matterviz 0.3.2 → 0.3.4

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 (281) hide show
  1. package/dist/EmptyState.svelte +10 -2
  2. package/dist/FilePicker.svelte +123 -82
  3. package/dist/Icon.svelte +18 -12
  4. package/dist/MillerIndexInput.svelte +27 -21
  5. package/dist/api/optimade.js +6 -6
  6. package/dist/app.css +216 -207
  7. package/dist/brillouin/BrillouinZone.svelte +292 -149
  8. package/dist/brillouin/BrillouinZone.svelte.d.ts +1 -1
  9. package/dist/brillouin/BrillouinZoneControls.svelte +32 -5
  10. package/dist/brillouin/BrillouinZoneExportPane.svelte +69 -42
  11. package/dist/brillouin/BrillouinZoneExportPane.svelte.d.ts +1 -1
  12. package/dist/brillouin/BrillouinZoneInfoPane.svelte +99 -68
  13. package/dist/brillouin/BrillouinZoneScene.svelte +275 -163
  14. package/dist/brillouin/BrillouinZoneScene.svelte.d.ts +1 -1
  15. package/dist/brillouin/BrillouinZoneTooltip.svelte +17 -7
  16. package/dist/brillouin/compute.js +11 -6
  17. package/dist/chempot-diagram/ChemPotDiagram.svelte +162 -27
  18. package/dist/chempot-diagram/ChemPotDiagram2D.svelte +451 -281
  19. package/dist/chempot-diagram/ChemPotDiagram3D.svelte +2148 -1642
  20. package/dist/chempot-diagram/ChemPotScene3D.svelte +8 -5
  21. package/dist/chempot-diagram/async-compute.svelte.d.ts +3 -0
  22. package/dist/chempot-diagram/async-compute.svelte.js +77 -0
  23. package/dist/chempot-diagram/chempot-worker.d.ts +1 -0
  24. package/dist/chempot-diagram/chempot-worker.js +11 -0
  25. package/dist/chempot-diagram/color.js +1 -2
  26. package/dist/chempot-diagram/compute.d.ts +10 -0
  27. package/dist/chempot-diagram/compute.js +250 -88
  28. package/dist/chempot-diagram/index.d.ts +2 -1
  29. package/dist/chempot-diagram/index.js +2 -1
  30. package/dist/chempot-diagram/temperature.js +8 -9
  31. package/dist/chempot-diagram/types.d.ts +3 -0
  32. package/dist/chempot-diagram/types.js +1 -0
  33. package/dist/colors/index.d.ts +1 -1
  34. package/dist/colors/index.js +5 -3
  35. package/dist/composition/BarChart.svelte +128 -55
  36. package/dist/composition/BubbleChart.svelte +102 -49
  37. package/dist/composition/Composition.svelte +100 -79
  38. package/dist/composition/Formula.svelte +108 -62
  39. package/dist/composition/FormulaFilter.svelte +665 -537
  40. package/dist/composition/PieChart.svelte +183 -108
  41. package/dist/composition/format.d.ts +5 -0
  42. package/dist/composition/format.js +20 -3
  43. package/dist/composition/parse.js +14 -9
  44. package/dist/convex-hull/ConvexHull.svelte +93 -40
  45. package/dist/convex-hull/ConvexHull.svelte.d.ts +1 -1
  46. package/dist/convex-hull/ConvexHull2D.svelte +549 -360
  47. package/dist/convex-hull/ConvexHull2D.svelte.d.ts +1 -1
  48. package/dist/convex-hull/ConvexHull3D.svelte +1296 -827
  49. package/dist/convex-hull/ConvexHull3D.svelte.d.ts +1 -1
  50. package/dist/convex-hull/ConvexHull4D.svelte +1004 -688
  51. package/dist/convex-hull/ConvexHull4D.svelte.d.ts +1 -1
  52. package/dist/convex-hull/ConvexHullControls.svelte +115 -28
  53. package/dist/convex-hull/ConvexHullControls.svelte.d.ts +1 -1
  54. package/dist/convex-hull/ConvexHullInfoPane.svelte +29 -3
  55. package/dist/convex-hull/ConvexHullStats.svelte +425 -328
  56. package/dist/convex-hull/ConvexHullTooltip.svelte +40 -16
  57. package/dist/convex-hull/GasPressureControls.svelte +104 -61
  58. package/dist/convex-hull/StructurePopup.svelte +25 -4
  59. package/dist/convex-hull/TemperatureSlider.svelte +45 -25
  60. package/dist/convex-hull/barycentric-coords.js +13 -7
  61. package/dist/convex-hull/demo-temperature.js +8 -4
  62. package/dist/convex-hull/gas-thermodynamics.js +17 -12
  63. package/dist/convex-hull/helpers.d.ts +9 -0
  64. package/dist/convex-hull/helpers.js +77 -34
  65. package/dist/convex-hull/thermodynamics.js +61 -56
  66. package/dist/convex-hull/types.d.ts +9 -14
  67. package/dist/convex-hull/types.js +0 -17
  68. package/dist/coordination/CoordinationBarPlot.svelte +227 -154
  69. package/dist/element/BohrAtom.svelte +55 -12
  70. package/dist/element/ElementHeading.svelte +7 -2
  71. package/dist/element/ElementPhoto.svelte +15 -9
  72. package/dist/element/ElementStats.svelte +10 -4
  73. package/dist/element/ElementTile.svelte +137 -73
  74. package/dist/element/Nucleus.svelte +39 -11
  75. package/dist/element/data.js +1 -1
  76. package/dist/feedback/ClickFeedback.svelte +16 -5
  77. package/dist/feedback/DragOverlay.svelte +10 -2
  78. package/dist/feedback/Spinner.svelte +4 -2
  79. package/dist/feedback/StatusMessage.svelte +8 -2
  80. package/dist/fermi-surface/FermiSlice.svelte +118 -88
  81. package/dist/fermi-surface/FermiSurface.svelte +328 -187
  82. package/dist/fermi-surface/FermiSurface.svelte.d.ts +1 -1
  83. package/dist/fermi-surface/FermiSurfaceControls.svelte +113 -46
  84. package/dist/fermi-surface/FermiSurfaceControls.svelte.d.ts +1 -1
  85. package/dist/fermi-surface/FermiSurfaceScene.svelte +535 -342
  86. package/dist/fermi-surface/FermiSurfaceScene.svelte.d.ts +1 -1
  87. package/dist/fermi-surface/FermiSurfaceTooltip.svelte +14 -5
  88. package/dist/fermi-surface/compute.js +16 -20
  89. package/dist/fermi-surface/parse.js +24 -14
  90. package/dist/fermi-surface/symmetry.js +2 -7
  91. package/dist/fermi-surface/types.d.ts +3 -5
  92. package/dist/heatmap-matrix/HeatmapMatrix.svelte +1019 -765
  93. package/dist/heatmap-matrix/HeatmapMatrix.svelte.d.ts +1 -1
  94. package/dist/heatmap-matrix/HeatmapMatrixControls.svelte +76 -22
  95. package/dist/heatmap-matrix/HeatmapMatrixControls.svelte.d.ts +2 -3
  96. package/dist/icons.js +47 -0
  97. package/dist/index.d.ts +2 -1
  98. package/dist/index.js +2 -1
  99. package/dist/io/decompress.js +1 -1
  100. package/dist/io/export.d.ts +3 -0
  101. package/dist/io/export.js +129 -143
  102. package/dist/io/is-binary.js +2 -3
  103. package/dist/io/url-drop.js +1 -2
  104. package/dist/isosurface/Isosurface.svelte +202 -148
  105. package/dist/isosurface/IsosurfaceControls.svelte +46 -28
  106. package/dist/isosurface/parse.js +34 -29
  107. package/dist/isosurface/slice.js +5 -10
  108. package/dist/isosurface/types.d.ts +2 -1
  109. package/dist/isosurface/types.js +61 -12
  110. package/dist/labels.js +11 -8
  111. package/dist/layout/FullscreenToggle.svelte +11 -2
  112. package/dist/layout/InfoCard.svelte +38 -6
  113. package/dist/layout/InfoTag.svelte +63 -32
  114. package/dist/layout/PropertyFilter.svelte +82 -37
  115. package/dist/layout/SettingsSection.svelte +85 -55
  116. package/dist/layout/SubpageGrid.svelte +10 -2
  117. package/dist/layout/json-tree/JsonNode.svelte +183 -138
  118. package/dist/layout/json-tree/JsonTree.svelte +499 -413
  119. package/dist/layout/json-tree/JsonValue.svelte +127 -99
  120. package/dist/layout/json-tree/utils.js +4 -2
  121. package/dist/marching-cubes.js +25 -2
  122. package/dist/math.d.ts +13 -17
  123. package/dist/math.js +133 -67
  124. package/dist/overlays/ContextMenu.svelte +65 -40
  125. package/dist/overlays/DraggablePane.svelte +211 -139
  126. package/dist/periodic-table/PeriodicTable.svelte +278 -145
  127. package/dist/periodic-table/PeriodicTableControls.svelte +178 -128
  128. package/dist/periodic-table/PropertySelect.svelte +25 -7
  129. package/dist/periodic-table/TableInset.svelte +8 -3
  130. package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte +446 -309
  131. package/dist/phase-diagram/IsobaricBinaryPhaseDiagram.svelte.d.ts +1 -1
  132. package/dist/phase-diagram/PhaseDiagramControls.svelte +102 -43
  133. package/dist/phase-diagram/PhaseDiagramControls.svelte.d.ts +1 -1
  134. package/dist/phase-diagram/PhaseDiagramEditorPane.svelte +63 -40
  135. package/dist/phase-diagram/PhaseDiagramExportPane.svelte +71 -28
  136. package/dist/phase-diagram/PhaseDiagramExportPane.svelte.d.ts +1 -1
  137. package/dist/phase-diagram/PhaseDiagramTooltip.svelte +158 -101
  138. package/dist/phase-diagram/TdbInfoPanel.svelte +28 -4
  139. package/dist/phase-diagram/build-diagram.js +9 -9
  140. package/dist/phase-diagram/colors.js +1 -3
  141. package/dist/phase-diagram/parse.js +10 -9
  142. package/dist/phase-diagram/svg-to-diagram.js +53 -49
  143. package/dist/phase-diagram/utils.d.ts +1 -0
  144. package/dist/phase-diagram/utils.js +80 -25
  145. package/dist/plot/AxisLabel.svelte +28 -3
  146. package/dist/plot/BarPlot.svelte +1182 -734
  147. package/dist/plot/BarPlot.svelte.d.ts +2 -2
  148. package/dist/plot/BarPlotControls.svelte +31 -5
  149. package/dist/plot/BarPlotControls.svelte.d.ts +1 -1
  150. package/dist/plot/ColorBar.svelte +479 -329
  151. package/dist/plot/ColorScaleSelect.svelte +27 -6
  152. package/dist/plot/ElementScatter.svelte +36 -15
  153. package/dist/plot/FillArea.svelte +152 -95
  154. package/dist/plot/Histogram.svelte +934 -571
  155. package/dist/plot/Histogram.svelte.d.ts +1 -1
  156. package/dist/plot/HistogramControls.svelte +53 -9
  157. package/dist/plot/HistogramControls.svelte.d.ts +1 -1
  158. package/dist/plot/InteractiveAxisLabel.svelte +34 -11
  159. package/dist/plot/InteractiveAxisLabel.svelte.d.ts +1 -1
  160. package/dist/plot/Line.svelte +63 -28
  161. package/dist/plot/PlotControls.svelte +157 -114
  162. package/dist/plot/PlotControls.svelte.d.ts +1 -1
  163. package/dist/plot/PlotLegend.svelte +174 -91
  164. package/dist/plot/PlotTooltip.svelte +45 -6
  165. package/dist/plot/PortalSelect.svelte +175 -147
  166. package/dist/plot/ReferenceLine.svelte +76 -22
  167. package/dist/plot/ReferenceLine3D.svelte +132 -107
  168. package/dist/plot/ReferencePlane.svelte +146 -121
  169. package/dist/plot/ScatterPlot.svelte +1681 -1091
  170. package/dist/plot/ScatterPlot.svelte.d.ts +2 -2
  171. package/dist/plot/ScatterPlot3D.svelte +256 -131
  172. package/dist/plot/ScatterPlot3D.svelte.d.ts +2 -2
  173. package/dist/plot/ScatterPlot3DControls.svelte +113 -63
  174. package/dist/plot/ScatterPlot3DControls.svelte.d.ts +2 -1
  175. package/dist/plot/ScatterPlot3DScene.svelte +608 -403
  176. package/dist/plot/ScatterPlot3DScene.svelte.d.ts +2 -2
  177. package/dist/plot/ScatterPlotControls.svelte +65 -25
  178. package/dist/plot/ScatterPlotControls.svelte.d.ts +1 -1
  179. package/dist/plot/ScatterPoint.svelte +98 -26
  180. package/dist/plot/ScatterPoint.svelte.d.ts +1 -0
  181. package/dist/plot/SpacegroupBarPlot.svelte +142 -85
  182. package/dist/plot/Surface3D.svelte +159 -108
  183. package/dist/plot/ZeroLines.svelte +55 -3
  184. package/dist/plot/ZoomRect.svelte +4 -2
  185. package/dist/plot/axis-utils.js +1 -3
  186. package/dist/plot/data-cleaning.js +12 -28
  187. package/dist/plot/data-transform.js +2 -1
  188. package/dist/plot/fill-utils.js +2 -0
  189. package/dist/plot/layout.d.ts +4 -1
  190. package/dist/plot/layout.js +33 -14
  191. package/dist/plot/reference-line.d.ts +2 -2
  192. package/dist/plot/reference-line.js +7 -5
  193. package/dist/plot/scales.js +24 -36
  194. package/dist/plot/types.d.ts +11 -23
  195. package/dist/plot/types.js +6 -11
  196. package/dist/plot/utils/label-placement.d.ts +32 -15
  197. package/dist/plot/utils/label-placement.js +227 -66
  198. package/dist/plot/utils/series-visibility.js +2 -3
  199. package/dist/rdf/RdfPlot.svelte +143 -91
  200. package/dist/rdf/calc-rdf.js +4 -5
  201. package/dist/sanitize.d.ts +4 -0
  202. package/dist/sanitize.js +107 -0
  203. package/dist/settings.d.ts +18 -6
  204. package/dist/settings.js +46 -16
  205. package/dist/spectral/Bands.svelte +632 -453
  206. package/dist/spectral/BandsAndDos.svelte +90 -49
  207. package/dist/spectral/BrillouinBandsDos.svelte +151 -93
  208. package/dist/spectral/Dos.svelte +389 -258
  209. package/dist/spectral/helpers.js +55 -43
  210. package/dist/state.svelte.d.ts +1 -1
  211. package/dist/state.svelte.js +3 -2
  212. package/dist/structure/Arrow.svelte +59 -20
  213. package/dist/structure/AtomLegend.svelte +215 -134
  214. package/dist/structure/Bond.svelte +73 -47
  215. package/dist/structure/CanvasTooltip.svelte +10 -2
  216. package/dist/structure/CellSelect.svelte +72 -45
  217. package/dist/structure/Cylinder.svelte +33 -17
  218. package/dist/structure/Lattice.svelte +88 -33
  219. package/dist/structure/Structure.svelte +1063 -797
  220. package/dist/structure/Structure.svelte.d.ts +1 -1
  221. package/dist/structure/StructureControls.svelte +349 -118
  222. package/dist/structure/StructureExportPane.svelte +124 -89
  223. package/dist/structure/StructureExportPane.svelte.d.ts +1 -1
  224. package/dist/structure/StructureInfoPane.svelte +304 -237
  225. package/dist/structure/StructureScene.svelte +879 -443
  226. package/dist/structure/StructureScene.svelte.d.ts +15 -7
  227. package/dist/structure/atom-properties.js +8 -8
  228. package/dist/structure/bonding.js +6 -7
  229. package/dist/structure/export.js +14 -29
  230. package/dist/structure/ferrox-wasm.js +1 -1
  231. package/dist/structure/index.d.ts +13 -3
  232. package/dist/structure/index.js +83 -23
  233. package/dist/structure/measure.d.ts +2 -2
  234. package/dist/structure/measure.js +4 -44
  235. package/dist/structure/parse.js +113 -141
  236. package/dist/structure/partial-occupancy.js +7 -10
  237. package/dist/structure/pbc.d.ts +1 -0
  238. package/dist/structure/pbc.js +16 -6
  239. package/dist/structure/supercell.d.ts +2 -2
  240. package/dist/structure/supercell.js +12 -22
  241. package/dist/structure/validation.js +1 -2
  242. package/dist/symmetry/SymmetryStats.svelte +84 -41
  243. package/dist/symmetry/WyckoffTable.svelte +26 -6
  244. package/dist/symmetry/cell-transform.js +5 -3
  245. package/dist/symmetry/index.js +8 -7
  246. package/dist/symmetry/spacegroups.js +148 -148
  247. package/dist/table/HeatmapTable.svelte +790 -554
  248. package/dist/table/HeatmapTable.svelte.d.ts +1 -1
  249. package/dist/table/ToggleMenu.svelte +125 -92
  250. package/dist/table/index.js +2 -4
  251. package/dist/theme/ThemeControl.svelte +21 -12
  252. package/dist/time.js +4 -1
  253. package/dist/tooltip/TooltipContent.svelte +33 -8
  254. package/dist/trajectory/Trajectory.svelte +758 -558
  255. package/dist/trajectory/TrajectoryError.svelte +14 -3
  256. package/dist/trajectory/TrajectoryExportPane.svelte +137 -83
  257. package/dist/trajectory/TrajectoryInfoPane.svelte +272 -143
  258. package/dist/trajectory/extract.js +10 -26
  259. package/dist/trajectory/format-detect.js +5 -5
  260. package/dist/trajectory/frame-reader.d.ts +1 -1
  261. package/dist/trajectory/frame-reader.js +5 -12
  262. package/dist/trajectory/helpers.d.ts +0 -1
  263. package/dist/trajectory/helpers.js +2 -17
  264. package/dist/trajectory/index.js +14 -12
  265. package/dist/trajectory/parse/ase.js +5 -4
  266. package/dist/trajectory/parse/hdf5.js +26 -18
  267. package/dist/trajectory/parse/index.js +13 -18
  268. package/dist/trajectory/parse/lammps.js +17 -7
  269. package/dist/trajectory/parse/vasp.js +5 -2
  270. package/dist/trajectory/parse/xyz.js +8 -7
  271. package/dist/trajectory/plotting.js +13 -8
  272. package/dist/utils.d.ts +1 -0
  273. package/dist/utils.js +13 -0
  274. package/dist/xrd/XrdPlot.svelte +337 -247
  275. package/dist/xrd/broadening.js +14 -9
  276. package/dist/xrd/calc-xrd.js +12 -18
  277. package/dist/xrd/parse.d.ts +1 -1
  278. package/dist/xrd/parse.js +17 -17
  279. package/package.json +99 -103
  280. package/readme.md +1 -1
  281. /package/dist/theme/{themes.js → themes.mjs} +0 -0
@@ -59,7 +59,7 @@ declare function $$render<Metadata extends Record<string, unknown> = Record<stri
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  pan?: PanConfig;
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  };
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  exports: {};
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- bindings: "display" | "mode" | "orientation" | "series" | "show_controls" | "controls_open" | "x_axis" | "x2_axis" | "y_axis" | "y2_axis" | "fullscreen" | "hovered" | "ref_lines";
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+ bindings: "orientation" | "display" | "mode" | "fullscreen" | "series" | "hovered" | "ref_lines" | "show_controls" | "controls_open" | "x_axis" | "y_axis" | "x2_axis" | "y2_axis";
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  slots: {};
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  events: {};
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  };
@@ -67,7 +67,7 @@ declare class __sveltets_Render<Metadata extends Record<string, unknown> = Recor
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  props(): ReturnType<typeof $$render<Metadata>>['props'];
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  events(): ReturnType<typeof $$render<Metadata>>['events'];
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  slots(): ReturnType<typeof $$render<Metadata>>['slots'];
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- bindings(): "display" | "mode" | "orientation" | "series" | "show_controls" | "controls_open" | "x_axis" | "x2_axis" | "y_axis" | "y2_axis" | "fullscreen" | "hovered" | "ref_lines";
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+ bindings(): "orientation" | "display" | "mode" | "fullscreen" | "series" | "hovered" | "ref_lines" | "show_controls" | "controls_open" | "x_axis" | "y_axis" | "x2_axis" | "y2_axis";
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  exports(): {};
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  }
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  interface $$IsomorphicComponent {
@@ -1,8 +1,34 @@
1
- <script lang="ts">import { SettingsSection } from '../layout';
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- import { PlotControls } from './';
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- // Unique ID prefix to avoid conflicts when multiple instances on same page
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- const uid = crypto.randomUUID().slice(0, 8);
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- let { orientation = $bindable(`vertical`), mode = $bindable(`overlay`), x_axis = $bindable({}), x2_axis = $bindable({}), y_axis = $bindable({}), y2_axis = $bindable({}), display = $bindable({}), show_controls = $bindable(false), controls_open = $bindable(false), children, ...rest } = $props();
1
+ <script lang="ts">
2
+ import { SettingsSection } from '../layout'
3
+ import type { BarMode, PlotConfig } from './'
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+ import { PlotControls } from './'
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+ import type { Orientation, PlotControlsProps } from './types'
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+ import type { Snippet } from 'svelte'
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+
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+ // Unique ID prefix to avoid conflicts when multiple instances on same page
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+ const uid = crypto.randomUUID().slice(0, 8)
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+
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+ let {
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+ orientation = $bindable(`vertical`),
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+ mode = $bindable(`overlay`),
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+ x_axis = $bindable({}),
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+ x2_axis = $bindable({}),
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+ y_axis = $bindable({}),
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+ y2_axis = $bindable({}),
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+ display = $bindable({}),
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+ show_controls = $bindable(false),
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+ controls_open = $bindable(false),
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+ children,
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+ ...rest
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+ }: Omit<PlotControlsProps, `children` | `post_children`> & {
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+ orientation?: Orientation
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+ mode?: BarMode
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+ show_controls?: boolean
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+ controls_open?: boolean
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+ children?: Snippet<
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+ [{ orientation: Orientation; mode: BarMode } & Required<PlotConfig>]
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+ >
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+ } = $props()
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  </script>
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  <PlotControls
@@ -13,6 +13,6 @@ type $$ComponentProps = Omit<PlotControlsProps, `children` | `post_children`> &
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  } & Required<PlotConfig>
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  ]>;
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  };
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- declare const BarPlotControls: import("svelte").Component<$$ComponentProps, {}, "display" | "mode" | "orientation" | "show_controls" | "controls_open" | "x_axis" | "x2_axis" | "y_axis" | "y2_axis">;
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+ declare const BarPlotControls: import("svelte").Component<$$ComponentProps, {}, "orientation" | "display" | "mode" | "show_controls" | "controls_open" | "x_axis" | "y_axis" | "x2_axis" | "y2_axis">;
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  type BarPlotControls = ReturnType<typeof BarPlotControls>;
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  export default BarPlotControls;