
+ }}
719
+ aria-label="Binary convex hull visualization"
720
+ series={scatter_series}
721
+ bind:display
722
+ controls={{ show: false }}
723
+ x_axis={{
724
+ label: elements.length === 2 ? `x in ${elements[0]}₁₋ₓ ${elements[1]}ₓ` : `x`,
725
+ range: x_domain,
726
+ ticks: 4,
727
+ ...x_axis,
728
+ }}
729
+ y_axis={{
730
+ label: `E<sub>form</sub> (eV/atom)`,
731
+ range: y_domain,
732
+ ticks: 4,
733
+ label_shift: { y: 15 },
734
+ ...y_axis,
735
+ }}
736
+ legend={null}
737
+ color_bar={{
738
+ title: `E<sub>above hull</sub> (eV/atom)`,
739
+ bar_style: `width: 220px; height: 16px;`,
740
+ }}
741
+ {tooltip}
742
+ {user_content}
743
+ header_controls={pd_header_controls}
744
+ selected_point={selected_scatter_point}
745
+ on_point_click={handle_point_click_internal}
746
+ on_point_hover={(data: ScatterHandlerEvent<ConvexHullEntry> | null) => {
747
+ if (!data) {
748
+ hover_data = null
749
+ on_point_hover?.(null)
750
+ return
751
+ }
752
+ const { metadata: entry, event } = data
753
+ hover_data = entry
754
+ ? { entry, position: { x: event.clientX, y: event.clientY } }
755
+ : null
756
+ on_point_hover?.(hover_data)
757
+ }}
758
+ padding={{ t: 30, b: 60, l: 60, r: 30 }}
759
+ >
760
+ {@render children?.({
761
+ stable_entries,
762
+ unstable_entries,
763
+ highlighted_entries,
764
+ selected_entry,
765
+ })}
766
+ <h3 style="position: absolute; left: 1em; top: 1ex; margin: 0">
767
+ {@html sanitize_html(merged_controls.title || phase_stats?.chemical_system || ``)}
768
+ </h3>
769
+
770
+ <ClickFeedback
771
+ bind:visible={copy_feedback.visible}
772
+ position={copy_feedback.position}
773
+ />
774
+ <DragOverlay visible={drag_over} />
775
+
776
+ {#if has_temp_data && temperature !== undefined}
777
+ <TemperatureSlider {available_temperatures} bind:temperature />
778
+ {/if}
779
+
780
+ {#if gas_analysis.has_gas_dependent_elements && merged_gas_config}
781
+ <GasPressureControls
782
+ config={merged_gas_config}
783
+ bind:pressures={gas_pressures}
784
+ temperature={temperature ?? 300}
785
+ />
786
+ {/if}
787
+
788
+ {#if structure_popup.open && structure_popup.structure}
789
+ <StructurePopup
790
+ structure={structure_popup.structure}
791
+ place_right={structure_popup.place_right}
792
+ stats={{
793
+ id: structure_popup.entry?.entry_id,
794
+ e_above_hull: structure_popup.entry?.e_above_hull,
795
+ e_form: structure_popup.entry?.e_form_per_atom,
796
+ }}
797
+ onclose={close_structure_popup}
798
+ />
799
+ {/if}
800
+ </ScatterPlot>
801
+ {/key}
802
+
803
+ <style>
804
+ :global(.convex-hull-2d:fullscreen) {
805
+ background: var(--hull-2d-bg-fullscreen, var(--hull-2d-bg, var(--hull-bg)))
806
+ !important;
807
+ overflow: hidden;
808
+ }
809
+ :global(.convex-hull-2d.dragover) {
810
+ border: 2px dashed var(--accent-color, #1976d2) !important;
811
+ }
812
+ /* Styles for control buttons rendered via header_controls snippet */
813
+ :global(.convex-hull-2d .control-btn) {
814
+ background: transparent;
815
+ border: none;
816
+ padding: 4px;
817
+ cursor: pointer;
818
+ border-radius: 3px;
819
+ color: var(--text-color, currentColor);
820
+ transition: background-color 0.2s, opacity 0.2s;
821
+ display: flex;
822
+ font-size: clamp(0.85em, 2cqmin, 1.3em);
823
+ }
824
+ :global(.convex-hull-2d .control-btn:hover) {
825
+ background-color: color-mix(in srgb, currentColor 8%, transparent);
826
+ }
827
+ </style>