matterviz 0.3.6 → 0.3.7

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 (863) 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.d.ts +13 -0
  5. package/dist/MillerIndexInput.svelte +66 -0
  6. package/dist/MillerIndexInput.svelte.d.ts +7 -0
  7. package/dist/api/mp.d.ts +6 -0
  8. package/dist/api/mp.js +22 -0
  9. package/dist/api/optimade.d.ts +45 -0
  10. package/dist/api/optimade.js +135 -0
  11. package/dist/brillouin/BrillouinZone.svelte +549 -0
  12. package/dist/brillouin/BrillouinZone.svelte.d.ts +83 -0
  13. package/dist/brillouin/BrillouinZoneControls.svelte +144 -0
  14. package/dist/brillouin/BrillouinZoneControls.svelte.d.ts +17 -0
  15. package/dist/brillouin/BrillouinZoneExportPane.svelte +146 -0
  16. package/dist/brillouin/BrillouinZoneExportPane.svelte.d.ts +15 -0
  17. package/dist/brillouin/BrillouinZoneInfoPane.svelte +146 -0
  18. package/dist/brillouin/BrillouinZoneInfoPane.svelte.d.ts +13 -0
  19. package/dist/brillouin/BrillouinZoneScene.svelte +476 -0
  20. package/dist/brillouin/BrillouinZoneScene.svelte.d.ts +48 -0
  21. package/dist/brillouin/BrillouinZoneTooltip.svelte +92 -0
  22. package/dist/brillouin/BrillouinZoneTooltip.svelte.d.ts +8 -0
  23. package/dist/brillouin/compute.d.ts +17 -0
  24. package/dist/brillouin/compute.js +426 -0
  25. package/dist/brillouin/index.d.ts +8 -0
  26. package/dist/brillouin/index.js +7 -0
  27. package/dist/brillouin/types.d.ts +43 -0
  28. package/dist/brillouin/types.js +1 -0
  29. package/dist/chempot-diagram/ChemPotDiagram.svelte +327 -0
  30. package/dist/chempot-diagram/ChemPotDiagram.svelte.d.ts +13 -0
  31. package/dist/chempot-diagram/ChemPotDiagram2D.svelte +846 -0
  32. package/dist/chempot-diagram/ChemPotDiagram2D.svelte.d.ts +16 -0
  33. package/dist/chempot-diagram/ChemPotDiagram3D.svelte +3193 -0
  34. package/dist/chempot-diagram/ChemPotDiagram3D.svelte.d.ts +16 -0
  35. package/dist/chempot-diagram/ChemPotScene3D.svelte.d.ts +7 -0
  36. package/dist/chempot-diagram/async-compute.svelte.d.ts +3 -0
  37. package/dist/chempot-diagram/async-compute.svelte.js +78 -0
  38. package/dist/chempot-diagram/chempot-worker.d.ts +1 -0
  39. package/dist/chempot-diagram/chempot-worker.js +11 -0
  40. package/dist/chempot-diagram/color.d.ts +10 -0
  41. package/dist/chempot-diagram/color.js +32 -0
  42. package/dist/chempot-diagram/compute.d.ts +48 -0
  43. package/dist/chempot-diagram/compute.js +806 -0
  44. package/dist/chempot-diagram/index.d.ts +6 -0
  45. package/dist/chempot-diagram/index.js +6 -0
  46. package/dist/chempot-diagram/pointer.d.ts +16 -0
  47. package/dist/chempot-diagram/pointer.js +40 -0
  48. package/dist/chempot-diagram/temperature.d.ts +15 -0
  49. package/dist/chempot-diagram/temperature.js +34 -0
  50. package/dist/chempot-diagram/types.d.ts +81 -0
  51. package/dist/chempot-diagram/types.js +28 -0
  52. package/dist/colors/index.d.ts +47 -0
  53. package/dist/colors/index.js +203 -0
  54. package/dist/composition/BarChart.svelte +297 -0
  55. package/dist/composition/BarChart.svelte.d.ts +39 -0
  56. package/dist/composition/BubbleChart.svelte +218 -0
  57. package/dist/composition/BubbleChart.svelte.d.ts +28 -0
  58. package/dist/composition/Composition.svelte +165 -0
  59. package/dist/composition/Composition.svelte.d.ts +15 -0
  60. package/dist/composition/Formula.svelte +268 -0
  61. package/dist/composition/Formula.svelte.d.ts +19 -0
  62. package/dist/composition/FormulaFilter.svelte +1257 -0
  63. package/dist/composition/FormulaFilter.svelte.d.ts +51 -0
  64. package/dist/composition/PieChart.svelte +323 -0
  65. package/dist/composition/PieChart.svelte.d.ts +37 -0
  66. package/dist/composition/format.d.ts +15 -0
  67. package/dist/composition/format.js +109 -0
  68. package/dist/composition/index.d.ts +20 -0
  69. package/dist/composition/index.js +14 -0
  70. package/dist/composition/parse.d.ts +56 -0
  71. package/dist/composition/parse.js +474 -0
  72. package/dist/constants.d.ts +29 -0
  73. package/dist/constants.js +99 -0
  74. package/dist/controls.d.ts +14 -0
  75. package/dist/controls.js +30 -0
  76. package/dist/convex-hull/ConvexHull.svelte +157 -0
  77. package/dist/convex-hull/ConvexHull.svelte.d.ts +13 -0
  78. package/dist/convex-hull/ConvexHull2D.svelte +825 -0
  79. package/dist/convex-hull/ConvexHull2D.svelte.d.ts +11 -0
  80. package/dist/convex-hull/ConvexHull3D.svelte +1801 -0
  81. package/dist/convex-hull/ConvexHull3D.svelte.d.ts +8 -0
  82. package/dist/convex-hull/ConvexHull4D.svelte +1398 -0
  83. package/dist/convex-hull/ConvexHull4D.svelte.d.ts +8 -0
  84. package/dist/convex-hull/ConvexHullControls.svelte +535 -0
  85. package/dist/convex-hull/ConvexHullControls.svelte.d.ts +48 -0
  86. package/dist/convex-hull/ConvexHullInfoPane.svelte +125 -0
  87. package/dist/convex-hull/ConvexHullInfoPane.svelte.d.ts +20 -0
  88. package/dist/convex-hull/ConvexHullStats.svelte +929 -0
  89. package/dist/convex-hull/ConvexHullStats.svelte.d.ts +17 -0
  90. package/dist/convex-hull/ConvexHullTooltip.svelte +131 -0
  91. package/dist/convex-hull/ConvexHullTooltip.svelte.d.ts +33 -0
  92. package/dist/convex-hull/GasPressureControls.svelte +247 -0
  93. package/dist/convex-hull/GasPressureControls.svelte.d.ts +11 -0
  94. package/dist/convex-hull/StructurePopup.svelte +151 -0
  95. package/dist/convex-hull/StructurePopup.svelte.d.ts +18 -0
  96. package/dist/convex-hull/TemperatureSlider.svelte.d.ts +8 -0
  97. package/dist/convex-hull/barycentric-coords.d.ts +18 -0
  98. package/dist/convex-hull/barycentric-coords.js +182 -0
  99. package/dist/convex-hull/demo-temperature.d.ts +6 -0
  100. package/dist/convex-hull/demo-temperature.js +40 -0
  101. package/dist/convex-hull/gas-thermodynamics.d.ts +16 -0
  102. package/dist/convex-hull/gas-thermodynamics.js +314 -0
  103. package/dist/convex-hull/helpers.d.ts +114 -0
  104. package/dist/convex-hull/helpers.js +710 -0
  105. package/dist/convex-hull/index.d.ts +119 -0
  106. package/dist/convex-hull/index.js +58 -0
  107. package/dist/convex-hull/thermodynamics.d.ts +67 -0
  108. package/dist/convex-hull/thermodynamics.js +1752 -0
  109. package/dist/convex-hull/types.d.ts +162 -0
  110. package/dist/convex-hull/types.js +36 -0
  111. package/dist/coordination/CoordinationBarPlot.svelte +311 -0
  112. package/dist/coordination/CoordinationBarPlot.svelte.d.ts +30 -0
  113. package/dist/coordination/calc-coordination.d.ts +15 -0
  114. package/dist/coordination/calc-coordination.js +63 -0
  115. package/dist/coordination/index.d.ts +8 -0
  116. package/dist/coordination/index.js +7 -0
  117. package/dist/effects.svelte.d.ts +12 -0
  118. package/dist/effects.svelte.js +37 -0
  119. package/dist/element/BohrAtom.svelte.d.ts +20 -0
  120. package/dist/element/ElementHeading.svelte +26 -0
  121. package/dist/element/ElementHeading.svelte.d.ts +8 -0
  122. package/dist/element/ElementPhoto.svelte +57 -0
  123. package/dist/element/ElementPhoto.svelte.d.ts +9 -0
  124. package/dist/element/ElementStats.svelte +80 -0
  125. package/dist/element/ElementStats.svelte.d.ts +8 -0
  126. package/dist/element/ElementTile.svelte +484 -0
  127. package/dist/element/ElementTile.svelte.d.ts +29 -0
  128. package/dist/element/Nucleus.svelte.d.ts +17 -0
  129. package/dist/element/data.d.ts +2 -0
  130. package/dist/element/data.js +2 -0
  131. package/dist/element/index.d.ts +8 -0
  132. package/dist/element/index.js +7 -0
  133. package/dist/element/types.d.ts +57 -0
  134. package/dist/element/types.js +1 -0
  135. package/dist/feedback/ClickFeedback.svelte +58 -0
  136. package/dist/feedback/ClickFeedback.svelte.d.ts +12 -0
  137. package/dist/feedback/DragOverlay.svelte +42 -0
  138. package/dist/feedback/DragOverlay.svelte.d.ts +7 -0
  139. package/dist/feedback/Spinner.svelte.d.ts +7 -0
  140. package/dist/feedback/StatusMessage.svelte.d.ts +9 -0
  141. package/dist/feedback/index.d.ts +4 -0
  142. package/dist/feedback/index.js +4 -0
  143. package/dist/fermi-surface/FermiSlice.svelte +189 -0
  144. package/dist/fermi-surface/FermiSlice.svelte.d.ts +24 -0
  145. package/dist/fermi-surface/FermiSurface.svelte +600 -0
  146. package/dist/fermi-surface/FermiSurface.svelte.d.ts +83 -0
  147. package/dist/fermi-surface/FermiSurfaceControls.svelte +448 -0
  148. package/dist/fermi-surface/FermiSurfaceControls.svelte.d.ts +35 -0
  149. package/dist/fermi-surface/FermiSurfaceScene.svelte +794 -0
  150. package/dist/fermi-surface/FermiSurfaceScene.svelte.d.ts +50 -0
  151. package/dist/fermi-surface/FermiSurfaceTooltip.svelte +111 -0
  152. package/dist/fermi-surface/FermiSurfaceTooltip.svelte.d.ts +8 -0
  153. package/dist/fermi-surface/compute.d.ts +5 -0
  154. package/dist/fermi-surface/compute.js +538 -0
  155. package/dist/fermi-surface/constants.d.ts +9 -0
  156. package/dist/fermi-surface/constants.js +27 -0
  157. package/dist/fermi-surface/export.d.ts +5 -0
  158. package/dist/fermi-surface/export.js +50 -0
  159. package/dist/fermi-surface/index.d.ts +12 -0
  160. package/dist/fermi-surface/index.js +13 -0
  161. package/dist/fermi-surface/marching-cubes.d.ts +2 -0
  162. package/dist/fermi-surface/marching-cubes.js +2 -0
  163. package/dist/fermi-surface/parse.d.ts +2 -0
  164. package/dist/fermi-surface/parse.js +491 -0
  165. package/dist/fermi-surface/symmetry.d.ts +3 -0
  166. package/dist/fermi-surface/symmetry.js +46 -0
  167. package/dist/fermi-surface/types.d.ts +110 -0
  168. package/dist/fermi-surface/types.js +4 -0
  169. package/dist/heatmap-matrix/HeatmapMatrix.svelte +1545 -0
  170. package/dist/heatmap-matrix/HeatmapMatrix.svelte.d.ts +110 -0
  171. package/dist/heatmap-matrix/HeatmapMatrixControls.svelte +225 -0
  172. package/dist/heatmap-matrix/HeatmapMatrixControls.svelte.d.ts +30 -0
  173. package/dist/heatmap-matrix/index.d.ts +53 -0
  174. package/dist/heatmap-matrix/index.js +100 -0
  175. package/dist/heatmap-matrix/shared.d.ts +2 -0
  176. package/dist/heatmap-matrix/shared.js +4 -0
  177. package/dist/icons.d.ts +569 -0
  178. package/dist/icons.js +648 -0
  179. package/dist/index.d.ts +39 -0
  180. package/dist/index.js +39 -0
  181. package/dist/io/decompress.d.ts +11 -0
  182. package/dist/io/decompress.js +74 -0
  183. package/dist/io/export.d.ts +16 -0
  184. package/dist/io/export.js +316 -0
  185. package/dist/io/fetch.d.ts +5 -0
  186. package/dist/io/fetch.js +39 -0
  187. package/dist/io/file-drop.d.ts +7 -0
  188. package/dist/io/file-drop.js +43 -0
  189. package/dist/io/index.d.ts +7 -0
  190. package/dist/io/index.js +6 -0
  191. package/dist/io/is-binary.d.ts +1 -0
  192. package/dist/io/is-binary.js +20 -0
  193. package/dist/io/types.d.ts +8 -0
  194. package/dist/io/types.js +1 -0
  195. package/dist/io/url-drop.d.ts +2 -0
  196. package/dist/io/url-drop.js +123 -0
  197. package/dist/isosurface/Isosurface.svelte +285 -0
  198. package/dist/isosurface/Isosurface.svelte.d.ts +8 -0
  199. package/dist/isosurface/IsosurfaceControls.svelte +277 -0
  200. package/dist/isosurface/IsosurfaceControls.svelte.d.ts +9 -0
  201. package/dist/isosurface/index.d.ts +5 -0
  202. package/dist/isosurface/index.js +6 -0
  203. package/dist/isosurface/parse.d.ts +6 -0
  204. package/dist/isosurface/parse.js +553 -0
  205. package/dist/isosurface/slice.d.ts +11 -0
  206. package/dist/isosurface/slice.js +140 -0
  207. package/dist/isosurface/types.d.ts +56 -0
  208. package/dist/isosurface/types.js +227 -0
  209. package/dist/labels.d.ts +53 -0
  210. package/dist/labels.js +277 -0
  211. package/dist/layout/FullscreenToggle.svelte +50 -0
  212. package/dist/layout/FullscreenToggle.svelte.d.ts +7 -0
  213. package/dist/layout/InfoCard.svelte +120 -0
  214. package/dist/layout/InfoCard.svelte.d.ts +21 -0
  215. package/dist/layout/InfoTag.svelte +185 -0
  216. package/dist/layout/InfoTag.svelte.d.ts +19 -0
  217. package/dist/layout/PropertyFilter.svelte +246 -0
  218. package/dist/layout/PropertyFilter.svelte.d.ts +24 -0
  219. package/dist/layout/SettingsSection.svelte +148 -0
  220. package/dist/layout/SettingsSection.svelte.d.ts +17 -0
  221. package/dist/layout/SubpageGrid.svelte +82 -0
  222. package/dist/layout/SubpageGrid.svelte.d.ts +14 -0
  223. package/dist/layout/fullscreen.d.ts +9 -0
  224. package/dist/layout/fullscreen.js +53 -0
  225. package/dist/layout/index.d.ts +10 -0
  226. package/dist/layout/index.js +8 -0
  227. package/dist/layout/json-tree/JsonNode.svelte +548 -0
  228. package/dist/layout/json-tree/JsonNode.svelte.d.ts +11 -0
  229. package/dist/layout/json-tree/JsonTree.svelte +1230 -0
  230. package/dist/layout/json-tree/JsonTree.svelte.d.ts +6 -0
  231. package/dist/layout/json-tree/JsonValue.svelte.d.ts +9 -0
  232. package/dist/layout/json-tree/index.d.ts +3 -0
  233. package/dist/layout/json-tree/index.js +3 -0
  234. package/dist/layout/json-tree/types.d.ts +74 -0
  235. package/dist/layout/json-tree/types.js +2 -0
  236. package/dist/layout/json-tree/utils.d.ts +29 -0
  237. package/dist/layout/json-tree/utils.js +641 -0
  238. package/dist/marching-cubes.d.ts +14 -0
  239. package/dist/marching-cubes.js +540 -0
  240. package/dist/math.d.ts +101 -0
  241. package/dist/math.js +905 -0
  242. package/dist/overlays/ContextMenu.svelte +162 -0
  243. package/dist/overlays/ContextMenu.svelte.d.ts +25 -0
  244. package/dist/overlays/CopyButton.svelte +45 -0
  245. package/dist/overlays/CopyButton.svelte.d.ts +8 -0
  246. package/dist/overlays/DragControlTab.svelte +98 -0
  247. package/dist/overlays/DragControlTab.svelte.d.ts +8 -0
  248. package/dist/overlays/DraggablePane.svelte +487 -0
  249. package/dist/overlays/DraggablePane.svelte.d.ts +36 -0
  250. package/dist/overlays/InfoPaneCards.svelte +149 -0
  251. package/dist/overlays/InfoPaneCards.svelte.d.ts +22 -0
  252. package/dist/overlays/index.d.ts +3 -0
  253. package/dist/overlays/index.js +3 -0
  254. package/dist/periodic-table/PeriodicTable.svelte +469 -0
  255. package/dist/periodic-table/PeriodicTable.svelte.d.ts +55 -0
  256. package/dist/periodic-table/PeriodicTableControls.svelte +557 -0
  257. package/dist/periodic-table/PeriodicTableControls.svelte.d.ts +24 -0
  258. package/dist/periodic-table/PropertySelect.svelte +37 -0
  259. package/dist/periodic-table/PropertySelect.svelte.d.ts +13 -0
  260. package/dist/periodic-table/TableInset.svelte.d.ts +9 -0
  261. package/dist/periodic-table/index.d.ts +10 -0
  262. package/dist/periodic-table/index.js +4 -0
  263. package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte +1086 -0
  264. package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte.d.ts +44 -0
  265. package/dist/phase-diagram/PhaseDiagramControls.svelte +444 -0
  266. package/dist/phase-diagram/PhaseDiagramControls.svelte.d.ts +30 -0
  267. package/dist/phase-diagram/PhaseDiagramEditorPane.svelte +126 -0
  268. package/dist/phase-diagram/PhaseDiagramEditorPane.svelte.d.ts +15 -0
  269. package/dist/phase-diagram/PhaseDiagramExportPane.svelte +184 -0
  270. package/dist/phase-diagram/PhaseDiagramExportPane.svelte.d.ts +19 -0
  271. package/dist/phase-diagram/PhaseDiagramTooltip.svelte +391 -0
  272. package/dist/phase-diagram/PhaseDiagramTooltip.svelte.d.ts +16 -0
  273. package/dist/phase-diagram/TdbInfoPanel.svelte +203 -0
  274. package/dist/phase-diagram/TdbInfoPanel.svelte.d.ts +12 -0
  275. package/dist/phase-diagram/build-diagram.d.ts +11 -0
  276. package/dist/phase-diagram/build-diagram.js +160 -0
  277. package/dist/phase-diagram/colors.d.ts +35 -0
  278. package/dist/phase-diagram/colors.js +51 -0
  279. package/dist/phase-diagram/diagram-input.d.ts +29 -0
  280. package/dist/phase-diagram/diagram-input.js +3 -0
  281. package/dist/phase-diagram/index.d.ts +13 -0
  282. package/dist/phase-diagram/index.js +11 -0
  283. package/dist/phase-diagram/parse.d.ts +55 -0
  284. package/dist/phase-diagram/parse.js +272 -0
  285. package/dist/phase-diagram/svg-to-diagram.d.ts +2 -0
  286. package/dist/phase-diagram/svg-to-diagram.js +867 -0
  287. package/dist/phase-diagram/types.d.ts +93 -0
  288. package/dist/phase-diagram/types.js +1 -0
  289. package/dist/phase-diagram/utils.d.ts +118 -0
  290. package/dist/phase-diagram/utils.js +604 -0
  291. package/dist/plot/AxisLabel.svelte +51 -0
  292. package/dist/plot/AxisLabel.svelte.d.ts +16 -0
  293. package/dist/plot/BarPlot.svelte +2113 -0
  294. package/dist/plot/BarPlot.svelte.d.ts +84 -0
  295. package/dist/plot/BarPlotControls.svelte +66 -0
  296. package/dist/plot/BarPlotControls.svelte.d.ts +18 -0
  297. package/dist/plot/BinnedScatterPlot.svelte +1114 -0
  298. package/dist/plot/BinnedScatterPlot.svelte.d.ts +66 -0
  299. package/dist/plot/ColorBar.svelte +721 -0
  300. package/dist/plot/ColorBar.svelte.d.ts +31 -0
  301. package/dist/plot/ColorScaleSelect.svelte +54 -0
  302. package/dist/plot/ColorScaleSelect.svelte.d.ts +15 -0
  303. package/dist/plot/ElementScatter.svelte +63 -0
  304. package/dist/plot/ElementScatter.svelte.d.ts +14 -0
  305. package/dist/plot/FillArea.svelte.d.ts +21 -0
  306. package/dist/plot/Histogram.svelte +1558 -0
  307. package/dist/plot/Histogram.svelte.d.ts +50 -0
  308. package/dist/plot/HistogramControls.svelte +212 -0
  309. package/dist/plot/HistogramControls.svelte.d.ts +22 -0
  310. package/dist/plot/InteractiveAxisLabel.svelte +96 -0
  311. package/dist/plot/InteractiveAxisLabel.svelte.d.ts +14 -0
  312. package/dist/plot/Line.svelte +84 -0
  313. package/dist/plot/Line.svelte.d.ts +15 -0
  314. package/dist/plot/PlotAxis.svelte +169 -0
  315. package/dist/plot/PlotAxis.svelte.d.ts +24 -0
  316. package/dist/plot/PlotControls.svelte +537 -0
  317. package/dist/plot/PlotControls.svelte.d.ts +4 -0
  318. package/dist/plot/PlotLegend.svelte +569 -0
  319. package/dist/plot/PlotLegend.svelte.d.ts +29 -0
  320. package/dist/plot/PlotTooltip.svelte +67 -0
  321. package/dist/plot/PlotTooltip.svelte.d.ts +17 -0
  322. package/dist/plot/PortalSelect.svelte +253 -0
  323. package/dist/plot/PortalSelect.svelte.d.ts +16 -0
  324. package/dist/plot/ReferenceLine.svelte.d.ts +20 -0
  325. package/dist/plot/ReferenceLine3D.svelte +156 -0
  326. package/dist/plot/ReferenceLine3D.svelte.d.ts +14 -0
  327. package/dist/plot/ReferencePlane.svelte +175 -0
  328. package/dist/plot/ReferencePlane.svelte.d.ts +14 -0
  329. package/dist/plot/ScatterPlot.svelte +2778 -0
  330. package/dist/plot/ScatterPlot.svelte.d.ts +96 -0
  331. package/dist/plot/ScatterPlot3D.svelte +529 -0
  332. package/dist/plot/ScatterPlot3D.svelte.d.ts +95 -0
  333. package/dist/plot/ScatterPlot3DControls.svelte +437 -0
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  677. package/dist/src/lib/phase-diagram/PhaseDiagramExportPane.svelte +0 -184
  678. package/dist/src/lib/phase-diagram/PhaseDiagramTooltip.svelte +0 -391
  679. package/dist/src/lib/phase-diagram/TdbInfoPanel.svelte +0 -203
  680. package/dist/src/lib/phase-diagram/build-diagram.ts +0 -186
  681. package/dist/src/lib/phase-diagram/colors.ts +0 -58
  682. package/dist/src/lib/phase-diagram/diagram-input.ts +0 -40
  683. package/dist/src/lib/phase-diagram/index.ts +0 -13
  684. package/dist/src/lib/phase-diagram/parse.ts +0 -348
  685. package/dist/src/lib/phase-diagram/svg-to-diagram.ts +0 -1023
  686. package/dist/src/lib/phase-diagram/types.ts +0 -144
  687. package/dist/src/lib/phase-diagram/utils.ts +0 -775
  688. package/dist/src/lib/plot/AxisLabel.svelte +0 -51
  689. package/dist/src/lib/plot/BarPlot.svelte +0 -2113
  690. package/dist/src/lib/plot/BarPlotControls.svelte +0 -66
  691. package/dist/src/lib/plot/BinnedScatterPlot.svelte +0 -1114
  692. package/dist/src/lib/plot/ColorBar.svelte +0 -721
  693. package/dist/src/lib/plot/ColorScaleSelect.svelte +0 -54
  694. package/dist/src/lib/plot/ElementScatter.svelte +0 -63
  695. package/dist/src/lib/plot/Histogram.svelte +0 -1558
  696. package/dist/src/lib/plot/HistogramControls.svelte +0 -212
  697. package/dist/src/lib/plot/InteractiveAxisLabel.svelte +0 -96
  698. package/dist/src/lib/plot/Line.svelte +0 -84
  699. package/dist/src/lib/plot/PlotAxis.svelte +0 -169
  700. package/dist/src/lib/plot/PlotControls.svelte +0 -537
  701. package/dist/src/lib/plot/PlotLegend.svelte +0 -569
  702. package/dist/src/lib/plot/PlotTooltip.svelte +0 -67
  703. package/dist/src/lib/plot/PortalSelect.svelte +0 -253
  704. package/dist/src/lib/plot/ReferenceLine3D.svelte +0 -156
  705. package/dist/src/lib/plot/ReferencePlane.svelte +0 -175
  706. package/dist/src/lib/plot/ScatterPlot.svelte +0 -2778
  707. package/dist/src/lib/plot/ScatterPlot3D.svelte +0 -529
  708. package/dist/src/lib/plot/ScatterPlot3DControls.svelte +0 -437
  709. package/dist/src/lib/plot/ScatterPlot3DScene.svelte +0 -912
  710. package/dist/src/lib/plot/ScatterPlotControls.svelte +0 -306
  711. package/dist/src/lib/plot/ScatterPoint.svelte +0 -182
  712. package/dist/src/lib/plot/SpacegroupBarPlot.svelte +0 -293
  713. package/dist/src/lib/plot/Surface3D.svelte +0 -197
  714. package/dist/src/lib/plot/ZeroLines.svelte +0 -97
  715. package/dist/src/lib/plot/ZoomRect.svelte +0 -23
  716. package/dist/src/lib/plot/adaptive-density.ts +0 -316
  717. package/dist/src/lib/plot/auto-place.ts +0 -184
  718. package/dist/src/lib/plot/axis-utils.ts +0 -122
  719. package/dist/src/lib/plot/binned-scatter-types.ts +0 -83
  720. package/dist/src/lib/plot/data-cleaning.ts +0 -1069
  721. package/dist/src/lib/plot/data-transform.ts +0 -69
  722. package/dist/src/lib/plot/defaults.ts +0 -9
  723. package/dist/src/lib/plot/fill-utils.ts +0 -494
  724. package/dist/src/lib/plot/hover-lock.svelte.ts +0 -60
  725. package/dist/src/lib/plot/index.ts +0 -53
  726. package/dist/src/lib/plot/interactions.ts +0 -119
  727. package/dist/src/lib/plot/layout.ts +0 -425
  728. package/dist/src/lib/plot/reference-line.ts +0 -426
  729. package/dist/src/lib/plot/scales.ts +0 -654
  730. package/dist/src/lib/plot/svg.ts +0 -23
  731. package/dist/src/lib/plot/types.ts +0 -1144
  732. package/dist/src/lib/plot/utils/label-placement.ts +0 -541
  733. package/dist/src/lib/plot/utils/series-visibility.ts +0 -140
  734. package/dist/src/lib/plot/utils.ts +0 -11
  735. package/dist/src/lib/rdf/RdfPlot.svelte +0 -247
  736. package/dist/src/lib/rdf/calc-rdf.ts +0 -167
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  743. package/dist/src/lib/spectral/Dos.svelte +0 -697
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  747. package/dist/src/lib/state.svelte.ts +0 -64
  748. package/dist/src/lib/structure/Arrow.svelte +0 -72
  749. package/dist/src/lib/structure/AtomLegend.svelte +0 -815
  750. package/dist/src/lib/structure/Bond.svelte +0 -140
  751. package/dist/src/lib/structure/CanvasTooltip.svelte +0 -33
  752. package/dist/src/lib/structure/CellSelect.svelte +0 -349
  753. package/dist/src/lib/structure/Cylinder.svelte +0 -45
  754. package/dist/src/lib/structure/Lattice.svelte +0 -196
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  756. package/dist/src/lib/structure/StructureControls.svelte +0 -1273
  757. package/dist/src/lib/structure/StructureExportPane.svelte +0 -252
  758. package/dist/src/lib/structure/StructureInfoPane.svelte +0 -737
  759. package/dist/src/lib/structure/StructureScene.svelte +0 -2255
  760. package/dist/src/lib/structure/atom-properties.ts +0 -316
  761. package/dist/src/lib/structure/bond-order-perception.ts +0 -447
  762. package/dist/src/lib/structure/bonding.ts +0 -944
  763. package/dist/src/lib/structure/export.ts +0 -861
  764. package/dist/src/lib/structure/index.ts +0 -291
  765. package/dist/src/lib/structure/label-placement.ts +0 -130
  766. package/dist/src/lib/structure/measure.ts +0 -45
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  777. package/dist/src/lib/table/HeatmapTable.svelte +0 -1833
  778. package/dist/src/lib/table/ToggleMenu.svelte +0 -385
  779. package/dist/src/lib/table/index.ts +0 -139
  780. package/dist/src/lib/theme/ThemeControl.svelte +0 -53
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  782. package/dist/src/lib/time.ts +0 -71
  783. package/dist/src/lib/tooltip/TooltipContent.svelte +0 -58
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  807. package/dist/src/lib/xrd/calc-xrd.ts +0 -397
  808. package/dist/src/lib/xrd/index.ts +0 -38
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  811. package/icon.png +0 -0
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  813. package/matterviz-0.3.4.vsix +0 -0
  814. package/matterviz-0.3.5.vsix +0 -0
  815. package/scripts/sync-config.ts +0 -101
  816. package/src/declarations.d.ts +0 -2
  817. package/src/extension.ts +0 -972
  818. package/src/node-io.ts +0 -65
  819. package/src/types.ts +0 -17
  820. package/src/webview/JsonBrowser.svelte +0 -1079
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  822. package/src/webview/detect.ts +0 -444
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  824. package/src/webview/plot-utils.ts +0 -250
  825. package/test-fixtures/all-viz-types.json.gz +0 -0
  826. package/test-fixtures/plot-demo-data.json.gz +0 -0
  827. package/tests/detect.test.ts +0 -604
  828. package/tests/extension.test.ts +0 -2041
  829. package/tests/node-io.test.ts +0 -39
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  831. package/tests/vite-plugin-json-gz.test.ts +0 -114
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  833. package/tests/webview.test.ts +0 -231
  834. package/tsconfig.json +0 -20
  835. package/vite-plugin-json-gz.ts +0 -29
  836. package/vite.config.ts +0 -34
  837. package/vite.extension.config.ts +0 -34
  838. /package/dist/{src/lib/EmptyState.svelte → EmptyState.svelte} +0 -0
  839. /package/dist/{src/lib/Icon.svelte → Icon.svelte} +0 -0
  840. /package/dist/{src/lib/app.css → app.css} +0 -0
  841. /package/dist/{src/lib/chempot-diagram → chempot-diagram}/ChemPotScene3D.svelte +0 -0
  842. /package/dist/{src/lib/colors → colors}/alloy-colors.json +0 -0
  843. /package/dist/{src/lib/colors → colors}/dark-mode-colors.json +0 -0
  844. /package/dist/{src/lib/colors → colors}/jmol-colors.json +0 -0
  845. /package/dist/{src/lib/colors → colors}/muted-colors.json +0 -0
  846. /package/dist/{src/lib/colors → colors}/pastel-colors.json +0 -0
  847. /package/dist/{src/lib/colors → colors}/vesta-colors.json +0 -0
  848. /package/dist/{src/lib/convex-hull → convex-hull}/TemperatureSlider.svelte +0 -0
  849. /package/dist/{src/lib/element → element}/BohrAtom.svelte +0 -0
  850. /package/dist/{src/lib/element → element}/Nucleus.svelte +0 -0
  851. /package/dist/{src/lib/element → element}/data.json +0 -0
  852. /package/dist/{src/lib/element → element}/data.json.gz +0 -0
  853. /package/dist/{src/lib/element → element}/data.json.gz.d.ts +0 -0
  854. /package/dist/{src/lib/element → element}/data.schema.json +0 -0
  855. /package/dist/{src/lib/element-image-urls.json → element-image-urls.json} +0 -0
  856. /package/dist/{src/lib/feedback → feedback}/Spinner.svelte +0 -0
  857. /package/dist/{src/lib/feedback → feedback}/StatusMessage.svelte +0 -0
  858. /package/dist/{src/lib/layout → layout}/json-tree/JsonValue.svelte +0 -0
  859. /package/dist/{src/lib/periodic-table → periodic-table}/TableInset.svelte +0 -0
  860. /package/dist/{src/lib/plot → plot}/FillArea.svelte +0 -0
  861. /package/dist/{src/lib/plot → plot}/ReferenceLine.svelte +0 -0
  862. /package/dist/{src/lib/theme → theme}/themes.mjs +0 -0
  863. /package/dist/{src/lib/xrd → xrd}/atomic_scattering_params.json +0 -0
@@ -1,815 +0,0 @@
1
- <script lang="ts">
2
- import { contrast_color, default_element_colors } from '$lib/colors'
3
- import type { CompositionType } from '$lib/composition'
4
- import type { ElementSymbol } from '$lib/element'
5
- import { element_data } from '$lib/element'
6
- import Icon from '$lib/Icon.svelte'
7
- import { ELEM_SYMBOLS, format_num } from '$lib/labels'
8
- import { ColorBar } from '$lib/plot'
9
- import { SETTINGS_CONFIG } from '$lib/settings'
10
- import { colors } from '$lib/state.svelte'
11
- import type { AnyStructure } from '$lib/structure'
12
- import { atomic_radii } from '$lib/structure'
13
- import type {
14
- AtomColorConfig,
15
- AtomPropertyColors,
16
- } from '$lib/structure/atom-properties'
17
- import type { MoyoDataset } from '@spglib/moyo-wasm'
18
- import type { Snippet } from 'svelte'
19
- import { click_outside, tooltip } from 'svelte-multiselect/attachments'
20
- import type { HTMLAttributes } from 'svelte/elements'
21
- import { SvelteMap, SvelteSet } from 'svelte/reactivity'
22
-
23
- let {
24
- atom_color_config = $bindable({
25
- mode: `element`,
26
- scale: undefined,
27
- scale_type: `continuous`,
28
- }),
29
- property_colors = null,
30
- elements,
31
- elem_color_picker_title = `Double click to reset color`,
32
- labels = $bindable([]),
33
- amount_format = `.3~f`,
34
- show_amounts = true,
35
- get_element_label,
36
- hidden_elements = $bindable(new SvelteSet()),
37
- hidden_prop_vals = $bindable(new SvelteSet<number | string>()),
38
- // Element remapping: maps original element symbols to new ones
39
- element_mapping = $bindable(),
40
- // Per-element and per-site radius overrides
41
- element_radius_overrides = $bindable<Partial<Record<ElementSymbol, number>>>({}),
42
- site_radius_overrides = $bindable<SvelteMap<number, number>>(new SvelteMap()),
43
- selected_sites = [] as number[],
44
- title = ``,
45
- sym_data = null,
46
- structure = undefined,
47
- show_mode_toggle = true,
48
- children,
49
- ...rest
50
- }: Omit<HTMLAttributes<HTMLDivElement>, `children`> & {
51
- atom_color_config?: Partial<AtomColorConfig>
52
- property_colors?: AtomPropertyColors | null
53
- elements?: CompositionType
54
- elem_color_picker_title?: string
55
- labels?: HTMLLabelElement[]
56
- amount_format?: string // Float formatting for element amounts (default: 3 significant digits)
57
- show_amounts?: boolean // Whether to show element amounts
58
- get_element_label?: (element: string, amount: number) => string // Custom label function
59
- hidden_elements?: Set<ElementSymbol>
60
- hidden_prop_vals?: Set<number | string> // Track hidden property values (e.g. Wyckoff positions, coordination numbers)
61
- // Element remapping: maps original element symbols to new ones (e.g. {'H': 'Na', 'He': 'Cl'})
62
- element_mapping?: Partial<Record<ElementSymbol, ElementSymbol>>
63
- // Per-element and per-site radius overrides (absolute values in Angstroms)
64
- element_radius_overrides?: Partial<Record<ElementSymbol, number>>
65
- site_radius_overrides?: Map<number, number> | SvelteMap<number, number>
66
- selected_sites?: number[] // Currently selected site indices
67
- title?: string
68
- sym_data?: MoyoDataset | null
69
- structure?: AnyStructure | null
70
- show_mode_toggle?: boolean
71
- children?: Snippet<[{ mode_menu_open: boolean; structure?: AnyStructure | null }]>
72
- } = $props()
73
-
74
- const titles = {
75
- coordination: `Coordination`,
76
- wyckoff: `Wyckoff Position`,
77
- }
78
-
79
- let show_element_legend = $derived(
80
- atom_color_config.mode === `element` && elements &&
81
- Object.keys(elements).length > 0,
82
- )
83
- let show_property_legend = $derived(
84
- atom_color_config.mode !== `element` && property_colors?.colors.length,
85
- )
86
- let legend_title = $derived(
87
- title || titles[atom_color_config.mode as keyof typeof titles] || ``,
88
- )
89
-
90
- // Dropdown state
91
- let mode_menu_open = $state(false)
92
- let mode_toggle_visible = $derived(show_mode_toggle || mode_menu_open)
93
-
94
- // Clear hidden property values when switching modes (since they may not be valid)
95
- let prev_mode = $state(atom_color_config.mode)
96
- $effect(() => {
97
- if (atom_color_config.mode !== prev_mode) {
98
- hidden_prop_vals.clear()
99
- prev_mode = atom_color_config.mode
100
- }
101
- })
102
-
103
- // Normalize incoming Map to SvelteMap at boundary for reactivity
104
- // This preserves identity for bindings while ensuring SvelteMap methods work
105
- $effect(() => {
106
- if (site_radius_overrides && !(site_radius_overrides instanceof SvelteMap)) {
107
- site_radius_overrides = new SvelteMap(site_radius_overrides)
108
- }
109
- })
110
- // Format display values based on mode
111
- let format_value = (val: number | string): string => {
112
- if (typeof val === `number`) return format_num(val, `.3~f`)
113
-
114
- if (typeof val === `string` && val.includes(`|`)) { // Format Wyckoff orbit IDs
115
- const [wyckoff, element] = val.split(`|`, 2)
116
- // Count how many sites have this wyckoff+element combination
117
- const count = property_colors?.values.filter((property_value) =>
118
- property_value === val
119
- ).length ?? 0
120
- return `${element}:${count}${wyckoff}`
121
- }
122
- return String(val)
123
- }
124
-
125
- // Map from property value to color (computed once, reused in categorical legend)
126
- let color_map = $derived(
127
- new Map(
128
- // Use unique_values instead of values to avoid undefined colors from duplicates
129
- property_colors?.unique_values?.flatMap((val) => {
130
- const idx = property_colors.values.indexOf(val)
131
- return idx >= 0 ? [[val, property_colors.colors[idx]]] : []
132
- }) ?? [],
133
- ),
134
- )
135
-
136
- function toggle_visibility<T>(
137
- set: Set<T>,
138
- value: T,
139
- event: MouseEvent,
140
- ): Set<T> {
141
- event.preventDefault()
142
- event.stopPropagation()
143
- const new_set = new SvelteSet(set)
144
- if (new_set.has(value)) new_set.delete(value)
145
- else new_set.add(value)
146
- return new_set
147
- }
148
-
149
- // Element remapping state
150
- let remap_menu_open = $state<ElementSymbol | null>(null)
151
- let remap_search = $state(``)
152
-
153
- // Filtered elements based on search
154
- let filtered_elements = $derived.by(() => {
155
- if (!remap_search) return ELEM_SYMBOLS
156
- const query = remap_search.toLowerCase()
157
- return ELEM_SYMBOLS.filter((elem) => {
158
- const data = element_data?.find((el) => el.symbol === elem)
159
- return elem.toLowerCase().includes(query) ||
160
- data?.name?.toLowerCase().includes(query)
161
- })
162
- })
163
-
164
- const known_element_symbols = new Set(ELEM_SYMBOLS)
165
- let sorted_element_entries = $derived.by(() => {
166
- if (!elements) return []
167
- const element_amounts = elements as Record<string, number>
168
- const ordered_known_entries = ELEM_SYMBOLS
169
- .flatMap((element_symbol) => {
170
- const amount = element_amounts[element_symbol]
171
- return amount === undefined ? [] : [[element_symbol, amount] as const]
172
- })
173
- const unknown_entries = Object.entries(element_amounts)
174
- .filter(([element_symbol]) =>
175
- !known_element_symbols.has(element_symbol as ElementSymbol)
176
- )
177
- .sort(([element_a], [element_b]) => element_a.localeCompare(element_b))
178
- return [...ordered_known_entries, ...unknown_entries]
179
- })
180
-
181
- function remap_element(from: ElementSymbol, to: ElementSymbol) {
182
- if (from === to && element_mapping?.[from]) {
183
- // Remove mapping if mapping back to original element
184
- const { [from]: _removed_mapping, ...mapping } = element_mapping
185
- element_mapping = Object.keys(mapping).length > 0 ? mapping : undefined
186
- } else if (from !== to) {
187
- element_mapping = { ...element_mapping, [from]: to }
188
- }
189
- remap_menu_open = null
190
- remap_search = ``
191
- }
192
-
193
- // Radius bounds (Angstroms) - max accommodates largest atomic radii (~2.6Å for Cs)
194
- const MIN_RADIUS = 0.1
195
- const MAX_RADIUS = 5
196
-
197
- const parse_radius = (value: string): number | null => {
198
- const num = parseFloat(value)
199
- return !isNaN(num) && num >= MIN_RADIUS && num <= MAX_RADIUS ? num : null
200
- }
201
-
202
- function update_element_radius(elem: ElementSymbol, value: string) {
203
- const radius = parse_radius(value)
204
- if (radius !== null) {
205
- element_radius_overrides = { ...element_radius_overrides, [elem]: radius }
206
- }
207
- }
208
-
209
- function clear_element_radius(elem: ElementSymbol) {
210
- const { [elem]: _removed_radius, ...radii } = element_radius_overrides ?? {}
211
- element_radius_overrides = radii
212
- }
213
-
214
- const get_element_radius = (elem: ElementSymbol): number =>
215
- element_radius_overrides?.[elem] ?? atomic_radii[elem] ?? 1
216
-
217
- // Mutate in-place to preserve map identity for bindings (aligns with Structure.svelte pattern)
218
- function update_site_radius(site_idx: number, value: string) {
219
- const radius = parse_radius(value)
220
- if (radius === null) return
221
- site_radius_overrides?.set(site_idx, radius)
222
- }
223
-
224
- function clear_site_radius(site_idx: number) {
225
- site_radius_overrides?.delete(site_idx)
226
- }
227
-
228
- const get_site_radius = (site_idx: number): number => {
229
- const override = site_radius_overrides?.get(site_idx)
230
- if (override !== undefined) return override
231
- const element = structure?.sites?.[site_idx]?.species[0]?.element as
232
- | ElementSymbol
233
- | undefined
234
- return element ? get_element_radius(element) : 1
235
- }
236
- </script>
237
-
238
- {#snippet mode_selector_snippet()}
239
- <div
240
- class="mode-selector"
241
- {@attach click_outside({ callback: () => mode_menu_open = false })}
242
- >
243
- <button
244
- class="mode-toggle"
245
- class:visible={mode_toggle_visible}
246
- onclick={() => (mode_menu_open = !mode_menu_open)}
247
- title="Change atom coloring mode"
248
- aria-expanded={mode_menu_open}
249
- aria-hidden={mode_toggle_visible ? undefined : true}
250
- tabindex={mode_toggle_visible ? undefined : -1}
251
- {@attach tooltip()}
252
- >
253
- <Icon icon={mode_menu_open ? `Collapse` : `Expand`} />
254
- </button>
255
- {#if mode_menu_open}
256
- <div class="mode-dropdown">
257
- {#each Object.entries(SETTINGS_CONFIG.structure.atom_color_mode.enum || {}) as
258
- [value, label]
259
- (value)
260
- }
261
- <button
262
- class="mode-option"
263
- class:selected={atom_color_config.mode === value}
264
- class:disabled={value === `wyckoff` && !sym_data}
265
- disabled={value === `wyckoff` && !sym_data}
266
- onclick={() => {
267
- atom_color_config.mode = value as AtomColorConfig[`mode`]
268
- if (atom_color_config.mode === `wyckoff`) {
269
- atom_color_config.scale_type = `categorical`
270
- } else if (atom_color_config.mode === `coordination`) {
271
- atom_color_config.scale_type = `continuous`
272
- }
273
- mode_menu_open = false
274
- }}
275
- >
276
- <span>{titles[value as keyof typeof titles] || label}</span>
277
- </button>
278
- {/each}
279
- </div>
280
- {/if}
281
- </div>
282
- {/snippet}
283
-
284
- {#snippet site_radius_control_snippet()}
285
- {#if selected_sites.length === 1}
286
- {@const site_idx = selected_sites[0]}
287
- {@const site = structure?.sites?.[site_idx]}
288
- {#if site}
289
- {@const main_elem = site.species[0]?.element ?? `?`}
290
- <div class="site-radius-control">
291
- <label
292
- title="Radius for selected site {site_idx}"
293
- {@attach tooltip({ placement: `top` })}
294
- >
295
- <span class="site-label">{main_elem}{site_idx}</span>
296
- <input
297
- type="number"
298
- min={MIN_RADIUS}
299
- max={MAX_RADIUS}
300
- step={0.05}
301
- value={get_site_radius(site_idx)}
302
- oninput={(event) => {
303
- if (event.target instanceof HTMLInputElement) {
304
- update_site_radius(site_idx, event.target.value)
305
- }
306
- }}
307
- />
308
- <span class="unit">Å</span>
309
- </label>
310
- {#if site_radius_overrides?.has(site_idx)}
311
- <button
312
- class="reset-btn"
313
- onclick={() => clear_site_radius(site_idx)}
314
- title="Reset to element default"
315
- {@attach tooltip({ placement: `top` })}
316
- >
317
-
318
- </button>
319
- {/if}
320
- </div>
321
- {/if}
322
- {/if}
323
- {/snippet}
324
-
325
- {#if show_element_legend}
326
- <div {...rest} class="atom-legend element-legend {rest.class ?? ``}">
327
- {#each sorted_element_entries as [elem, amt], idx (elem)}
328
- {@const is_hidden = hidden_elements.has(elem as ElementSymbol)}
329
- {@const displayed_elem = element_mapping?.[elem as ElementSymbol] || elem}
330
- <div class="legend-item">
331
- <label
332
- bind:this={labels[idx]}
333
- title="{element_data?.find((el) => el.symbol === displayed_elem)?.name ?? ``}{displayed_elem !== elem ? ` (remapped from ${elem})` : ``}"
334
- {@attach tooltip()}
335
- style:background-color={colors.element[displayed_elem]}
336
- class:hidden={is_hidden}
337
- class:remapped={displayed_elem !== elem}
338
- ondblclick={(event) => {
339
- event.preventDefault()
340
- colors.element[displayed_elem] = default_element_colors[displayed_elem]
341
- }}
342
- oncontextmenu={(event) => {
343
- event.preventDefault()
344
- remap_menu_open = remap_menu_open === elem ? null : (elem as ElementSymbol)
345
- remap_search = ``
346
- }}
347
- {@attach contrast_color()}
348
- >
349
- {#if get_element_label}
350
- {get_element_label(displayed_elem, amt)}
351
- {:else}
352
- {displayed_elem}
353
- {#if show_amounts}
354
- <sub>{format_num(amt, amount_format)}</sub>
355
- {/if}
356
- {/if}
357
- <input
358
- type="color"
359
- bind:value={colors.element[elem]}
360
- title={elem_color_picker_title}
361
- />
362
- </label>
363
- <button
364
- class="toggle-visibility"
365
- class:element-hidden={is_hidden}
366
- onclick={(
367
- event,
368
- ) => (hidden_elements = toggle_visibility(
369
- hidden_elements,
370
- elem as ElementSymbol,
371
- event,
372
- ))}
373
- title={is_hidden ? `Show ${elem} atoms` : `Hide ${elem} atoms`}
374
- {@attach tooltip({ placement: `top` })}
375
- type="button"
376
- >
377
- ×
378
- </button>
379
- {#if remap_menu_open === elem}
380
- <div
381
- class="remap-dropdown"
382
- {@attach click_outside({
383
- callback: () => {
384
- remap_menu_open = null
385
- remap_search = ``
386
- },
387
- })}
388
- >
389
- <div class="radius-control">
390
- <label
391
- title={displayed_elem !== elem
392
- ? `Radius for ${elem} atoms (displayed as ${displayed_elem})`
393
- : `Radius for ${elem} atoms`}
394
- {@attach tooltip({ placement: `top` })}
395
- >
396
- <span>Radius ({elem})</span>
397
- <input
398
- type="number"
399
- min={MIN_RADIUS}
400
- max={MAX_RADIUS}
401
- step={0.05}
402
- value={get_element_radius(elem as ElementSymbol)}
403
- oninput={(event) => {
404
- if (event.target instanceof HTMLInputElement) {
405
- update_element_radius(
406
- elem as ElementSymbol,
407
- event.target.value,
408
- )
409
- }
410
- }}
411
- />
412
- <span class="unit">Å</span>
413
- </label>
414
- {#if element_radius_overrides?.[elem as ElementSymbol] !== undefined}
415
- <button
416
- class="reset-btn"
417
- onclick={() => clear_element_radius(elem as ElementSymbol)}
418
- title="Reset to default radius"
419
- {@attach tooltip({ placement: `top` })}
420
- >
421
-
422
- </button>
423
- {/if}
424
- </div>
425
- <input
426
- type="text"
427
- class="remap-search"
428
- placeholder="Search elements..."
429
- bind:value={remap_search}
430
- onkeydown={(event) => {
431
- if (event.key === `Escape`) {
432
- remap_menu_open = null
433
- remap_search = ``
434
- } else if (event.key === `Enter` && filtered_elements.length > 0) {
435
- remap_element(elem as ElementSymbol, filtered_elements[0])
436
- }
437
- }}
438
- />
439
- <div class="remap-options">
440
- {#if displayed_elem !== elem}
441
- <button
442
- class="remap-option reset"
443
- onclick={() => remap_element(elem as ElementSymbol, elem as ElementSymbol)}
444
- >
445
- <span>Reset to {elem}</span>
446
- </button>
447
- {/if}
448
- {#each filtered_elements as target_elem (target_elem)}
449
- {@const elem_info = element_data?.find((el) => el.symbol === target_elem)}
450
- <button
451
- class="remap-option"
452
- class:selected={displayed_elem === target_elem}
453
- onclick={() => remap_element(elem as ElementSymbol, target_elem)}
454
- style:background-color={colors.element[target_elem]}
455
- {@attach contrast_color()}
456
- >
457
- <small style="opacity: 0.6">{elem_info?.number}</small>
458
- <b>{target_elem}</b>
459
- {elem_info?.name}
460
- </button>
461
- {/each}
462
- </div>
463
- </div>
464
- {/if}
465
- </div>
466
- {/each}
467
- {@render site_radius_control_snippet()}
468
- {@render mode_selector_snippet()}
469
- {@render children?.({ mode_menu_open, structure })}
470
- </div>
471
- {:else if show_property_legend}
472
- <div
473
- class="atom-legend property-legend atom-color-legend"
474
- class:categorical-legend={atom_color_config.scale_type === `categorical`}
475
- {...rest}
476
- >
477
- {#if legend_title}
478
- <div class="legend-header">
479
- <h4>{legend_title}</h4>
480
- </div>
481
- {/if}
482
- {#if atom_color_config.scale_type === `continuous` && property_colors}
483
- <div
484
- title={legend_title}
485
- {@attach tooltip({ placement: `top` })}
486
- >
487
- <ColorBar
488
- color_scale={atom_color_config.scale}
489
- range={[property_colors.min_value ?? 0, property_colors.max_value ?? 0]}
490
- tick_labels={Array.from(
491
- new Set([property_colors.min_value ?? 0, property_colors.max_value ?? 0]),
492
- )}
493
- tick_side="secondary"
494
- bar_style="height: 10px; width: 100px;"
495
- wrapper_style="padding: 0; gap: 2px;"
496
- style="margin-top: 0"
497
- tick_format=".3~f"
498
- />
499
- </div>
500
- {:else if atom_color_config.scale_type === `categorical` && property_colors}
501
- {#each property_colors.unique_values || [] as
502
- value
503
- (`${atom_color_config.mode}-${value}`)
504
- }
505
- {@const color = color_map.get(value)}
506
- {@const is_hidden = hidden_prop_vals.has(value)}
507
- <div class="legend-item">
508
- <span
509
- class="category-label color-swatch"
510
- class:hidden={is_hidden}
511
- style:background-color={color}
512
- {@attach contrast_color()}
513
- >
514
- {format_value(value)}
515
- </span>
516
- <button
517
- class="toggle-visibility"
518
- class:element-hidden={is_hidden}
519
- onclick={(
520
- event,
521
- ) => (hidden_prop_vals = toggle_visibility(
522
- hidden_prop_vals,
523
- value,
524
- event,
525
- ))}
526
- title={is_hidden ? `Show ${format_value(value)}` : `Hide ${format_value(value)}`}
527
- {@attach tooltip({ placement: `top` })}
528
- type="button"
529
- >
530
- ×
531
- </button>
532
- </div>
533
- {/each}
534
- {/if}
535
- {@render site_radius_control_snippet()}
536
- {@render mode_selector_snippet()}
537
- {@render children?.({ mode_menu_open, structure })}
538
- </div>
539
- {/if}
540
-
541
- <style>
542
- .atom-legend {
543
- position: absolute;
544
- z-index: var(--legend-z-index, 1);
545
- pointer-events: auto;
546
- visibility: visible;
547
- filter: var(--legend-filter, grayscale(10%) brightness(0.95) saturate(0.8));
548
- display: flex;
549
- align-items: center;
550
- bottom: var(--struct-legend-bottom, clamp(4pt, 3cqmin, 8pt));
551
- right: var(--struct-legend-right, clamp(4pt, 3cqmin, 8pt));
552
- gap: var(--struct-legend-gap, clamp(3pt, 2cqmin, 7pt));
553
- }
554
- .element-legend {
555
- font-size: var(--struct-legend-font, clamp(7pt, 2.5cqmin, 12pt));
556
- }
557
- .atom-legend .legend-item {
558
- position: relative;
559
- display: inline-block;
560
- }
561
- .element-legend label {
562
- padding: var(--struct-legend-padding, 0 4pt);
563
- border-radius: var(--struct-legend-radius, var(--border-radius, 3pt));
564
- line-height: var(--struct-legend-line-height, 1.3);
565
- display: inline-block;
566
- cursor: pointer;
567
- visibility: visible;
568
- white-space: nowrap;
569
- transition: opacity 0.2s ease;
570
- }
571
- .element-legend label.hidden {
572
- opacity: 0.4;
573
- }
574
- .element-legend label input[type='color'] {
575
- z-index: var(--struct-legend-input-z, 1);
576
- opacity: 0;
577
- position: absolute;
578
- visibility: hidden;
579
- top: 7pt;
580
- left: 0;
581
- }
582
- /* Toggle visibility button - shared between element and property legends */
583
- .atom-legend button.toggle-visibility {
584
- position: absolute;
585
- top: -3px;
586
- right: -7px;
587
- width: 1em;
588
- height: 1em;
589
- padding: 0;
590
- margin: 0;
591
- border: none;
592
- background: light-dark(rgba(0, 0, 0, 0.5), rgba(255, 255, 255, 0.5));
593
- color: light-dark(white, black);
594
- border-radius: 50%;
595
- font-size: 0.9em;
596
- line-height: 1;
597
- cursor: pointer;
598
- display: grid;
599
- place-items: center;
600
- opacity: 0;
601
- transition: opacity 0.2s ease, background 0.2s ease, transform 0.1s ease;
602
- z-index: 2;
603
- pointer-events: auto;
604
- }
605
- .atom-legend button.toggle-visibility.element-hidden,
606
- .atom-legend .legend-item:hover button.toggle-visibility {
607
- opacity: 1;
608
- }
609
- .atom-legend button.toggle-visibility:hover {
610
- background: light-dark(rgba(0, 0, 0, 0.8), rgba(255, 255, 255, 0.8));
611
- transform: scale(1.15);
612
- }
613
- .element-legend sub {
614
- font-size: 0.85em;
615
- margin: 0 0 0 -2pt;
616
- }
617
- .element-legend label.remapped {
618
- outline: 2px dashed var(--accent-color, #4a90d9);
619
- outline-offset: 1px;
620
- }
621
- .remap-dropdown {
622
- position: absolute;
623
- bottom: 100%;
624
- left: 50%;
625
- transform: translateX(-50%);
626
- margin-bottom: 0.4rem;
627
- background: var(--surface-bg);
628
- border-radius: var(--border-radius, 3pt);
629
- box-shadow: 0 4px 8px rgba(0, 0, 0, 0.25);
630
- }
631
- .remap-search {
632
- width: 100%;
633
- padding: 0.25rem 0.4rem;
634
- border: none;
635
- box-sizing: border-box;
636
- }
637
- .remap-search:focus {
638
- outline: none;
639
- }
640
- .remap-options {
641
- max-height: 250px;
642
- overflow-y: auto;
643
- }
644
- .remap-option {
645
- display: flex;
646
- gap: 3pt;
647
- place-items: center;
648
- width: 100%;
649
- border-radius: 0;
650
- }
651
- .remap-option:hover {
652
- filter: brightness(1.1);
653
- }
654
- .remap-option.selected {
655
- outline: 2px solid var(--accent-color);
656
- outline-offset: -2px;
657
- }
658
- .remap-option.reset {
659
- background: var(--surface-bg-hover, rgba(128, 128, 128, 0.1));
660
- font-style: italic;
661
- }
662
-
663
- /* Radius Control Styles */
664
- :is(.radius-control, .site-radius-control) {
665
- display: flex;
666
- align-items: center;
667
- gap: 4pt;
668
- padding: 0.3rem 0.4rem;
669
- border-bottom: 1px solid light-dark(rgba(0, 0, 0, 0.1), rgba(255, 255, 255, 0.1));
670
-
671
- & label {
672
- display: flex;
673
- align-items: center;
674
- gap: 4pt;
675
- font-size: 0.85em;
676
- white-space: nowrap;
677
- }
678
- & input[type='number'] {
679
- width: 3.5em;
680
- padding: 2pt 4pt;
681
- border: 1px solid light-dark(rgba(0, 0, 0, 0.2), rgba(255, 255, 255, 0.2));
682
- border-radius: var(--border-radius, 3pt);
683
- font-size: 0.9em;
684
- text-align: center;
685
- box-sizing: border-box;
686
- &:focus {
687
- outline: 1px solid var(--accent-color, #4a90d9);
688
- }
689
- }
690
- & .unit {
691
- font-size: 0.8em;
692
- opacity: 0.7;
693
- }
694
- & .reset-btn {
695
- background: transparent;
696
- border: none;
697
- padding: 2pt 4pt;
698
- cursor: pointer;
699
- font-size: 0.9em;
700
- opacity: 0.6;
701
- transition: opacity 0.15s ease;
702
- &:hover {
703
- opacity: 1;
704
- }
705
- }
706
- }
707
- .site-radius-control {
708
- border-bottom: none;
709
- padding: 0.2rem 0.4rem;
710
- background: light-dark(rgba(0, 0, 0, 0.05), rgba(255, 255, 255, 0.05));
711
- border-radius: var(--border-radius, 3pt);
712
- & .site-label {
713
- font-weight: 500;
714
- min-width: 2em;
715
- }
716
- }
717
-
718
- /* Property Legend Styles */
719
- .property-legend {
720
- font-size: var(--struct-legend-font, clamp(8pt, 3cqmin, 14pt));
721
- }
722
- .mode-selector {
723
- position: relative;
724
- display: flex;
725
- align-items: center;
726
- margin-left: calc(-0.5 * var(--struct-legend-gap, clamp(3pt, 2cqmin, 7pt)));
727
- }
728
- .mode-toggle {
729
- background: transparent;
730
- border: none;
731
- padding: 0;
732
- cursor: pointer;
733
- display: flex;
734
- align-items: center;
735
- font-size: 0.9em;
736
- opacity: 0;
737
- pointer-events: none;
738
- transition: opacity 0.2s ease;
739
- }
740
- .mode-toggle :global(svg) {
741
- font-size: 1.15em;
742
- }
743
- .mode-toggle.visible {
744
- opacity: 0.7;
745
- pointer-events: auto;
746
- }
747
- .mode-toggle.visible:hover {
748
- opacity: 1;
749
- }
750
- .mode-dropdown {
751
- position: absolute;
752
- bottom: 100%;
753
- right: 0;
754
- margin-bottom: 0.25rem;
755
- background: var(--surface-bg);
756
- border-radius: var(--border-radius, 3pt);
757
- box-shadow: 0 8px 16px -4px rgba(0, 0, 0, 0.3), 0 4px 8px -2px rgba(0, 0, 0, 0.1);
758
- display: flex;
759
- flex-direction: column;
760
- z-index: 10;
761
- min-width: 150px;
762
- }
763
- .mode-option {
764
- display: flex;
765
- align-items: center;
766
- width: 100%;
767
- padding: 0.4rem 0.6rem;
768
- box-sizing: border-box;
769
- background: transparent;
770
- border: none;
771
- border-radius: 0;
772
- text-align: left;
773
- cursor: pointer;
774
- transition: background-color 0.15s ease;
775
- font-size: 0.85rem;
776
- }
777
- .mode-option:first-child {
778
- border-top-left-radius: var(--border-radius, 3pt);
779
- border-top-right-radius: var(--border-radius, 3pt);
780
- }
781
- .mode-option:last-child {
782
- border-bottom-left-radius: var(--border-radius, 3pt);
783
- border-bottom-right-radius: var(--border-radius, 3pt);
784
- }
785
- .mode-option:hover:not(.disabled) {
786
- background: var(--pane-btn-bg-hover, rgba(128, 128, 128, 0.1));
787
- }
788
- .mode-option.selected {
789
- color: var(--accent-color);
790
- font-weight: 500;
791
- }
792
- .mode-option.disabled {
793
- opacity: 0.5;
794
- cursor: not-allowed;
795
- }
796
- .mode-option span {
797
- white-space: nowrap;
798
- }
799
- .category-label {
800
- padding: var(--struct-legend-padding, 0 4pt);
801
- border-radius: var(--struct-legend-radius, var(--border-radius, 3pt));
802
- line-height: var(--struct-legend-line-height, 1.3);
803
- display: inline-block;
804
- white-space: nowrap;
805
- transition: opacity 0.2s ease;
806
- }
807
- .category-label.hidden {
808
- opacity: 0.4;
809
- }
810
- .legend-header h4 {
811
- margin: 0;
812
- font-size: 1em;
813
- font-weight: 600;
814
- }
815
- </style>