react-cheminfo 0.22.0 → 0.24.0

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 (464) hide show
  1. package/README.md +51 -28
  2. package/lib/chrome/ui/HeaderToggle.d.ts +52 -0
  3. package/lib/chrome/ui/HeaderToggle.d.ts.map +1 -0
  4. package/lib/chrome/ui/HeaderToggle.js +31 -0
  5. package/lib/chrome/ui/HeaderToggle.js.map +1 -0
  6. package/lib/chrome/ui/index.d.ts +2 -0
  7. package/lib/chrome/ui/index.d.ts.map +1 -1
  8. package/lib/chrome/ui/index.js +1 -0
  9. package/lib/chrome/ui/index.js.map +1 -1
  10. package/lib/citation/core/gfn2Paper.d.ts +10 -0
  11. package/lib/citation/core/gfn2Paper.d.ts.map +1 -0
  12. package/lib/citation/core/gfn2Paper.js +28 -0
  13. package/lib/citation/core/gfn2Paper.js.map +1 -0
  14. package/lib/citation/core/index.d.ts +1 -0
  15. package/lib/citation/core/index.d.ts.map +1 -1
  16. package/lib/citation/core/index.js +1 -0
  17. package/lib/citation/core/index.js.map +1 -1
  18. package/lib/clipboard/ui/ClickToCopy.d.ts +8 -7
  19. package/lib/clipboard/ui/ClickToCopy.d.ts.map +1 -1
  20. package/lib/clipboard/ui/ClickToCopy.js +3 -3
  21. package/lib/clipboard/ui/ClickToCopy.js.map +1 -1
  22. package/lib/conformers.d.ts +27 -0
  23. package/lib/conformers.d.ts.map +1 -0
  24. package/lib/conformers.js +19 -0
  25. package/lib/conformers.js.map +1 -0
  26. package/lib/core.d.ts +1 -0
  27. package/lib/core.d.ts.map +1 -1
  28. package/lib/core.js +1 -0
  29. package/lib/core.js.map +1 -1
  30. package/lib/credits/core/credits.d.ts +12 -0
  31. package/lib/credits/core/credits.d.ts.map +1 -1
  32. package/lib/credits/core/credits.js +14 -0
  33. package/lib/credits/core/credits.js.map +1 -1
  34. package/lib/ecosystem/core/index.d.ts +1 -1
  35. package/lib/ecosystem/core/index.d.ts.map +1 -1
  36. package/lib/ecosystem/core/index.js.map +1 -1
  37. package/lib/ecosystem/core/sites.d.ts +11 -1
  38. package/lib/ecosystem/core/sites.d.ts.map +1 -1
  39. package/lib/ecosystem/core/sites.js +7 -2
  40. package/lib/ecosystem/core/sites.js.map +1 -1
  41. package/lib/ecosystem/ui/EcosystemLinks.d.ts.map +1 -1
  42. package/lib/ecosystem/ui/EcosystemLinks.js +3 -1
  43. package/lib/ecosystem/ui/EcosystemLinks.js.map +1 -1
  44. package/lib/ecosystem/ui/SiteTile.d.ts.map +1 -1
  45. package/lib/ecosystem/ui/SiteTile.js +3 -1
  46. package/lib/ecosystem/ui/SiteTile.js.map +1 -1
  47. package/lib/format/core/index.d.ts +1 -1
  48. package/lib/format/core/index.d.ts.map +1 -1
  49. package/lib/format/core/index.js +1 -1
  50. package/lib/format/core/index.js.map +1 -1
  51. package/lib/format/core/words.d.ts +9 -0
  52. package/lib/format/core/words.d.ts.map +1 -1
  53. package/lib/format/core/words.js +16 -0
  54. package/lib/format/core/words.js.map +1 -1
  55. package/lib/language/core/index.d.ts +3 -0
  56. package/lib/language/core/index.d.ts.map +1 -0
  57. package/lib/language/core/index.js +3 -0
  58. package/lib/language/core/index.js.map +1 -0
  59. package/lib/language/core/languageName.d.ts +8 -0
  60. package/lib/language/core/languageName.d.ts.map +1 -0
  61. package/lib/language/core/languageName.js +16 -0
  62. package/lib/language/core/languageName.js.map +1 -0
  63. package/lib/language/core/languageParam.d.ts +35 -0
  64. package/lib/language/core/languageParam.d.ts.map +1 -0
  65. package/lib/language/core/languageParam.js +67 -0
  66. package/lib/language/core/languageParam.js.map +1 -0
  67. package/lib/language/ui/SiteLanguage.d.ts +20 -0
  68. package/lib/language/ui/SiteLanguage.d.ts.map +1 -0
  69. package/lib/language/ui/SiteLanguage.js +14 -0
  70. package/lib/language/ui/SiteLanguage.js.map +1 -0
  71. package/lib/language/ui/index.d.ts +4 -0
  72. package/lib/language/ui/index.d.ts.map +1 -0
  73. package/lib/language/ui/index.js +3 -0
  74. package/lib/language/ui/index.js.map +1 -0
  75. package/lib/language/ui/siteLanguageContext.d.ts +12 -0
  76. package/lib/language/ui/siteLanguageContext.d.ts.map +1 -0
  77. package/lib/language/ui/siteLanguageContext.js +19 -0
  78. package/lib/language/ui/siteLanguageContext.js.map +1 -0
  79. package/lib/orbital/core/atomicOrbitals.d.ts +9 -1
  80. package/lib/orbital/core/atomicOrbitals.d.ts.map +1 -1
  81. package/lib/orbital/core/atomicOrbitals.js +7 -0
  82. package/lib/orbital/core/atomicOrbitals.js.map +1 -1
  83. package/lib/orbital/core/hydrogenic.d.ts +2 -1
  84. package/lib/orbital/core/hydrogenic.d.ts.map +1 -1
  85. package/lib/orbital/core/hydrogenic.js +2 -1
  86. package/lib/orbital/core/hydrogenic.js.map +1 -1
  87. package/lib/orbital/core/index.d.ts +1 -0
  88. package/lib/orbital/core/index.d.ts.map +1 -1
  89. package/lib/orbital/core/index.js +1 -0
  90. package/lib/orbital/core/index.js.map +1 -1
  91. package/lib/orbital/core/slaterEnergy.d.ts +35 -0
  92. package/lib/orbital/core/slaterEnergy.d.ts.map +1 -0
  93. package/lib/orbital/core/slaterEnergy.js +66 -0
  94. package/lib/orbital/core/slaterEnergy.js.map +1 -0
  95. package/lib/overlay/core/index.d.ts +2 -2
  96. package/lib/overlay/core/index.d.ts.map +1 -1
  97. package/lib/overlay/core/index.js +1 -1
  98. package/lib/overlay/core/index.js.map +1 -1
  99. package/lib/overlay/core/overlayMarks.d.ts +20 -5
  100. package/lib/overlay/core/overlayMarks.d.ts.map +1 -1
  101. package/lib/overlay/core/overlayMarks.js +31 -5
  102. package/lib/overlay/core/overlayMarks.js.map +1 -1
  103. package/lib/overlay/ui/OverlayLegendMark.js +5 -0
  104. package/lib/overlay/ui/OverlayLegendMark.js.map +1 -1
  105. package/lib/projection/core/index.d.ts +4 -4
  106. package/lib/projection/core/index.d.ts.map +1 -1
  107. package/lib/projection/core/index.js +2 -2
  108. package/lib/projection/core/index.js.map +1 -1
  109. package/lib/projection/core/projectionCopy.d.ts +2 -0
  110. package/lib/projection/core/projectionCopy.d.ts.map +1 -1
  111. package/lib/projection/core/projectionCopy.js +1 -0
  112. package/lib/projection/core/projectionCopy.js.map +1 -1
  113. package/lib/projection/core/projectionGroupings.d.ts +44 -0
  114. package/lib/projection/core/projectionGroupings.d.ts.map +1 -0
  115. package/lib/projection/core/projectionGroupings.js +132 -0
  116. package/lib/projection/core/projectionGroupings.js.map +1 -0
  117. package/lib/projection/core/projectionOptions.d.ts +16 -6
  118. package/lib/projection/core/projectionOptions.d.ts.map +1 -1
  119. package/lib/projection/core/projectionOptions.js +7 -1
  120. package/lib/projection/core/projectionOptions.js.map +1 -1
  121. package/lib/projection/core/projectionPanelWords.d.ts +6 -0
  122. package/lib/projection/core/projectionPanelWords.d.ts.map +1 -1
  123. package/lib/projection/core/projectionPanelWords.js +4 -0
  124. package/lib/projection/core/projectionPanelWords.js.map +1 -1
  125. package/lib/projection/core/projectionSamples.d.ts +63 -32
  126. package/lib/projection/core/projectionSamples.d.ts.map +1 -1
  127. package/lib/projection/core/projectionSamples.js +1 -80
  128. package/lib/projection/core/projectionSamples.js.map +1 -1
  129. package/lib/projection/core/projectionStrings.d.ts +2 -0
  130. package/lib/projection/core/projectionStrings.d.ts.map +1 -1
  131. package/lib/projection/core/projectionStrings.js +10 -1
  132. package/lib/projection/core/projectionStrings.js.map +1 -1
  133. package/lib/projection/core/resolveProjectionOptions.d.ts +8 -3
  134. package/lib/projection/core/resolveProjectionOptions.d.ts.map +1 -1
  135. package/lib/projection/core/resolveProjectionOptions.js +58 -5
  136. package/lib/projection/core/resolveProjectionOptions.js.map +1 -1
  137. package/lib/projection/ui/ProjectionBar.d.ts +1 -1
  138. package/lib/projection/ui/ProjectionBar.d.ts.map +1 -1
  139. package/lib/projection/ui/ProjectionBar.js +3 -1
  140. package/lib/projection/ui/ProjectionBar.js.map +1 -1
  141. package/lib/projection/ui/ProjectionGroupingPickers.d.ts +38 -0
  142. package/lib/projection/ui/ProjectionGroupingPickers.d.ts.map +1 -0
  143. package/lib/projection/ui/ProjectionGroupingPickers.js +33 -0
  144. package/lib/projection/ui/ProjectionGroupingPickers.js.map +1 -0
  145. package/lib/projection/ui/ProjectionMapControls.d.ts +6 -7
  146. package/lib/projection/ui/ProjectionMapControls.d.ts.map +1 -1
  147. package/lib/projection/ui/ProjectionMapControls.js +11 -9
  148. package/lib/projection/ui/ProjectionMapControls.js.map +1 -1
  149. package/lib/projection/ui/ProjectionMapLegend.d.ts.map +1 -1
  150. package/lib/projection/ui/ProjectionMapLegend.js +1 -1
  151. package/lib/projection/ui/ProjectionMapLegend.js.map +1 -1
  152. package/lib/projection/ui/ProjectionMapMore.d.ts +2 -2
  153. package/lib/projection/ui/ProjectionMapMore.d.ts.map +1 -1
  154. package/lib/projection/ui/ProjectionMapMore.js +7 -5
  155. package/lib/projection/ui/ProjectionMapMore.js.map +1 -1
  156. package/lib/projection/ui/ProjectionMapTab.d.ts +15 -6
  157. package/lib/projection/ui/ProjectionMapTab.d.ts.map +1 -1
  158. package/lib/projection/ui/ProjectionMapTab.js +11 -7
  159. package/lib/projection/ui/ProjectionMapTab.js.map +1 -1
  160. package/lib/projection/ui/ProjectionPairsMore.d.ts +3 -7
  161. package/lib/projection/ui/ProjectionPairsMore.d.ts.map +1 -1
  162. package/lib/projection/ui/ProjectionPairsMore.js +4 -5
  163. package/lib/projection/ui/ProjectionPairsMore.js.map +1 -1
  164. package/lib/projection/ui/ProjectionPairsTab.d.ts.map +1 -1
  165. package/lib/projection/ui/ProjectionPairsTab.js +2 -2
  166. package/lib/projection/ui/ProjectionPairsTab.js.map +1 -1
  167. package/lib/projection/ui/ProjectionPanel.d.ts +1 -1
  168. package/lib/projection/ui/ProjectionPanel.d.ts.map +1 -1
  169. package/lib/projection/ui/ProjectionPanel.js +1 -1
  170. package/lib/projection/ui/ProjectionPanel.js.map +1 -1
  171. package/lib/projection/ui/ProjectionReadout.d.ts +7 -1
  172. package/lib/projection/ui/ProjectionReadout.d.ts.map +1 -1
  173. package/lib/projection/ui/ProjectionReadout.js +19 -7
  174. package/lib/projection/ui/ProjectionReadout.js.map +1 -1
  175. package/lib/projection/ui/ProjectionSpaceControls.d.ts +3 -5
  176. package/lib/projection/ui/ProjectionSpaceControls.d.ts.map +1 -1
  177. package/lib/projection/ui/ProjectionSpaceControls.js +9 -7
  178. package/lib/projection/ui/ProjectionSpaceControls.js.map +1 -1
  179. package/lib/projection/ui/ProjectionSpaceMore.d.ts +2 -2
  180. package/lib/projection/ui/ProjectionSpaceMore.d.ts.map +1 -1
  181. package/lib/projection/ui/ProjectionSpaceMore.js +5 -4
  182. package/lib/projection/ui/ProjectionSpaceMore.js.map +1 -1
  183. package/lib/projection/ui/ProjectionSpaceTab.d.ts +11 -3
  184. package/lib/projection/ui/ProjectionSpaceTab.d.ts.map +1 -1
  185. package/lib/projection/ui/ProjectionSpaceTab.js +7 -4
  186. package/lib/projection/ui/ProjectionSpaceTab.js.map +1 -1
  187. package/lib/projection/ui/ProjectionViewer.d.ts.map +1 -1
  188. package/lib/projection/ui/ProjectionViewer.js +1 -0
  189. package/lib/projection/ui/ProjectionViewer.js.map +1 -1
  190. package/lib/projection/ui/projectionBarReadings.d.ts +4 -1
  191. package/lib/projection/ui/projectionBarReadings.d.ts.map +1 -1
  192. package/lib/projection/ui/projectionBarReadings.js +14 -4
  193. package/lib/projection/ui/projectionBarReadings.js.map +1 -1
  194. package/lib/projection/ui/projectionBarSlots.d.ts +4 -2
  195. package/lib/projection/ui/projectionBarSlots.d.ts.map +1 -1
  196. package/lib/projection/ui/projectionBarSlots.js +3 -7
  197. package/lib/projection/ui/projectionBarSlots.js.map +1 -1
  198. package/lib/projection/ui/projectionMapChoices.d.ts +31 -6
  199. package/lib/projection/ui/projectionMapChoices.d.ts.map +1 -1
  200. package/lib/projection/ui/projectionMapChoices.js +58 -9
  201. package/lib/projection/ui/projectionMapChoices.js.map +1 -1
  202. package/lib/projection/ui/projectionMapChrome.d.ts +3 -9
  203. package/lib/projection/ui/projectionMapChrome.d.ts.map +1 -1
  204. package/lib/projection/ui/projectionMapChrome.js +41 -27
  205. package/lib/projection/ui/projectionMapChrome.js.map +1 -1
  206. package/lib/projection/ui/projectionMapCorner.d.ts +25 -0
  207. package/lib/projection/ui/projectionMapCorner.d.ts.map +1 -0
  208. package/lib/projection/ui/projectionMapCorner.js +46 -0
  209. package/lib/projection/ui/projectionMapCorner.js.map +1 -0
  210. package/lib/projection/ui/projectionMapModel.d.ts +9 -18
  211. package/lib/projection/ui/projectionMapModel.d.ts.map +1 -1
  212. package/lib/projection/ui/projectionMapModel.js +14 -39
  213. package/lib/projection/ui/projectionMapModel.js.map +1 -1
  214. package/lib/projection/ui/projectionMapView.d.ts +3 -1
  215. package/lib/projection/ui/projectionMapView.d.ts.map +1 -1
  216. package/lib/projection/ui/projectionMapView.js +9 -4
  217. package/lib/projection/ui/projectionMapView.js.map +1 -1
  218. package/lib/projection/ui/projectionSelectionSentence.d.ts +10 -0
  219. package/lib/projection/ui/projectionSelectionSentence.d.ts.map +1 -0
  220. package/lib/projection/ui/projectionSelectionSentence.js +18 -0
  221. package/lib/projection/ui/projectionSelectionSentence.js.map +1 -0
  222. package/lib/projection/ui/projectionStateApi.d.ts +47 -0
  223. package/lib/projection/ui/projectionStateApi.d.ts.map +1 -0
  224. package/lib/projection/ui/projectionStateApi.js +9 -0
  225. package/lib/projection/ui/projectionStateApi.js.map +1 -0
  226. package/lib/projection/ui/projectionTabModels.js +1 -1
  227. package/lib/projection/ui/projectionTabModels.js.map +1 -1
  228. package/lib/projection/ui/useProjectionState.d.ts +1 -29
  229. package/lib/projection/ui/useProjectionState.d.ts.map +1 -1
  230. package/lib/projection/ui/useProjectionState.js +13 -5
  231. package/lib/projection/ui/useProjectionState.js.map +1 -1
  232. package/lib/scatter/core/index.d.ts +1 -0
  233. package/lib/scatter/core/index.d.ts.map +1 -1
  234. package/lib/scatter/core/index.js +1 -0
  235. package/lib/scatter/core/index.js.map +1 -1
  236. package/lib/scatter/core/pointShape.d.ts +18 -0
  237. package/lib/scatter/core/pointShape.d.ts.map +1 -0
  238. package/lib/scatter/core/pointShape.js +70 -0
  239. package/lib/scatter/core/pointShape.js.map +1 -0
  240. package/lib/scatter/ui/ScatterPlot.d.ts.map +1 -1
  241. package/lib/scatter/ui/ScatterPlot.js +3 -2
  242. package/lib/scatter/ui/ScatterPlot.js.map +1 -1
  243. package/lib/scatter/ui/ScatterPointLayer.d.ts +14 -1
  244. package/lib/scatter/ui/ScatterPointLayer.d.ts.map +1 -1
  245. package/lib/scatter/ui/ScatterPointLayer.js +15 -3
  246. package/lib/scatter/ui/ScatterPointLayer.js.map +1 -1
  247. package/lib/scatter/ui/scatterFigureProps.d.ts +13 -0
  248. package/lib/scatter/ui/scatterFigureProps.d.ts.map +1 -1
  249. package/lib/scatter/ui/scatterMarkGlyph.d.ts +2 -1
  250. package/lib/scatter/ui/scatterMarkGlyph.d.ts.map +1 -1
  251. package/lib/scatter/ui/scatterMarkGlyph.js +7 -1
  252. package/lib/scatter/ui/scatterMarkGlyph.js.map +1 -1
  253. package/lib/scatter3d/ui/ScatterCloud.d.ts.map +1 -1
  254. package/lib/scatter3d/ui/ScatterCloud.js +2 -1
  255. package/lib/scatter3d/ui/ScatterCloud.js.map +1 -1
  256. package/lib/shared/ui/MenuButton.d.ts +3 -2
  257. package/lib/shared/ui/MenuButton.d.ts.map +1 -1
  258. package/lib/shared/ui/MenuButton.js +1 -1
  259. package/lib/shared/ui/MenuButton.js.map +1 -1
  260. package/lib/structure/core/conformerMinimise.d.ts +36 -0
  261. package/lib/structure/core/conformerMinimise.d.ts.map +1 -0
  262. package/lib/structure/core/conformerMinimise.js +81 -0
  263. package/lib/structure/core/conformerMinimise.js.map +1 -0
  264. package/lib/structure/core/conformerMinimum.d.ts +62 -0
  265. package/lib/structure/core/conformerMinimum.d.ts.map +1 -0
  266. package/lib/structure/core/conformerMinimum.js +90 -0
  267. package/lib/structure/core/conformerMinimum.js.map +1 -0
  268. package/lib/structure/core/conformerOptions.d.ts +62 -0
  269. package/lib/structure/core/conformerOptions.d.ts.map +1 -0
  270. package/lib/structure/core/conformerOptions.js +83 -0
  271. package/lib/structure/core/conformerOptions.js.map +1 -0
  272. package/lib/structure/core/conformerRefine.d.ts +104 -0
  273. package/lib/structure/core/conformerRefine.d.ts.map +1 -0
  274. package/lib/structure/core/conformerRefine.js +130 -0
  275. package/lib/structure/core/conformerRefine.js.map +1 -0
  276. package/lib/structure/core/conformerRefineRank.d.ts +36 -0
  277. package/lib/structure/core/conformerRefineRank.d.ts.map +1 -0
  278. package/lib/structure/core/conformerRefineRank.js +69 -0
  279. package/lib/structure/core/conformerRefineRank.js.map +1 -0
  280. package/lib/structure/core/conformerSession.d.ts +50 -0
  281. package/lib/structure/core/conformerSession.d.ts.map +1 -0
  282. package/lib/structure/core/conformerSession.js +88 -0
  283. package/lib/structure/core/conformerSession.js.map +1 -0
  284. package/lib/structure/core/conformerShape.d.ts +36 -0
  285. package/lib/structure/core/conformerShape.d.ts.map +1 -0
  286. package/lib/structure/core/conformerShape.js +150 -0
  287. package/lib/structure/core/conformerShape.js.map +1 -0
  288. package/lib/structure/core/conformers.d.ts +107 -0
  289. package/lib/structure/core/conformers.d.ts.map +1 -0
  290. package/lib/structure/core/conformers.js +149 -0
  291. package/lib/structure/core/conformers.js.map +1 -0
  292. package/lib/structure/core/geometryRelaxer.d.ts +66 -0
  293. package/lib/structure/core/geometryRelaxer.d.ts.map +1 -0
  294. package/lib/structure/core/geometryRelaxer.js +2 -0
  295. package/lib/structure/core/geometryRelaxer.js.map +1 -0
  296. package/lib/structure/core/index.d.ts +4 -0
  297. package/lib/structure/core/index.d.ts.map +1 -1
  298. package/lib/structure/core/index.js +2 -0
  299. package/lib/structure/core/index.js.map +1 -1
  300. package/lib/structure/core/moleculeCoordinates.d.ts +31 -0
  301. package/lib/structure/core/moleculeCoordinates.d.ts.map +1 -0
  302. package/lib/structure/core/moleculeCoordinates.js +80 -0
  303. package/lib/structure/core/moleculeCoordinates.js.map +1 -0
  304. package/lib/structure/core/molfileExport.d.ts +42 -0
  305. package/lib/structure/core/molfileExport.d.ts.map +1 -0
  306. package/lib/structure/core/molfileExport.js +47 -0
  307. package/lib/structure/core/molfileExport.js.map +1 -0
  308. package/lib/structure/core/oclResources.d.ts +12 -0
  309. package/lib/structure/core/oclResources.d.ts.map +1 -0
  310. package/lib/structure/core/oclResources.js +35 -0
  311. package/lib/structure/core/oclResources.js.map +1 -0
  312. package/lib/translate/core/catalog.d.ts +61 -0
  313. package/lib/translate/core/catalog.d.ts.map +1 -0
  314. package/lib/translate/core/catalog.js +49 -0
  315. package/lib/translate/core/catalog.js.map +1 -0
  316. package/lib/translate/core/checkTranslation.d.ts +32 -0
  317. package/lib/translate/core/checkTranslation.d.ts.map +1 -0
  318. package/lib/translate/core/checkTranslation.js +98 -0
  319. package/lib/translate/core/checkTranslation.js.map +1 -0
  320. package/lib/translate/core/contribution.d.ts +88 -0
  321. package/lib/translate/core/contribution.d.ts.map +1 -0
  322. package/lib/translate/core/contribution.js +14 -0
  323. package/lib/translate/core/contribution.js.map +1 -0
  324. package/lib/translate/core/index.d.ts +19 -0
  325. package/lib/translate/core/index.d.ts.map +1 -0
  326. package/lib/translate/core/index.js +15 -0
  327. package/lib/translate/core/index.js.map +1 -0
  328. package/lib/translate/core/marker.d.ts +45 -0
  329. package/lib/translate/core/marker.d.ts.map +1 -0
  330. package/lib/translate/core/marker.js +79 -0
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@@ -33,8 +33,16 @@ export interface AtomicOrbital {
33
33
  effectiveCharge: number;
34
34
  /** Shielding `S` those rules produced. */
35
35
  shielding: number;
36
- /** `−13.6 Z_eff²/n²`, electronvolts. */
36
+ /** `−13.606 Z_eff²/n²`, electronvolts: one rydberg times `Z_eff²/n²`. */
37
37
  energy: number;
38
+ /**
39
+ * Energy to pull this electron off the atom, electronvolts: the difference
40
+ * of Slater total energies between the ion and the atom. `null` when the
41
+ * subshell is empty, there being no electron to remove. This, not
42
+ * {@link AtomicOrbital.energy}, is the number to compare with a measured
43
+ * ionisation energy — see `slaterEnergy.ts`.
44
+ */
45
+ removalEnergy: number | null;
38
46
  /** `n − ℓ − 1` spheres on which the wavefunction changes sign. */
39
47
  radialNodes: number;
40
48
  /** ℓ planes or cones on which it changes sign. */
@@ -1 +1 @@
1
- {"version":3,"file":"atomicOrbitals.d.ts","sourceRoot":"","sources":["../../../src/orbital/core/atomicOrbitals.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;GAYG;AAOH,OAAO,KAAK,EAAE,oBAAoB,EAAE,MAAM,iBAAiB,CAAC;AAS5D,OAAO,KAAK,EAAE,YAAY,EAAE,MAAM,oBAAoB,CAAC;AAIvD,2EAA2E;AAC3E,MAAM,WAAW,aAAa;IAC5B,8DAA8D;IAC9D,EAAE,EAAE,MAAM,CAAC;IACX,wCAAwC;IACxC,CAAC,EAAE,MAAM,CAAC;IACV,mEAAmE;IACnE,CAAC,EAAE,MAAM,CAAC;IACV,4DAA4D;IAC5D,QAAQ,EAAE,YAAY,CAAC;IACvB,sDAAsD;IACtD,KAAK,EAAE,MAAM,CAAC;IACd,mEAAmE;IACnE,SAAS,EAAE,MAAM,CAAC;IAClB,uCAAuC;IACvC,iBAAiB,EAAE,MAAM,CAAC;IAC1B,oDAAoD;IACpD,eAAe,EAAE,MAAM,CAAC;IACxB,0CAA0C;IAC1C,SAAS,EAAE,MAAM,CAAC;IAClB,wCAAwC;IACxC,MAAM,EAAE,MAAM,CAAC;IACf,kEAAkE;IAClE,WAAW,EAAE,MAAM,CAAC;IACpB,kDAAkD;IAClD,YAAY,EAAE,MAAM,CAAC;IACrB,uBAAuB;IACvB,UAAU,EAAE,MAAM,CAAC;IACnB,2DAA2D;IAC3D,SAAS,EAAE,OAAO,CAAC;IACnB,sDAAsD;IACtD,SAAS,EAAE,OAAO,CAAC;CACpB;AAED,4CAA4C;AAC5C,MAAM,WAAW,oBAAoB;IACnC;;;;;;OAMG;IACH,YAAY,CAAC,EAAE,MAAM,CAAC;CACvB;AAED;;;;;;;GAOG;AACH,wBAAgB,gBAAgB,CAC9B,YAAY,EAAE,MAAM,EACpB,OAAO,GAAE,oBAAyB,GACjC,aAAa,EAAE,CAyDjB;AAED;;;;;GAKG;AACH,wBAAgB,iBAAiB,CAC/B,QAAQ,EAAE,SAAS,aAAa,EAAE,EAClC,EAAE,EAAE,MAAM,GACT,aAAa,GAAG,IAAI,CAKtB;AAED;;;;GAIG;AACH,wBAAgB,sBAAsB,CACpC,OAAO,EAAE,aAAa,GACrB,oBAAoB,CAEtB;AAaD;;;;;;GAMG;AACH,wBAAgB,gBAAgB,CAC9B,QAAQ,EAAE,SAAS,aAAa,EAAE,GACjC,MAAM,GAAG,IAAI,CAaf"}
1
+ {"version":3,"file":"atomicOrbitals.d.ts","sourceRoot":"","sources":["../../../src/orbital/core/atomicOrbitals.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;GAYG;AAOH,OAAO,KAAK,EAAE,oBAAoB,EAAE,MAAM,iBAAiB,CAAC;AAS5D,OAAO,KAAK,EAAE,YAAY,EAAE,MAAM,oBAAoB,CAAC;AAKvD,2EAA2E;AAC3E,MAAM,WAAW,aAAa;IAC5B,8DAA8D;IAC9D,EAAE,EAAE,MAAM,CAAC;IACX,wCAAwC;IACxC,CAAC,EAAE,MAAM,CAAC;IACV,mEAAmE;IACnE,CAAC,EAAE,MAAM,CAAC;IACV,4DAA4D;IAC5D,QAAQ,EAAE,YAAY,CAAC;IACvB,sDAAsD;IACtD,KAAK,EAAE,MAAM,CAAC;IACd,mEAAmE;IACnE,SAAS,EAAE,MAAM,CAAC;IAClB,uCAAuC;IACvC,iBAAiB,EAAE,MAAM,CAAC;IAC1B,oDAAoD;IACpD,eAAe,EAAE,MAAM,CAAC;IACxB,0CAA0C;IAC1C,SAAS,EAAE,MAAM,CAAC;IAClB,yEAAyE;IACzE,MAAM,EAAE,MAAM,CAAC;IACf;;;;;;OAMG;IACH,aAAa,EAAE,MAAM,GAAG,IAAI,CAAC;IAC7B,kEAAkE;IAClE,WAAW,EAAE,MAAM,CAAC;IACpB,kDAAkD;IAClD,YAAY,EAAE,MAAM,CAAC;IACrB,uBAAuB;IACvB,UAAU,EAAE,MAAM,CAAC;IACnB,2DAA2D;IAC3D,SAAS,EAAE,OAAO,CAAC;IACnB,sDAAsD;IACtD,SAAS,EAAE,OAAO,CAAC;CACpB;AAED,4CAA4C;AAC5C,MAAM,WAAW,oBAAoB;IACnC;;;;;;OAMG;IACH,YAAY,CAAC,EAAE,MAAM,CAAC;CACvB;AAED;;;;;;;GAOG;AACH,wBAAgB,gBAAgB,CAC9B,YAAY,EAAE,MAAM,EACpB,OAAO,GAAE,oBAAyB,GACjC,aAAa,EAAE,CAgEjB;AAED;;;;;GAKG;AACH,wBAAgB,iBAAiB,CAC/B,QAAQ,EAAE,SAAS,aAAa,EAAE,EAClC,EAAE,EAAE,MAAM,GACT,aAAa,GAAG,IAAI,CAKtB;AAED;;;;GAIG;AACH,wBAAgB,sBAAsB,CACpC,OAAO,EAAE,aAAa,GACrB,oBAAoB,CAEtB;AAaD;;;;;;GAMG;AACH,wBAAgB,gBAAgB,CAC9B,QAAQ,EAAE,SAAS,aAAa,EAAE,GACjC,MAAM,GAAG,IAAI,CAaf"}
@@ -16,6 +16,7 @@ import { meanRadius, orbitalEnergy, radialNodeCount } from "./hydrogenic.js";
16
16
  import { MINIMUM_CHARGE, defaultMaximumShell, hundDistribution, outermostShell, withoutOutermostElectron, } from "./occupancy.js";
17
17
  import { harmonicsOf, subshellLetter } from "./realHarmonics.js";
18
18
  import { slaterScreening } from "./screening.js";
19
+ import { slaterRemovalEnergy } from "./slaterEnergy.js";
19
20
  /**
20
21
  * Every orbital of an element, in Madelung (roughly energetic) order.
21
22
  * @param atomicNumber - Proton count, 1 to 118.
@@ -52,6 +53,11 @@ export function atomicOrbitalsOf(atomicNumber, options = {}) {
52
53
  l: subshell.l,
53
54
  charge,
54
55
  };
56
+ // Once per subshell, not once per harmonic: the seven orbitals of an f
57
+ // subshell share one removal energy.
58
+ const removalEnergy = subshellElectrons === 0
59
+ ? null
60
+ : slaterRemovalEnergy(atomicNumber, configuration, subshell);
55
61
  const harmonics = harmonicsOf(subshell.l);
56
62
  const spread = hundDistribution(subshellElectrons, harmonics.length);
57
63
  for (let index = 0; index < harmonics.length; index++) {
@@ -67,6 +73,7 @@ export function atomicOrbitalsOf(atomicNumber, options = {}) {
67
73
  effectiveCharge: charge,
68
74
  shielding: screening.shielding,
69
75
  energy: orbitalEnergy(parameters),
76
+ removalEnergy,
70
77
  radialNodes: radialNodeCount(parameters),
71
78
  angularNodes: subshell.l,
72
79
  meanRadius: meanRadius(parameters),
@@ -1 +1 @@
1
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@@ -37,7 +37,8 @@ export declare function radialNodeCount(parameters: HydrogenicParameters): numbe
37
37
  */
38
38
  export declare function meanRadius(parameters: HydrogenicParameters): number;
39
39
  /**
40
- * Orbital energy in the hydrogen-like model, `E = −13.6 Z²/n²` eV.
40
+ * Orbital energy in the hydrogen-like model, `E = −13.606 Z²/n²` eV — one
41
+ * rydberg times `Z²/n²`.
41
42
  * @param parameters - Which orbital.
42
43
  * @returns The energy in electronvolts, always negative.
43
44
  */
@@ -1 +1 @@
1
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+ {"version":3,"file":"hydrogenic.d.ts","sourceRoot":"","sources":["../../../src/orbital/core/hydrogenic.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;;;GAeG;AAUH,iEAAiE;AACjE,MAAM,WAAW,oBAAoB;IACnC,0CAA0C;IAC1C,CAAC,EAAE,MAAM,CAAC;IACV,mDAAmD;IACnD,CAAC,EAAE,MAAM,CAAC;IACV,mEAAmE;IACnE,MAAM,EAAE,MAAM,CAAC;CAChB;AAED;;;;GAIG;AACH,wBAAgB,eAAe,CAAC,UAAU,EAAE,oBAAoB,GAAG,MAAM,CAExE;AAED;;;;;GAKG;AACH,wBAAgB,UAAU,CAAC,UAAU,EAAE,oBAAoB,GAAG,MAAM,CAMnE;AAED;;;;;GAKG;AACH,wBAAgB,aAAa,CAAC,UAAU,EAAE,oBAAoB,GAAG,MAAM,CAGtE;AAED;;;;;;;GAOG;AACH,wBAAgB,oBAAoB,CAClC,UAAU,EAAE,oBAAoB,GAC/B,CAAC,QAAQ,EAAE,MAAM,KAAK,MAAM,CAwB9B;AAED;;;;;GAKG;AACH,wBAAgB,eAAe,CAC7B,UAAU,EAAE,oBAAoB,EAChC,QAAQ,EAAE,MAAM,GACf,MAAM,CAER;AAED;;;;;;;;;;;GAWG;AACH,wBAAgB,eAAe,CAC7B,UAAU,EAAE,oBAAoB,EAChC,KAAK,SAA6B,GACjC,MAAM,EAAE,CAmBV;AAED;;;;;;;;;GASG;AACH,wBAAgB,eAAe,CAC7B,UAAU,EAAE,oBAAoB,EAChC,QAAQ,EAAE,MAAM,GACf,MAAM,CA0BR;AAED;;;;;;;;GAQG;AACH,wBAAgB,aAAa,CAC3B,UAAU,EAAE,oBAAoB,EAChC,KAAK,EAAE,MAAM,EACb,KAAK,EAAE,MAAM,GACZ;IAAE,SAAS,EAAE,YAAY,CAAC;IAAC,SAAS,EAAE,YAAY,CAAC;IAAC,OAAO,EAAE,YAAY,CAAA;CAAE,CAc7E"}
@@ -36,7 +36,8 @@ export function meanRadius(parameters) {
36
36
  (2 * Math.max(charge, 1e-6)));
37
37
  }
38
38
  /**
39
- * Orbital energy in the hydrogen-like model, `E = −13.6 Z²/n²` eV.
39
+ * Orbital energy in the hydrogen-like model, `E = −13.606 Z²/n²` eV — one
40
+ * rydberg times `Z²/n²`.
40
41
  * @param parameters - Which orbital.
41
42
  * @returns The energy in electronvolts, always negative.
42
43
  */
@@ -1 +1 @@
1
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@@ -23,4 +23,5 @@ export type { AtomicSampleRequest, AtomicSampleResult, AtomicSampler, } from './
23
23
  export { runAtomicSample } from './sample.ts';
24
24
  export type { Screening } from './screening.ts';
25
25
  export { groupRank, slaterScreening } from './screening.ts';
26
+ export { slaterRemovalEnergy, slaterTotalEnergy } from './slaterEnergy.ts';
26
27
  //# sourceMappingURL=index.d.ts.map
@@ -1 +1 @@
1
- {"version":3,"file":"index.d.ts","sourceRoot":"","sources":["../../../src/orbital/core/index.ts"],"names":[],"mappings":"AAAA,YAAY,EAAE,gBAAgB,EAAE,MAAM,iBAAiB,CAAC;AACxD,OAAO,EACL,oBAAoB,EACpB,4BAA4B,GAC7B,MAAM,iBAAiB,CAAC;AACzB,YAAY,EAAE,aAAa,EAAE,oBAAoB,EAAE,MAAM,qBAAqB,CAAC;AAC/E,OAAO,EACL,gBAAgB,EAChB,gBAAgB,EAChB,iBAAiB,EACjB,sBAAsB,GACvB,MAAM,qBAAqB,CAAC;AAC7B,YAAY,EAAE,IAAI,EAAE,MAAM,gBAAgB,CAAC;AAC3C,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,gBAAgB,CAAC;AACzE,YAAY,EAAE,QAAQ,EAAE,iBAAiB,EAAE,MAAM,4BAA4B,CAAC;AAC9E,OAAO,EACL,iBAAiB,EACjB,qBAAqB,EACrB,cAAc,EACd,WAAW,EACX,qBAAqB,EACrB,eAAe,EACf,gBAAgB,EAChB,mBAAmB,EACnB,eAAe,EACf,WAAW,EACX,gBAAgB,EAChB,aAAa,GACd,MAAM,4BAA4B,CAAC;AACpC,YAAY,EAAE,OAAO,EAAE,gBAAgB,EAAE,WAAW,EAAE,MAAM,WAAW,CAAC;AACxE,OAAO,EAAE,YAAY,EAAE,SAAS,EAAE,MAAM,WAAW,CAAC;AACpD,YAAY,EAAE,cAAc,EAAE,MAAM,eAAe,CAAC;AACpD,OAAO,EAAE,aAAa,EAAE,gBAAgB,EAAE,cAAc,EAAE,MAAM,eAAe,CAAC;AAChF,YAAY,EAAE,oBAAoB,EAAE,MAAM,iBAAiB,CAAC;AAC5D,OAAO,EACL,oBAAoB,EACpB,eAAe,EACf,UAAU,EACV,aAAa,EACb,eAAe,EACf,eAAe,EACf,eAAe,EACf,aAAa,GACd,MAAM,iBAAiB,CAAC;AACzB,OAAO,EACL,gBAAgB,EAChB,cAAc,EACd,wBAAwB,GACzB,MAAM,gBAAgB,CAAC;AACxB,YAAY,EAAE,YAAY,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AACjE,OAAO,EAAE,wBAAwB,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AACxE,YAAY,EACV,kBAAkB,EAClB,yBAAyB,GAC1B,MAAM,yBAAyB,CAAC;AACjC,OAAO,EAAE,kBAAkB,EAAE,MAAM,yBAAyB,CAAC;AAC7D,YAAY,EAAE,YAAY,EAAE,MAAM,oBAAoB,CAAC;AACvD,OAAO,EACL,cAAc,EACd,gBAAgB,EAChB,WAAW,EACX,cAAc,GACf,MAAM,oBAAoB,CAAC;AAC5B,YAAY,EACV,mBAAmB,EACnB,kBAAkB,EAClB,aAAa,GACd,MAAM,aAAa,CAAC;AACrB,OAAO,EAAE,eAAe,EAAE,MAAM,aAAa,CAAC;AAC9C,YAAY,EAAE,SAAS,EAAE,MAAM,gBAAgB,CAAC;AAChD,OAAO,EAAE,SAAS,EAAE,eAAe,EAAE,MAAM,gBAAgB,CAAC"}
1
+ {"version":3,"file":"index.d.ts","sourceRoot":"","sources":["../../../src/orbital/core/index.ts"],"names":[],"mappings":"AAAA,YAAY,EAAE,gBAAgB,EAAE,MAAM,iBAAiB,CAAC;AACxD,OAAO,EACL,oBAAoB,EACpB,4BAA4B,GAC7B,MAAM,iBAAiB,CAAC;AACzB,YAAY,EAAE,aAAa,EAAE,oBAAoB,EAAE,MAAM,qBAAqB,CAAC;AAC/E,OAAO,EACL,gBAAgB,EAChB,gBAAgB,EAChB,iBAAiB,EACjB,sBAAsB,GACvB,MAAM,qBAAqB,CAAC;AAC7B,YAAY,EAAE,IAAI,EAAE,MAAM,gBAAgB,CAAC;AAC3C,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,gBAAgB,CAAC;AACzE,YAAY,EAAE,QAAQ,EAAE,iBAAiB,EAAE,MAAM,4BAA4B,CAAC;AAC9E,OAAO,EACL,iBAAiB,EACjB,qBAAqB,EACrB,cAAc,EACd,WAAW,EACX,qBAAqB,EACrB,eAAe,EACf,gBAAgB,EAChB,mBAAmB,EACnB,eAAe,EACf,WAAW,EACX,gBAAgB,EAChB,aAAa,GACd,MAAM,4BAA4B,CAAC;AACpC,YAAY,EAAE,OAAO,EAAE,gBAAgB,EAAE,WAAW,EAAE,MAAM,WAAW,CAAC;AACxE,OAAO,EAAE,YAAY,EAAE,SAAS,EAAE,MAAM,WAAW,CAAC;AACpD,YAAY,EAAE,cAAc,EAAE,MAAM,eAAe,CAAC;AACpD,OAAO,EAAE,aAAa,EAAE,gBAAgB,EAAE,cAAc,EAAE,MAAM,eAAe,CAAC;AAChF,YAAY,EAAE,oBAAoB,EAAE,MAAM,iBAAiB,CAAC;AAC5D,OAAO,EACL,oBAAoB,EACpB,eAAe,EACf,UAAU,EACV,aAAa,EACb,eAAe,EACf,eAAe,EACf,eAAe,EACf,aAAa,GACd,MAAM,iBAAiB,CAAC;AACzB,OAAO,EACL,gBAAgB,EAChB,cAAc,EACd,wBAAwB,GACzB,MAAM,gBAAgB,CAAC;AACxB,YAAY,EAAE,YAAY,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AACjE,OAAO,EAAE,wBAAwB,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AACxE,YAAY,EACV,kBAAkB,EAClB,yBAAyB,GAC1B,MAAM,yBAAyB,CAAC;AACjC,OAAO,EAAE,kBAAkB,EAAE,MAAM,yBAAyB,CAAC;AAC7D,YAAY,EAAE,YAAY,EAAE,MAAM,oBAAoB,CAAC;AACvD,OAAO,EACL,cAAc,EACd,gBAAgB,EAChB,WAAW,EACX,cAAc,GACf,MAAM,oBAAoB,CAAC;AAC5B,YAAY,EACV,mBAAmB,EACnB,kBAAkB,EAClB,aAAa,GACd,MAAM,aAAa,CAAC;AACrB,OAAO,EAAE,eAAe,EAAE,MAAM,aAAa,CAAC;AAC9C,YAAY,EAAE,SAAS,EAAE,MAAM,gBAAgB,CAAC;AAChD,OAAO,EAAE,SAAS,EAAE,eAAe,EAAE,MAAM,gBAAgB,CAAC;AAC5D,OAAO,EAAE,mBAAmB,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC"}
@@ -11,4 +11,5 @@ export { radialDistribution } from "./radialDistribution.js";
11
11
  export { REAL_HARMONICS, SUBSHELL_LETTERS, harmonicsOf, subshellLetter, } from "./realHarmonics.js";
12
12
  export { runAtomicSample } from "./sample.js";
13
13
  export { groupRank, slaterScreening } from "./screening.js";
14
+ export { slaterRemovalEnergy, slaterTotalEnergy } from "./slaterEnergy.js";
14
15
  //# sourceMappingURL=index.js.map
@@ -1 +1 @@
1
- {"version":3,"file":"index.js","sourceRoot":"","sources":["../../../src/orbital/core/index.ts"],"names":[],"mappings":"AACA,OAAO,EACL,oBAAoB,EACpB,4BAA4B,GAC7B,MAAM,iBAAiB,CAAC;AAEzB,OAAO,EACL,gBAAgB,EAChB,gBAAgB,EAChB,iBAAiB,EACjB,sBAAsB,GACvB,MAAM,qBAAqB,CAAC;AAE7B,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,gBAAgB,CAAC;AAEzE,OAAO,EACL,iBAAiB,EACjB,qBAAqB,EACrB,cAAc,EACd,WAAW,EACX,qBAAqB,EACrB,eAAe,EACf,gBAAgB,EAChB,mBAAmB,EACnB,eAAe,EACf,WAAW,EACX,gBAAgB,EAChB,aAAa,GACd,MAAM,4BAA4B,CAAC;AAEpC,OAAO,EAAE,YAAY,EAAE,SAAS,EAAE,MAAM,WAAW,CAAC;AAEpD,OAAO,EAAE,aAAa,EAAE,gBAAgB,EAAE,cAAc,EAAE,MAAM,eAAe,CAAC;AAEhF,OAAO,EACL,oBAAoB,EACpB,eAAe,EACf,UAAU,EACV,aAAa,EACb,eAAe,EACf,eAAe,EACf,eAAe,EACf,aAAa,GACd,MAAM,iBAAiB,CAAC;AACzB,OAAO,EACL,gBAAgB,EAChB,cAAc,EACd,wBAAwB,GACzB,MAAM,gBAAgB,CAAC;AAExB,OAAO,EAAE,wBAAwB,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AAKxE,OAAO,EAAE,kBAAkB,EAAE,MAAM,yBAAyB,CAAC;AAE7D,OAAO,EACL,cAAc,EACd,gBAAgB,EAChB,WAAW,EACX,cAAc,GACf,MAAM,oBAAoB,CAAC;AAM5B,OAAO,EAAE,eAAe,EAAE,MAAM,aAAa,CAAC;AAE9C,OAAO,EAAE,SAAS,EAAE,eAAe,EAAE,MAAM,gBAAgB,CAAC"}
1
+ {"version":3,"file":"index.js","sourceRoot":"","sources":["../../../src/orbital/core/index.ts"],"names":[],"mappings":"AACA,OAAO,EACL,oBAAoB,EACpB,4BAA4B,GAC7B,MAAM,iBAAiB,CAAC;AAEzB,OAAO,EACL,gBAAgB,EAChB,gBAAgB,EAChB,iBAAiB,EACjB,sBAAsB,GACvB,MAAM,qBAAqB,CAAC;AAE7B,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,gBAAgB,CAAC;AAEzE,OAAO,EACL,iBAAiB,EACjB,qBAAqB,EACrB,cAAc,EACd,WAAW,EACX,qBAAqB,EACrB,eAAe,EACf,gBAAgB,EAChB,mBAAmB,EACnB,eAAe,EACf,WAAW,EACX,gBAAgB,EAChB,aAAa,GACd,MAAM,4BAA4B,CAAC;AAEpC,OAAO,EAAE,YAAY,EAAE,SAAS,EAAE,MAAM,WAAW,CAAC;AAEpD,OAAO,EAAE,aAAa,EAAE,gBAAgB,EAAE,cAAc,EAAE,MAAM,eAAe,CAAC;AAEhF,OAAO,EACL,oBAAoB,EACpB,eAAe,EACf,UAAU,EACV,aAAa,EACb,eAAe,EACf,eAAe,EACf,eAAe,EACf,aAAa,GACd,MAAM,iBAAiB,CAAC;AACzB,OAAO,EACL,gBAAgB,EAChB,cAAc,EACd,wBAAwB,GACzB,MAAM,gBAAgB,CAAC;AAExB,OAAO,EAAE,wBAAwB,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AAKxE,OAAO,EAAE,kBAAkB,EAAE,MAAM,yBAAyB,CAAC;AAE7D,OAAO,EACL,cAAc,EACd,gBAAgB,EAChB,WAAW,EACX,cAAc,GACf,MAAM,oBAAoB,CAAC;AAM5B,OAAO,EAAE,eAAe,EAAE,MAAM,aAAa,CAAC;AAE9C,OAAO,EAAE,SAAS,EAAE,eAAe,EAAE,MAAM,gBAAgB,CAAC;AAC5D,OAAO,EAAE,mBAAmB,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC"}
@@ -0,0 +1,35 @@
1
+ /**
2
+ * What Slater's rules are actually good for: the energy it takes to pull one
3
+ * electron off the atom.
4
+ *
5
+ * The hydrogen-like orbital energy `−Ry Z_eff²/n²` is the model's own number
6
+ * and it orders the orbitals correctly, but it is not an ionisation energy and
7
+ * must never be read as one — it is 5.4× the measured value for neon, while
8
+ * being within 10% for lithium, so it is not even a constant factor off.
9
+ *
10
+ * Slater fitted his rules to *total* energies, and that is how they are used:
11
+ * add up `n Z_eff²/n²` over every electron of the atom, do the same for the ion
12
+ * with one electron gone — recomputing the shielding, which is the whole point,
13
+ * since the remaining electrons are screened by one fewer neighbour — and
14
+ * subtract. Over the first four periods that difference lands within a factor
15
+ * 0.74–1.81 of the measured first ionisation energy, against 0.9–5.4 for the
16
+ * orbital energy.
17
+ */
18
+ import type { Subshell, SubshellOccupancy } from './electronConfiguration.ts';
19
+ /**
20
+ * Total electronic energy of a configuration in the Slater model.
21
+ * @param atomicNumber - Proton count, the `Z` each electron is screened from.
22
+ * @param configuration - Every occupied subshell.
23
+ * @returns The sum of `−Ry Z_eff²/n²` over every electron, electronvolts.
24
+ */
25
+ export declare function slaterTotalEnergy(atomicNumber: number, configuration: readonly SubshellOccupancy[]): number;
26
+ /**
27
+ * Energy needed to take one electron out of a subshell and off the atom.
28
+ * @param atomicNumber - Proton count.
29
+ * @param configuration - Every occupied subshell of the neutral atom.
30
+ * @param subshell - The subshell the electron leaves.
31
+ * @returns `E(ion) − E(atom)`, electronvolts, positive for a bound electron.
32
+ * @throws {RangeError} When that subshell holds no electron to remove.
33
+ */
34
+ export declare function slaterRemovalEnergy(atomicNumber: number, configuration: readonly SubshellOccupancy[], subshell: Subshell): number;
35
+ //# sourceMappingURL=slaterEnergy.d.ts.map
@@ -0,0 +1 @@
1
+ {"version":3,"file":"slaterEnergy.d.ts","sourceRoot":"","sources":["../../../src/orbital/core/slaterEnergy.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;;;;GAgBG;AAGH,OAAO,KAAK,EAAE,QAAQ,EAAE,iBAAiB,EAAE,MAAM,4BAA4B,CAAC;AAG9E;;;;;GAKG;AACH,wBAAgB,iBAAiB,CAC/B,YAAY,EAAE,MAAM,EACpB,aAAa,EAAE,SAAS,iBAAiB,EAAE,GAC1C,MAAM,CAgBR;AAED;;;;;;;GAOG;AACH,wBAAgB,mBAAmB,CACjC,YAAY,EAAE,MAAM,EACpB,aAAa,EAAE,SAAS,iBAAiB,EAAE,EAC3C,QAAQ,EAAE,QAAQ,GACjB,MAAM,CAqBR"}
@@ -0,0 +1,66 @@
1
+ /**
2
+ * What Slater's rules are actually good for: the energy it takes to pull one
3
+ * electron off the atom.
4
+ *
5
+ * The hydrogen-like orbital energy `−Ry Z_eff²/n²` is the model's own number
6
+ * and it orders the orbitals correctly, but it is not an ionisation energy and
7
+ * must never be read as one — it is 5.4× the measured value for neon, while
8
+ * being within 10% for lithium, so it is not even a constant factor off.
9
+ *
10
+ * Slater fitted his rules to *total* energies, and that is how they are used:
11
+ * add up `n Z_eff²/n²` over every electron of the atom, do the same for the ion
12
+ * with one electron gone — recomputing the shielding, which is the whole point,
13
+ * since the remaining electrons are screened by one fewer neighbour — and
14
+ * subtract. Over the first four periods that difference lands within a factor
15
+ * 0.74–1.81 of the measured first ionisation energy, against 0.9–5.4 for the
16
+ * orbital energy.
17
+ */
18
+ import { RYDBERG_ELECTRONVOLTS } from "./constants.js";
19
+ import { slaterScreening } from "./screening.js";
20
+ /**
21
+ * Total electronic energy of a configuration in the Slater model.
22
+ * @param atomicNumber - Proton count, the `Z` each electron is screened from.
23
+ * @param configuration - Every occupied subshell.
24
+ * @returns The sum of `−Ry Z_eff²/n²` over every electron, electronvolts.
25
+ */
26
+ export function slaterTotalEnergy(atomicNumber, configuration) {
27
+ let energy = 0;
28
+ for (const occupied of configuration) {
29
+ const { effectiveCharge } = slaterScreening(atomicNumber, configuration, occupied);
30
+ energy -=
31
+ (occupied.electrons *
32
+ RYDBERG_ELECTRONVOLTS *
33
+ effectiveCharge *
34
+ effectiveCharge) /
35
+ (occupied.n * occupied.n);
36
+ }
37
+ return energy;
38
+ }
39
+ /**
40
+ * Energy needed to take one electron out of a subshell and off the atom.
41
+ * @param atomicNumber - Proton count.
42
+ * @param configuration - Every occupied subshell of the neutral atom.
43
+ * @param subshell - The subshell the electron leaves.
44
+ * @returns `E(ion) − E(atom)`, electronvolts, positive for a bound electron.
45
+ * @throws {RangeError} When that subshell holds no electron to remove.
46
+ */
47
+ export function slaterRemovalEnergy(atomicNumber, configuration, subshell) {
48
+ const ion = [];
49
+ let found = false;
50
+ for (const occupied of configuration) {
51
+ if (occupied.n === subshell.n && occupied.l === subshell.l) {
52
+ found = true;
53
+ if (occupied.electrons === 1)
54
+ continue;
55
+ ion.push({ ...occupied, electrons: occupied.electrons - 1 });
56
+ continue;
57
+ }
58
+ ion.push(occupied);
59
+ }
60
+ if (!found) {
61
+ throw new RangeError(`the ${subshell.n}${'spdf'[subshell.l] ?? '?'} subshell holds no electron to remove`);
62
+ }
63
+ return (slaterTotalEnergy(atomicNumber, ion) -
64
+ slaterTotalEnergy(atomicNumber, configuration));
65
+ }
66
+ //# sourceMappingURL=slaterEnergy.js.map
@@ -0,0 +1 @@
1
+ {"version":3,"file":"slaterEnergy.js","sourceRoot":"","sources":["../../../src/orbital/core/slaterEnergy.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;;;;GAgBG;AAEH,OAAO,EAAE,qBAAqB,EAAE,MAAM,gBAAgB,CAAC;AAEvD,OAAO,EAAE,eAAe,EAAE,MAAM,gBAAgB,CAAC;AAEjD;;;;;GAKG;AACH,MAAM,UAAU,iBAAiB,CAC/B,YAAoB,EACpB,aAA2C;IAE3C,IAAI,MAAM,GAAG,CAAC,CAAC;IACf,KAAK,MAAM,QAAQ,IAAI,aAAa,EAAE,CAAC;QACrC,MAAM,EAAE,eAAe,EAAE,GAAG,eAAe,CACzC,YAAY,EACZ,aAAa,EACb,QAAQ,CACT,CAAC;QACF,MAAM;YACJ,CAAC,QAAQ,CAAC,SAAS;gBACjB,qBAAqB;gBACrB,eAAe;gBACf,eAAe,CAAC;gBAClB,CAAC,QAAQ,CAAC,CAAC,GAAG,QAAQ,CAAC,CAAC,CAAC,CAAC;IAC9B,CAAC;IACD,OAAO,MAAM,CAAC;AAChB,CAAC;AAED;;;;;;;GAOG;AACH,MAAM,UAAU,mBAAmB,CACjC,YAAoB,EACpB,aAA2C,EAC3C,QAAkB;IAElB,MAAM,GAAG,GAAwB,EAAE,CAAC;IACpC,IAAI,KAAK,GAAG,KAAK,CAAC;IAClB,KAAK,MAAM,QAAQ,IAAI,aAAa,EAAE,CAAC;QACrC,IAAI,QAAQ,CAAC,CAAC,KAAK,QAAQ,CAAC,CAAC,IAAI,QAAQ,CAAC,CAAC,KAAK,QAAQ,CAAC,CAAC,EAAE,CAAC;YAC3D,KAAK,GAAG,IAAI,CAAC;YACb,IAAI,QAAQ,CAAC,SAAS,KAAK,CAAC;gBAAE,SAAS;YACvC,GAAG,CAAC,IAAI,CAAC,EAAE,GAAG,QAAQ,EAAE,SAAS,EAAE,QAAQ,CAAC,SAAS,GAAG,CAAC,EAAE,CAAC,CAAC;YAC7D,SAAS;QACX,CAAC;QACD,GAAG,CAAC,IAAI,CAAC,QAAQ,CAAC,CAAC;IACrB,CAAC;IACD,IAAI,CAAC,KAAK,EAAE,CAAC;QACX,MAAM,IAAI,UAAU,CAClB,OAAO,QAAQ,CAAC,CAAC,GAAG,MAAM,CAAC,QAAQ,CAAC,CAAC,CAAC,IAAI,GAAG,uCAAuC,CACrF,CAAC;IACJ,CAAC;IACD,OAAO,CACL,iBAAiB,CAAC,YAAY,EAAE,GAAG,CAAC;QACpC,iBAAiB,CAAC,YAAY,EAAE,aAAa,CAAC,CAC/C,CAAC;AACJ,CAAC"}
@@ -10,8 +10,8 @@ export type { EmptiestCornerOptions } from './emptiestCorner.ts';
10
10
  export { emptiestCorner } from './emptiestCorner.ts';
11
11
  export type { OverlayBarFoldOptions } from './overlayCollapse.ts';
12
12
  export { overlayBarFolded, shouldCollapseOverlay } from './overlayCollapse.ts';
13
- export type { OverlayMarkShape } from './overlayMarks.ts';
14
- export { OVERLAY_MARK_SHAPES, isFilledMark } from './overlayMarks.ts';
13
+ export type { OverlayMarkShape, OverlaySampleShape } from './overlayMarks.ts';
14
+ export { OVERLAY_MARK_SHAPES, OVERLAY_SAMPLE_SHAPES, isFilledMark, } from './overlayMarks.ts';
15
15
  export type { OverlayDensity, OverlayMetrics, OverlayPointerKind, } from './overlayMetrics.ts';
16
16
  export { overlayMetrics } from './overlayMetrics.ts';
17
17
  export type { OverlayCorner, OverlayCornerStyle, OverlayPlacement, } from './overlayPlacement.ts';
@@ -1 +1 @@
1
- {"version":3,"file":"index.d.ts","sourceRoot":"","sources":["../../../src/overlay/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;GAOG;AAEH,YAAY,EAAE,qBAAqB,EAAE,MAAM,qBAAqB,CAAC;AACjE,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,YAAY,EAAE,qBAAqB,EAAE,MAAM,sBAAsB,CAAC;AAClE,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,sBAAsB,CAAC;AAC/E,YAAY,EAAE,gBAAgB,EAAE,MAAM,mBAAmB,CAAC;AAC1D,OAAO,EAAE,mBAAmB,EAAE,YAAY,EAAE,MAAM,mBAAmB,CAAC;AACtE,YAAY,EACV,cAAc,EACd,cAAc,EACd,kBAAkB,GACnB,MAAM,qBAAqB,CAAC;AAC7B,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,YAAY,EACV,aAAa,EACb,kBAAkB,EAClB,gBAAgB,GACjB,MAAM,uBAAuB,CAAC;AAC/B,OAAO,EAAE,kBAAkB,EAAE,MAAM,uBAAuB,CAAC;AAC3D,YAAY,EAAE,eAAe,EAAE,kBAAkB,EAAE,MAAM,sBAAsB,CAAC;AAChF,YAAY,EAAE,WAAW,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC;AACxE,OAAO,EAAE,WAAW,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC;AACnE,YAAY,EACV,oBAAoB,EACpB,2BAA2B,GAC5B,MAAM,uBAAuB,CAAC;AAC/B,OAAO,EAAE,gBAAgB,EAAE,MAAM,uBAAuB,CAAC"}
1
+ {"version":3,"file":"index.d.ts","sourceRoot":"","sources":["../../../src/overlay/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;GAOG;AAEH,YAAY,EAAE,qBAAqB,EAAE,MAAM,qBAAqB,CAAC;AACjE,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,YAAY,EAAE,qBAAqB,EAAE,MAAM,sBAAsB,CAAC;AAClE,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,sBAAsB,CAAC;AAC/E,YAAY,EAAE,gBAAgB,EAAE,kBAAkB,EAAE,MAAM,mBAAmB,CAAC;AAC9E,OAAO,EACL,mBAAmB,EACnB,qBAAqB,EACrB,YAAY,GACb,MAAM,mBAAmB,CAAC;AAC3B,YAAY,EACV,cAAc,EACd,cAAc,EACd,kBAAkB,GACnB,MAAM,qBAAqB,CAAC;AAC7B,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,YAAY,EACV,aAAa,EACb,kBAAkB,EAClB,gBAAgB,GACjB,MAAM,uBAAuB,CAAC;AAC/B,OAAO,EAAE,kBAAkB,EAAE,MAAM,uBAAuB,CAAC;AAC3D,YAAY,EAAE,eAAe,EAAE,kBAAkB,EAAE,MAAM,sBAAsB,CAAC;AAChF,YAAY,EAAE,WAAW,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC;AACxE,OAAO,EAAE,WAAW,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC;AACnE,YAAY,EACV,oBAAoB,EACpB,2BAA2B,GAC5B,MAAM,uBAAuB,CAAC;AAC/B,OAAO,EAAE,gBAAgB,EAAE,MAAM,uBAAuB,CAAC"}
@@ -8,7 +8,7 @@
8
8
  */
9
9
  export { emptiestCorner } from "./emptiestCorner.js";
10
10
  export { overlayBarFolded, shouldCollapseOverlay } from "./overlayCollapse.js";
11
- export { OVERLAY_MARK_SHAPES, isFilledMark } from "./overlayMarks.js";
11
+ export { OVERLAY_MARK_SHAPES, OVERLAY_SAMPLE_SHAPES, isFilledMark, } from "./overlayMarks.js";
12
12
  export { overlayMetrics } from "./overlayMetrics.js";
13
13
  export { overlayCornerStyle } from "./overlayPlacement.js";
14
14
  export { overlayTier, overlayTierWidths } from "./overlayTiers.js";
@@ -1 +1 @@
1
- {"version":3,"file":"index.js","sourceRoot":"","sources":["../../../src/overlay/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;GAOG;AAGH,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AAErD,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,sBAAsB,CAAC;AAE/E,OAAO,EAAE,mBAAmB,EAAE,YAAY,EAAE,MAAM,mBAAmB,CAAC;AAMtE,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AAMrD,OAAO,EAAE,kBAAkB,EAAE,MAAM,uBAAuB,CAAC;AAG3D,OAAO,EAAE,WAAW,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC;AAKnE,OAAO,EAAE,gBAAgB,EAAE,MAAM,uBAAuB,CAAC"}
1
+ {"version":3,"file":"index.js","sourceRoot":"","sources":["../../../src/overlay/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;GAOG;AAGH,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AAErD,OAAO,EAAE,gBAAgB,EAAE,qBAAqB,EAAE,MAAM,sBAAsB,CAAC;AAE/E,OAAO,EACL,mBAAmB,EACnB,qBAAqB,EACrB,YAAY,GACb,MAAM,mBAAmB,CAAC;AAM3B,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AAMrD,OAAO,EAAE,kBAAkB,EAAE,MAAM,uBAAuB,CAAC;AAG3D,OAAO,EAAE,WAAW,EAAE,iBAAiB,EAAE,MAAM,mBAAmB,CAAC;AAKnE,OAAO,EAAE,gBAAgB,EAAE,MAAM,uBAAuB,CAAC"}
@@ -8,16 +8,31 @@
8
8
  * describe its own marks without a `core` module reaching into a `ui` one.
9
9
  */
10
10
  /** Which mark a legend entry, a marker or a series stands for. */
11
- export type OverlayMarkShape = 'dot' | 'ring' | 'square' | 'line' | 'dashed' | 'cross';
11
+ export type OverlayMarkShape = 'dot' | 'ring' | 'square' | 'triangle' | 'diamond' | 'triangle-down' | 'line' | 'dashed' | 'cross';
12
+ /**
13
+ * The shapes a sample's own dot can take, which is how a second grouping of
14
+ * the same samples is drawn while colour keeps the first.
15
+ */
16
+ export type OverlaySampleShape = Extract<OverlayMarkShape, 'dot' | 'square' | 'triangle' | 'diamond' | 'triangle-down'>;
12
17
  /**
13
18
  * Every mark, in the order a picker offers them.
14
19
  *
15
- * The first three separate one filled thing from another by colour alone; the
16
- * last three carry a second meaning on one figure — a line for a component
17
- * beside dots for the samples — which is what keeps a figure readable when the
18
- * colours run out or the reader does not separate two of them.
20
+ * The filled ones come first and separate one thing from another by colour or
21
+ * by outline alone; the last three carry a second meaning on one figure — a
22
+ * line for a component beside dots for the samples — which is what keeps a
23
+ * figure readable when the colours run out or the reader does not separate two
24
+ * of them.
19
25
  */
20
26
  export declare const OVERLAY_MARK_SHAPES: readonly OverlayMarkShape[];
27
+ /**
28
+ * The shapes a second grouping is given, in the order its groups are listed.
29
+ *
30
+ * Five, because that is about where a reader stops telling small shapes apart
31
+ * at a glance. None of them is a ring or a cross: a ring is a sample placed
32
+ * into a finished model and a cross is a group's average, and a sample drawn
33
+ * as either would be read as one of those.
34
+ */
35
+ export declare const OVERLAY_SAMPLE_SHAPES: readonly OverlaySampleShape[];
21
36
  /**
22
37
  * Whether a mark is drawn as a solid area rather than as a stroke.
23
38
  *
@@ -1 +1 @@
1
- {"version":3,"file":"overlayMarks.d.ts","sourceRoot":"","sources":["../../../src/overlay/core/overlayMarks.ts"],"names":[],"mappings":"AAAA;;;;;;;;GAQG;AAEH,kEAAkE;AAClE,MAAM,MAAM,gBAAgB,GAC1B,KAAK,GAAG,MAAM,GAAG,QAAQ,GAAG,MAAM,GAAG,QAAQ,GAAG,OAAO,CAAC;AAE1D;;;;;;;GAOG;AACH,eAAO,MAAM,mBAAmB,EAAE,SAAS,gBAAgB,EAO1D,CAAC;AAEF;;;;;;;;GAQG;AACH,wBAAgB,YAAY,CAAC,KAAK,EAAE,gBAAgB,GAAG,OAAO,CAE7D"}
1
+ {"version":3,"file":"overlayMarks.d.ts","sourceRoot":"","sources":["../../../src/overlay/core/overlayMarks.ts"],"names":[],"mappings":"AAAA;;;;;;;;GAQG;AAEH,kEAAkE;AAClE,MAAM,MAAM,gBAAgB,GACxB,KAAK,GACL,MAAM,GACN,QAAQ,GACR,UAAU,GACV,SAAS,GACT,eAAe,GACf,MAAM,GACN,QAAQ,GACR,OAAO,CAAC;AAEZ;;;GAGG;AACH,MAAM,MAAM,kBAAkB,GAAG,OAAO,CACtC,gBAAgB,EAChB,KAAK,GAAG,QAAQ,GAAG,UAAU,GAAG,SAAS,GAAG,eAAe,CAC5D,CAAC;AAEF;;;;;;;;GAQG;AACH,eAAO,MAAM,mBAAmB,EAAE,SAAS,gBAAgB,EAU1D,CAAC;AAEF;;;;;;;GAOG;AACH,eAAO,MAAM,qBAAqB,EAAE,SAAS,kBAAkB,EAM9D,CAAC;AAEF;;;;;;;;GAQG;AACH,wBAAgB,YAAY,CAAC,KAAK,EAAE,gBAAgB,GAAG,OAAO,CAE7D"}
@@ -10,19 +10,38 @@
10
10
  /**
11
11
  * Every mark, in the order a picker offers them.
12
12
  *
13
- * The first three separate one filled thing from another by colour alone; the
14
- * last three carry a second meaning on one figure — a line for a component
15
- * beside dots for the samples — which is what keeps a figure readable when the
16
- * colours run out or the reader does not separate two of them.
13
+ * The filled ones come first and separate one thing from another by colour or
14
+ * by outline alone; the last three carry a second meaning on one figure — a
15
+ * line for a component beside dots for the samples — which is what keeps a
16
+ * figure readable when the colours run out or the reader does not separate two
17
+ * of them.
17
18
  */
18
19
  export const OVERLAY_MARK_SHAPES = [
19
20
  'dot',
20
21
  'ring',
21
22
  'square',
23
+ 'triangle',
24
+ 'diamond',
25
+ 'triangle-down',
22
26
  'line',
23
27
  'dashed',
24
28
  'cross',
25
29
  ];
30
+ /**
31
+ * The shapes a second grouping is given, in the order its groups are listed.
32
+ *
33
+ * Five, because that is about where a reader stops telling small shapes apart
34
+ * at a glance. None of them is a ring or a cross: a ring is a sample placed
35
+ * into a finished model and a cross is a group's average, and a sample drawn
36
+ * as either would be read as one of those.
37
+ */
38
+ export const OVERLAY_SAMPLE_SHAPES = [
39
+ 'dot',
40
+ 'square',
41
+ 'triangle',
42
+ 'diamond',
43
+ 'triangle-down',
44
+ ];
26
45
  /**
27
46
  * Whether a mark is drawn as a solid area rather than as a stroke.
28
47
  *
@@ -33,6 +52,13 @@ export const OVERLAY_MARK_SHAPES = [
33
52
  * @returns `true` for the filled marks, `false` for the drawn ones.
34
53
  */
35
54
  export function isFilledMark(shape) {
36
- return shape === 'dot' || shape === 'square';
55
+ return FILLED_MARKS.has(shape);
37
56
  }
57
+ const FILLED_MARKS = new Set([
58
+ 'dot',
59
+ 'square',
60
+ 'triangle',
61
+ 'diamond',
62
+ 'triangle-down',
63
+ ]);
38
64
  //# sourceMappingURL=overlayMarks.js.map
@@ -1 +1 @@
1
- {"version":3,"file":"overlayMarks.js","sourceRoot":"","sources":["../../../src/overlay/core/overlayMarks.ts"],"names":[],"mappings":"AAAA;;;;;;;;GAQG;AAMH;;;;;;;GAOG;AACH,MAAM,CAAC,MAAM,mBAAmB,GAAgC;IAC9D,KAAK;IACL,MAAM;IACN,QAAQ;IACR,MAAM;IACN,QAAQ;IACR,OAAO;CACR,CAAC;AAEF;;;;;;;;GAQG;AACH,MAAM,UAAU,YAAY,CAAC,KAAuB;IAClD,OAAO,KAAK,KAAK,KAAK,IAAI,KAAK,KAAK,QAAQ,CAAC;AAC/C,CAAC"}
1
+ {"version":3,"file":"overlayMarks.js","sourceRoot":"","sources":["../../../src/overlay/core/overlayMarks.ts"],"names":[],"mappings":"AAAA;;;;;;;;GAQG;AAuBH;;;;;;;;GAQG;AACH,MAAM,CAAC,MAAM,mBAAmB,GAAgC;IAC9D,KAAK;IACL,MAAM;IACN,QAAQ;IACR,UAAU;IACV,SAAS;IACT,eAAe;IACf,MAAM;IACN,QAAQ;IACR,OAAO;CACR,CAAC;AAEF;;;;;;;GAOG;AACH,MAAM,CAAC,MAAM,qBAAqB,GAAkC;IAClE,KAAK;IACL,QAAQ;IACR,UAAU;IACV,SAAS;IACT,eAAe;CAChB,CAAC;AAEF;;;;;;;;GAQG;AACH,MAAM,UAAU,YAAY,CAAC,KAAuB;IAClD,OAAO,YAAY,CAAC,GAAG,CAAC,KAAK,CAAC,CAAC;AACjC,CAAC;AAED,MAAM,YAAY,GAAkC,IAAI,GAAG,CAAmB;IAC5E,KAAK;IACL,QAAQ;IACR,UAAU;IACV,SAAS;IACT,eAAe;CAChB,CAAC,CAAC"}
@@ -30,6 +30,11 @@ const MARK_GEOMETRY = {
30
30
  dot: _jsx("circle", { cx: "6", cy: "6", r: "4.2" }),
31
31
  ring: _jsx("circle", { cx: "6", cy: "6", r: "3.4", strokeWidth: "2.2" }),
32
32
  square: _jsx("rect", { x: "2", y: "2", width: "8", height: "8", rx: "1.5" }),
33
+ // Balanced on the centre of the box, as the dots they name are balanced on
34
+ // their samples.
35
+ triangle: _jsx("path", { d: "M6 0.8L10.5 8.6L1.5 8.6Z" }),
36
+ diamond: _jsx("path", { d: "M6 1L11 6L6 11L1 6Z" }),
37
+ 'triangle-down': _jsx("path", { d: "M1.5 3.4L10.5 3.4L6 11.2Z" }),
33
38
  line: _jsx("line", { x1: "0.5", y1: "6", x2: "11.5", y2: "6", strokeWidth: "2.8" }),
34
39
  dashed: (_jsx("line", { x1: "0.5", y1: "6", x2: "11.5", y2: "6", strokeWidth: "2.8", strokeDasharray: "3.4 2.6" })),
35
40
  cross: _jsx("path", { d: "M2.2 2.2 L9.8 9.8 M9.8 2.2 L2.2 9.8", strokeWidth: "2.4" }),
@@ -1 +1 @@
1
- {"version":3,"file":"OverlayLegendMark.js","sourceRoot":"","sources":["../../../src/overlay/ui/OverlayLegendMark.tsx"],"names":[],"mappings":";AAGA,OAAO,EAAE,YAAY,EAAE,MAAM,yBAAyB,CAAC;AAuBvD;;;;;;;;;;;GAWG;AACH,MAAM,UAAU,iBAAiB,CAAC,KAA6B;IAC7D,MAAM,EAAE,KAAK,EAAE,KAAK,GAAG,KAAK,EAAE,IAAI,GAAG,EAAE,EAAE,KAAK,GAAG,KAAK,EAAE,GAAG,KAAK,CAAC;IACjE,MAAM,MAAM,GAAG,YAAY,CAAC,KAAK,CAAC,CAAC;IAEnC,OAAO,CACL,cACE,KAAK,EAAE,IAAI,EACX,MAAM,EAAE,IAAI,EACZ,OAAO,EAAC,WAAW,iBACP,MAAM,EAClB,SAAS,EAAC,OAAO,EACjB,KAAK,EAAE;YACL,OAAO,EAAE,OAAO;YAChB,IAAI,EAAE,MAAM;YACZ,OAAO,EAAE,KAAK,CAAC,CAAC,CAAC,aAAa,CAAC,CAAC,CAAC,CAAC;SACnC,YAED,YACE,IAAI,EAAE,MAAM,CAAC,CAAC,CAAC,KAAK,CAAC,CAAC,CAAC,MAAM,EAC7B,MAAM,EAAE,MAAM,CAAC,CAAC,CAAC,MAAM,CAAC,CAAC,CAAC,KAAK,EAC/B,aAAa,EAAC,OAAO,YAEpB,aAAa,CAAC,KAAK,CAAC,GACnB,GACA,CACP,CAAC;AACJ,CAAC;AAED;;;;GAIG;AACH,MAAM,aAAa,GAA2C;IAC5D,GAAG,EAAE,iBAAQ,EAAE,EAAC,GAAG,EAAC,EAAE,EAAC,GAAG,EAAC,CAAC,EAAC,KAAK,GAAG;IACrC,IAAI,EAAE,iBAAQ,EAAE,EAAC,GAAG,EAAC,EAAE,EAAC,GAAG,EAAC,CAAC,EAAC,KAAK,EAAC,WAAW,EAAC,KAAK,GAAG;IACxD,MAAM,EAAE,eAAM,CAAC,EAAC,GAAG,EAAC,CAAC,EAAC,GAAG,EAAC,KAAK,EAAC,GAAG,EAAC,MAAM,EAAC,GAAG,EAAC,EAAE,EAAC,KAAK,GAAG;IAC1D,IAAI,EAAE,eAAM,EAAE,EAAC,KAAK,EAAC,EAAE,EAAC,GAAG,EAAC,EAAE,EAAC,MAAM,EAAC,EAAE,EAAC,GAAG,EAAC,WAAW,EAAC,KAAK,GAAG;IACjE,MAAM,EAAE,CACN,eACE,EAAE,EAAC,KAAK,EACR,EAAE,EAAC,GAAG,EACN,EAAE,EAAC,MAAM,EACT,EAAE,EAAC,GAAG,EACN,WAAW,EAAC,KAAK,EACjB,eAAe,EAAC,SAAS,GACzB,CACH;IACD,KAAK,EAAE,eAAM,CAAC,EAAC,qCAAqC,EAAC,WAAW,EAAC,KAAK,GAAG;CAC1E,CAAC;AAEF;;;;GAIG;AACH,MAAM,aAAa,GAAG,IAAI,CAAC"}
1
+ {"version":3,"file":"OverlayLegendMark.js","sourceRoot":"","sources":["../../../src/overlay/ui/OverlayLegendMark.tsx"],"names":[],"mappings":";AAGA,OAAO,EAAE,YAAY,EAAE,MAAM,yBAAyB,CAAC;AAuBvD;;;;;;;;;;;GAWG;AACH,MAAM,UAAU,iBAAiB,CAAC,KAA6B;IAC7D,MAAM,EAAE,KAAK,EAAE,KAAK,GAAG,KAAK,EAAE,IAAI,GAAG,EAAE,EAAE,KAAK,GAAG,KAAK,EAAE,GAAG,KAAK,CAAC;IACjE,MAAM,MAAM,GAAG,YAAY,CAAC,KAAK,CAAC,CAAC;IAEnC,OAAO,CACL,cACE,KAAK,EAAE,IAAI,EACX,MAAM,EAAE,IAAI,EACZ,OAAO,EAAC,WAAW,iBACP,MAAM,EAClB,SAAS,EAAC,OAAO,EACjB,KAAK,EAAE;YACL,OAAO,EAAE,OAAO;YAChB,IAAI,EAAE,MAAM;YACZ,OAAO,EAAE,KAAK,CAAC,CAAC,CAAC,aAAa,CAAC,CAAC,CAAC,CAAC;SACnC,YAED,YACE,IAAI,EAAE,MAAM,CAAC,CAAC,CAAC,KAAK,CAAC,CAAC,CAAC,MAAM,EAC7B,MAAM,EAAE,MAAM,CAAC,CAAC,CAAC,MAAM,CAAC,CAAC,CAAC,KAAK,EAC/B,aAAa,EAAC,OAAO,YAEpB,aAAa,CAAC,KAAK,CAAC,GACnB,GACA,CACP,CAAC;AACJ,CAAC;AAED;;;;GAIG;AACH,MAAM,aAAa,GAA2C;IAC5D,GAAG,EAAE,iBAAQ,EAAE,EAAC,GAAG,EAAC,EAAE,EAAC,GAAG,EAAC,CAAC,EAAC,KAAK,GAAG;IACrC,IAAI,EAAE,iBAAQ,EAAE,EAAC,GAAG,EAAC,EAAE,EAAC,GAAG,EAAC,CAAC,EAAC,KAAK,EAAC,WAAW,EAAC,KAAK,GAAG;IACxD,MAAM,EAAE,eAAM,CAAC,EAAC,GAAG,EAAC,CAAC,EAAC,GAAG,EAAC,KAAK,EAAC,GAAG,EAAC,MAAM,EAAC,GAAG,EAAC,EAAE,EAAC,KAAK,GAAG;IAC1D,2EAA2E;IAC3E,iBAAiB;IACjB,QAAQ,EAAE,eAAM,CAAC,EAAC,0BAA0B,GAAG;IAC/C,OAAO,EAAE,eAAM,CAAC,EAAC,qBAAqB,GAAG;IACzC,eAAe,EAAE,eAAM,CAAC,EAAC,2BAA2B,GAAG;IACvD,IAAI,EAAE,eAAM,EAAE,EAAC,KAAK,EAAC,EAAE,EAAC,GAAG,EAAC,EAAE,EAAC,MAAM,EAAC,EAAE,EAAC,GAAG,EAAC,WAAW,EAAC,KAAK,GAAG;IACjE,MAAM,EAAE,CACN,eACE,EAAE,EAAC,KAAK,EACR,EAAE,EAAC,GAAG,EACN,EAAE,EAAC,MAAM,EACT,EAAE,EAAC,GAAG,EACN,WAAW,EAAC,KAAK,EACjB,eAAe,EAAC,SAAS,GACzB,CACH;IACD,KAAK,EAAE,eAAM,CAAC,EAAC,qCAAqC,EAAC,WAAW,EAAC,KAAK,GAAG;CAC1E,CAAC;AAEF;;;;GAIG;AACH,MAAM,aAAa,GAAG,IAAI,CAAC"}
@@ -25,13 +25,13 @@ export { pcaResult } from './pcaResult.ts';
25
25
  export type { ProjectionCopy } from './projectionCopy.ts';
26
26
  export { PROJECTION_COPY } from './projectionCopy.ts';
27
27
  export type { ProjectionCopyPatch } from './projectionCopyPatch.ts';
28
- export type { ProjectionColorBy, ProjectionOptionId, ProjectionOptions, ProjectionVariablesView, } from './projectionOptions.ts';
28
+ export type { ProjectionOptionId, ProjectionOptions, ProjectionVariablesView, } from './projectionOptions.ts';
29
29
  export { mergeProjectionCopy } from './mergeProjectionCopy.ts';
30
- export { DEFAULT_PROJECTION_OPTIONS } from './projectionOptions.ts';
30
+ export { DEFAULT_PROJECTION_OPTIONS, NO_GROUPING, } from './projectionOptions.ts';
31
31
  export type { ProjectionChoiceWords, ProjectionOutlineWords, ProjectionPanelWords, ProjectionReasonWords, } from './projectionPanelWords.ts';
32
32
  export type { ProjectionAxis, ProjectionLoadings, ProjectionMarker, ProjectionResult, } from './projectionResult.ts';
33
- export type { ProjectionField, ProjectionSamples, ResolvedProjectionGroups, } from './projectionSamples.ts';
34
- export { resolveProjectionGroups } from './projectionSamples.ts';
33
+ export type { ProjectionField, ProjectionGrouping, ProjectionSamples, ResolvedProjectionGroups, ResolvedProjectionShapes, } from './projectionSamples.ts';
34
+ export { projectionGrouping, resolveProjectionGroups, resolveProjectionShapes, } from './projectionGroupings.ts';
35
35
  export type { ProjectionBarWords, ProjectionHelp, ProjectionHelpExample, } from './projectionStrings.ts';
36
36
  export { PROJECTION_HELP } from './projectionStrings.ts';
37
37
  export type { ProjectionTab } from './projectionTabs.ts';
@@ -1 +1 @@
1
- {"version":3,"file":"index.d.ts","sourceRoot":"","sources":["../../../src/projection/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;GAaG;AAEH,YAAY,EAAE,sBAAsB,EAAE,MAAM,sBAAsB,CAAC;AACnE,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,YAAY,EACV,cAAc,EACd,eAAe,EACf,sBAAsB,GACvB,MAAM,sBAAsB,CAAC;AAC9B,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,YAAY,EACV,cAAc,EACd,eAAe,EACf,sBAAsB,GACvB,MAAM,sBAAsB,CAAC;AAC9B,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,OAAO,EAAE,QAAQ,EAAE,MAAM,eAAe,CAAC;AACzC,YAAY,EAAE,OAAO,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AAC5D,YAAY,EAAE,gBAAgB,EAAE,MAAM,gBAAgB,CAAC;AACvD,OAAO,EAAE,SAAS,EAAE,MAAM,gBAAgB,CAAC;AAC3C,YAAY,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AAC1D,OAAO,EAAE,eAAe,EAAE,MAAM,qBAAqB,CAAC;AACtD,YAAY,EAAE,mBAAmB,EAAE,MAAM,0BAA0B,CAAC;AACpE,YAAY,EACV,iBAAiB,EACjB,kBAAkB,EAClB,iBAAiB,EACjB,uBAAuB,GACxB,MAAM,wBAAwB,CAAC;AAChC,OAAO,EAAE,mBAAmB,EAAE,MAAM,0BAA0B,CAAC;AAC/D,OAAO,EAAE,0BAA0B,EAAE,MAAM,wBAAwB,CAAC;AACpE,YAAY,EACV,qBAAqB,EACrB,sBAAsB,EACtB,oBAAoB,EACpB,qBAAqB,GACtB,MAAM,2BAA2B,CAAC;AACnC,YAAY,EACV,cAAc,EACd,kBAAkB,EAClB,gBAAgB,EAChB,gBAAgB,GACjB,MAAM,uBAAuB,CAAC;AAC/B,YAAY,EACV,eAAe,EACf,iBAAiB,EACjB,wBAAwB,GACzB,MAAM,wBAAwB,CAAC;AAChC,OAAO,EAAE,uBAAuB,EAAE,MAAM,wBAAwB,CAAC;AACjE,YAAY,EACV,kBAAkB,EAClB,cAAc,EACd,qBAAqB,GACtB,MAAM,wBAAwB,CAAC;AAChC,OAAO,EAAE,eAAe,EAAE,MAAM,wBAAwB,CAAC;AACzD,YAAY,EAAE,aAAa,EAAE,MAAM,qBAAqB,CAAC;AACzD,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,OAAO,EAAE,wBAAwB,EAAE,MAAM,+BAA+B,CAAC;AACzE,YAAY,EACV,sBAAsB,EACtB,iBAAiB,EACjB,iBAAiB,EACjB,YAAY,GACb,MAAM,mBAAmB,CAAC;AAC3B,OAAO,EACL,aAAa,EACb,gBAAgB,EAChB,aAAa,EACb,iBAAiB,GAClB,MAAM,mBAAmB,CAAC"}
1
+ {"version":3,"file":"index.d.ts","sourceRoot":"","sources":["../../../src/projection/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;GAaG;AAEH,YAAY,EAAE,sBAAsB,EAAE,MAAM,sBAAsB,CAAC;AACnE,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,YAAY,EACV,cAAc,EACd,eAAe,EACf,sBAAsB,GACvB,MAAM,sBAAsB,CAAC;AAC9B,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,YAAY,EACV,cAAc,EACd,eAAe,EACf,sBAAsB,GACvB,MAAM,sBAAsB,CAAC;AAC9B,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,OAAO,EAAE,QAAQ,EAAE,MAAM,eAAe,CAAC;AACzC,YAAY,EAAE,OAAO,EAAE,cAAc,EAAE,MAAM,cAAc,CAAC;AAC5D,YAAY,EAAE,gBAAgB,EAAE,MAAM,gBAAgB,CAAC;AACvD,OAAO,EAAE,SAAS,EAAE,MAAM,gBAAgB,CAAC;AAC3C,YAAY,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AAC1D,OAAO,EAAE,eAAe,EAAE,MAAM,qBAAqB,CAAC;AACtD,YAAY,EAAE,mBAAmB,EAAE,MAAM,0BAA0B,CAAC;AACpE,YAAY,EACV,kBAAkB,EAClB,iBAAiB,EACjB,uBAAuB,GACxB,MAAM,wBAAwB,CAAC;AAChC,OAAO,EAAE,mBAAmB,EAAE,MAAM,0BAA0B,CAAC;AAC/D,OAAO,EACL,0BAA0B,EAC1B,WAAW,GACZ,MAAM,wBAAwB,CAAC;AAChC,YAAY,EACV,qBAAqB,EACrB,sBAAsB,EACtB,oBAAoB,EACpB,qBAAqB,GACtB,MAAM,2BAA2B,CAAC;AACnC,YAAY,EACV,cAAc,EACd,kBAAkB,EAClB,gBAAgB,EAChB,gBAAgB,GACjB,MAAM,uBAAuB,CAAC;AAC/B,YAAY,EACV,eAAe,EACf,kBAAkB,EAClB,iBAAiB,EACjB,wBAAwB,EACxB,wBAAwB,GACzB,MAAM,wBAAwB,CAAC;AAChC,OAAO,EACL,kBAAkB,EAClB,uBAAuB,EACvB,uBAAuB,GACxB,MAAM,0BAA0B,CAAC;AAClC,YAAY,EACV,kBAAkB,EAClB,cAAc,EACd,qBAAqB,GACtB,MAAM,wBAAwB,CAAC;AAChC,OAAO,EAAE,eAAe,EAAE,MAAM,wBAAwB,CAAC;AACzD,YAAY,EAAE,aAAa,EAAE,MAAM,qBAAqB,CAAC;AACzD,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,OAAO,EAAE,wBAAwB,EAAE,MAAM,+BAA+B,CAAC;AACzE,YAAY,EACV,sBAAsB,EACtB,iBAAiB,EACjB,iBAAiB,EACjB,YAAY,GACb,MAAM,mBAAmB,CAAC;AAC3B,OAAO,EACL,aAAa,EACb,gBAAgB,EAChB,aAAa,EACb,iBAAiB,GAClB,MAAM,mBAAmB,CAAC"}
@@ -19,8 +19,8 @@ export { fillCopy } from "./fillCopy.js";
19
19
  export { pcaResult } from "./pcaResult.js";
20
20
  export { PROJECTION_COPY } from "./projectionCopy.js";
21
21
  export { mergeProjectionCopy } from "./mergeProjectionCopy.js";
22
- export { DEFAULT_PROJECTION_OPTIONS } from "./projectionOptions.js";
23
- export { resolveProjectionGroups } from "./projectionSamples.js";
22
+ export { DEFAULT_PROJECTION_OPTIONS, NO_GROUPING, } from "./projectionOptions.js";
23
+ export { projectionGrouping, resolveProjectionGroups, resolveProjectionShapes, } from "./projectionGroupings.js";
24
24
  export { PROJECTION_HELP } from "./projectionStrings.js";
25
25
  export { projectionTabs } from "./projectionTabs.js";
26
26
  export { resolveProjectionOptions } from "./resolveProjectionOptions.js";
@@ -1 +1 @@
1
- {"version":3,"file":"index.js","sourceRoot":"","sources":["../../../src/projection/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;GAaG;AAGH,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AAMvD,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AAMvD,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,OAAO,EAAE,QAAQ,EAAE,MAAM,eAAe,CAAC;AAGzC,OAAO,EAAE,SAAS,EAAE,MAAM,gBAAgB,CAAC;AAE3C,OAAO,EAAE,eAAe,EAAE,MAAM,qBAAqB,CAAC;AAQtD,OAAO,EAAE,mBAAmB,EAAE,MAAM,0BAA0B,CAAC;AAC/D,OAAO,EAAE,0BAA0B,EAAE,MAAM,wBAAwB,CAAC;AAkBpE,OAAO,EAAE,uBAAuB,EAAE,MAAM,wBAAwB,CAAC;AAMjE,OAAO,EAAE,eAAe,EAAE,MAAM,wBAAwB,CAAC;AAEzD,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,OAAO,EAAE,wBAAwB,EAAE,MAAM,+BAA+B,CAAC;AAOzE,OAAO,EACL,aAAa,EACb,gBAAgB,EAChB,aAAa,EACb,iBAAiB,GAClB,MAAM,mBAAmB,CAAC"}
1
+ {"version":3,"file":"index.js","sourceRoot":"","sources":["../../../src/projection/core/index.ts"],"names":[],"mappings":"AAAA;;;;;;;;;;;;;GAaG;AAGH,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AAMvD,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AAMvD,OAAO,EAAE,eAAe,EAAE,MAAM,sBAAsB,CAAC;AACvD,OAAO,EAAE,QAAQ,EAAE,MAAM,eAAe,CAAC;AAGzC,OAAO,EAAE,SAAS,EAAE,MAAM,gBAAgB,CAAC;AAE3C,OAAO,EAAE,eAAe,EAAE,MAAM,qBAAqB,CAAC;AAOtD,OAAO,EAAE,mBAAmB,EAAE,MAAM,0BAA0B,CAAC;AAC/D,OAAO,EACL,0BAA0B,EAC1B,WAAW,GACZ,MAAM,wBAAwB,CAAC;AAoBhC,OAAO,EACL,kBAAkB,EAClB,uBAAuB,EACvB,uBAAuB,GACxB,MAAM,0BAA0B,CAAC;AAMlC,OAAO,EAAE,eAAe,EAAE,MAAM,wBAAwB,CAAC;AAEzD,OAAO,EAAE,cAAc,EAAE,MAAM,qBAAqB,CAAC;AACrD,OAAO,EAAE,wBAAwB,EAAE,MAAM,+BAA+B,CAAC;AAOzE,OAAO,EACL,aAAa,EACb,gBAAgB,EAChB,aAAa,EACb,iBAAiB,GAClB,MAAM,mBAAmB,CAAC"}
@@ -66,6 +66,8 @@ export interface ProjectionCopy {
66
66
  projected: string;
67
67
  /** The title of a key whose colour stands for nothing, so only shape is left. */
68
68
  shapes: string;
69
+ /** What the shape stands for, after what the colour does. Carries `{shapes}`. */
70
+ shapedBy: string;
69
71
  };
70
72
  /** The sentences the viewer builds from the data. */
71
73
  sentence: {
@@ -1 +1 @@
1
- {"version":3,"file":"projectionCopy.d.ts","sourceRoot":"","sources":["../../../src/projection/core/projectionCopy.ts"],"names":[],"mappings":"AAAA,OAAO,KAAK,EAAE,kBAAkB,EAAE,MAAM,wBAAwB,CAAC;AACjE,OAAO,KAAK,EACV,qBAAqB,EACrB,sBAAsB,EACtB,oBAAoB,EACpB,qBAAqB,EACtB,MAAM,2BAA2B,CAAC;AAOnC,OAAO,KAAK,EACV,kBAAkB,EAClB,cAAc,EACf,MAAM,wBAAwB,CAAC;AAMhC,OAAO,KAAK,EAAE,aAAa,EAAE,MAAM,qBAAqB,CAAC;AAEzD,6CAA6C;AAC7C,MAAM,WAAW,cAAc;IAC7B,+BAA+B;IAC/B,GAAG,EAAE,MAAM,CAAC,aAAa,EAAE,MAAM,CAAC,CAAC;IACnC,uEAAuE;IACvE,QAAQ,EAAE,MAAM,CAAC,aAAa,EAAE,MAAM,CAAC,CAAC;IACxC,mDAAmD;IACnD,GAAG,EAAE,kBAAkB,CAAC;IACxB,yDAAyD;IACzD,KAAK,EAAE,oBAAoB,CAAC;IAC5B,wEAAwE;IACxE,MAAM,EAAE,qBAAqB,CAAC;IAC9B,oEAAoE;IACpE,MAAM,EAAE,qBAAqB,CAAC;IAC9B,gEAAgE;IAChE,OAAO,EAAE,sBAAsB,CAAC;IAChC,wDAAwD;IACxD,KAAK,EAAE;QACL,eAAe;QACf,GAAG,EAAE,MAAM,CAAC;QACZ,iBAAiB;QACjB,KAAK,EAAE,MAAM,CAAC;QACd,qBAAqB;QACrB,KAAK,EAAE,MAAM,CAAC;QACd;;;WAGG;QACH,mBAAmB,EAAE,MAAM,CAAC;QAC5B,kEAAkE;QAClE,cAAc,EAAE,MAAM,CAAC;QACvB,2EAA2E;QAC3E,eAAe,EAAE,MAAM,CAAC;QACxB,kDAAkD;QAClD,eAAe,EAAE,MAAM,CAAC;QACxB,sBAAsB;QACtB,MAAM,EAAE,MAAM,CAAC;KAChB,CAAC;IACF,gFAAgF;IAChF,MAAM,EAAE;QACN,oDAAoD;QACpD,GAAG,EAAE,MAAM,CAAC;QACZ,sDAAsD;QACtD,KAAK,EAAE,MAAM,CAAC;QACd,oDAAoD;QACpD,YAAY,EAAE,MAAM,CAAC;QACrB,yCAAyC;QACzC,KAAK,EAAE,MAAM,CAAC;QACd,qCAAqC;QACrC,eAAe,EAAE,MAAM,CAAC;QACxB,0BAA0B;QAC1B,gBAAgB,EAAE,MAAM,CAAC;QACzB,wCAAwC;QACxC,iBAAiB,EAAE,MAAM,CAAC;QAC1B,sDAAsD;QACtD,eAAe,EAAE,MAAM,CAAC;QACxB,sBAAsB;QACtB,MAAM,EAAE,MAAM,CAAC;QACf,oDAAoD;QACpD,WAAW,EAAE,MAAM,CAAC;QACpB,yEAAyE;QACzE,SAAS,EAAE,MAAM,CAAC;QAClB,iFAAiF;QACjF,MAAM,EAAE,MAAM,CAAC;KAChB,CAAC;IACF,qDAAqD;IACrD,QAAQ,EAAE;QACR,2BAA2B;QAC3B,WAAW,EAAE,MAAM,CAAC;QACpB,yCAAyC;QACzC,YAAY,EAAE,MAAM,CAAC;QACrB,yCAAyC;QACzC,cAAc,EAAE,MAAM,CAAC;QACvB,uCAAuC;QACvC,SAAS,EAAE,MAAM,CAAC;QAClB,6CAA6C;QAC7C,aAAa,EAAE,MAAM,CAAC;QACtB,oDAAoD;QACpD,YAAY,EAAE,MAAM,CAAC;QACrB,uCAAuC;QACvC,QAAQ,EAAE,MAAM,CAAC;QACjB,sCAAsC;QACtC,WAAW,EAAE,MAAM,CAAC;QACpB,yBAAyB;QACzB,aAAa,EAAE,MAAM,CAAC;QACtB,4EAA4E;QAC5E,SAAS,EAAE,MAAM,CAAC;QAClB,yEAAyE;QACzE,YAAY,EAAE,MAAM,CAAC;QACrB;;;WAGG;QACH,SAAS,EAAE,MAAM,CAAC;KACnB,CAAC;IACF,6BAA6B;IAC7B,MAAM,EAAE;QACN,mCAAmC;QACnC,eAAe,EAAE,MAAM,CAAC;QACxB,0BAA0B;QAC1B,SAAS,EAAE,MAAM,CAAC;QAClB,6BAA6B;QAC7B,cAAc,EAAE,MAAM,CAAC;QACvB,+CAA+C;QAC/C,QAAQ,EAAE,MAAM,CAAC;QACjB,uCAAuC;QACvC,OAAO,EAAE,MAAM,CAAC;KACjB,CAAC;IACF,4CAA4C;IAC5C,IAAI,EAAE,MAAM,CAAC,kBAAkB,EAAE,cAAc,CAAC,CAAC;IACjD,sDAAsD;IACtD,KAAK,EAAE;QACL,8BAA8B;QAC9B,MAAM,EAAE,MAAM,CAAC;QACf,iCAAiC;QACjC,OAAO,EAAE,MAAM,CAAC;QAChB,+BAA+B;QAC/B,SAAS,EAAE,MAAM,CAAC;QAClB,4BAA4B;QAC5B,UAAU,EAAE,MAAM,CAAC;QACnB,kEAAkE;QAClE,MAAM,EAAE,MAAM,CAAC;KAChB,CAAC;CACH;AAED;;;;;;;;;GASG;AACH,eAAO,MAAM,eAAe,EAAE,cAsF7B,CAAC"}
1
+ {"version":3,"file":"projectionCopy.d.ts","sourceRoot":"","sources":["../../../src/projection/core/projectionCopy.ts"],"names":[],"mappings":"AAAA,OAAO,KAAK,EAAE,kBAAkB,EAAE,MAAM,wBAAwB,CAAC;AACjE,OAAO,KAAK,EACV,qBAAqB,EACrB,sBAAsB,EACtB,oBAAoB,EACpB,qBAAqB,EACtB,MAAM,2BAA2B,CAAC;AAOnC,OAAO,KAAK,EACV,kBAAkB,EAClB,cAAc,EACf,MAAM,wBAAwB,CAAC;AAMhC,OAAO,KAAK,EAAE,aAAa,EAAE,MAAM,qBAAqB,CAAC;AAEzD,6CAA6C;AAC7C,MAAM,WAAW,cAAc;IAC7B,+BAA+B;IAC/B,GAAG,EAAE,MAAM,CAAC,aAAa,EAAE,MAAM,CAAC,CAAC;IACnC,uEAAuE;IACvE,QAAQ,EAAE,MAAM,CAAC,aAAa,EAAE,MAAM,CAAC,CAAC;IACxC,mDAAmD;IACnD,GAAG,EAAE,kBAAkB,CAAC;IACxB,yDAAyD;IACzD,KAAK,EAAE,oBAAoB,CAAC;IAC5B,wEAAwE;IACxE,MAAM,EAAE,qBAAqB,CAAC;IAC9B,oEAAoE;IACpE,MAAM,EAAE,qBAAqB,CAAC;IAC9B,gEAAgE;IAChE,OAAO,EAAE,sBAAsB,CAAC;IAChC,wDAAwD;IACxD,KAAK,EAAE;QACL,eAAe;QACf,GAAG,EAAE,MAAM,CAAC;QACZ,iBAAiB;QACjB,KAAK,EAAE,MAAM,CAAC;QACd,qBAAqB;QACrB,KAAK,EAAE,MAAM,CAAC;QACd;;;WAGG;QACH,mBAAmB,EAAE,MAAM,CAAC;QAC5B,kEAAkE;QAClE,cAAc,EAAE,MAAM,CAAC;QACvB,2EAA2E;QAC3E,eAAe,EAAE,MAAM,CAAC;QACxB,kDAAkD;QAClD,eAAe,EAAE,MAAM,CAAC;QACxB,sBAAsB;QACtB,MAAM,EAAE,MAAM,CAAC;KAChB,CAAC;IACF,gFAAgF;IAChF,MAAM,EAAE;QACN,oDAAoD;QACpD,GAAG,EAAE,MAAM,CAAC;QACZ,sDAAsD;QACtD,KAAK,EAAE,MAAM,CAAC;QACd,oDAAoD;QACpD,YAAY,EAAE,MAAM,CAAC;QACrB,yCAAyC;QACzC,KAAK,EAAE,MAAM,CAAC;QACd,qCAAqC;QACrC,eAAe,EAAE,MAAM,CAAC;QACxB,0BAA0B;QAC1B,gBAAgB,EAAE,MAAM,CAAC;QACzB,wCAAwC;QACxC,iBAAiB,EAAE,MAAM,CAAC;QAC1B,sDAAsD;QACtD,eAAe,EAAE,MAAM,CAAC;QACxB,sBAAsB;QACtB,MAAM,EAAE,MAAM,CAAC;QACf,oDAAoD;QACpD,WAAW,EAAE,MAAM,CAAC;QACpB,yEAAyE;QACzE,SAAS,EAAE,MAAM,CAAC;QAClB,iFAAiF;QACjF,MAAM,EAAE,MAAM,CAAC;QACf,iFAAiF;QACjF,QAAQ,EAAE,MAAM,CAAC;KAClB,CAAC;IACF,qDAAqD;IACrD,QAAQ,EAAE;QACR,2BAA2B;QAC3B,WAAW,EAAE,MAAM,CAAC;QACpB,yCAAyC;QACzC,YAAY,EAAE,MAAM,CAAC;QACrB,yCAAyC;QACzC,cAAc,EAAE,MAAM,CAAC;QACvB,uCAAuC;QACvC,SAAS,EAAE,MAAM,CAAC;QAClB,6CAA6C;QAC7C,aAAa,EAAE,MAAM,CAAC;QACtB,oDAAoD;QACpD,YAAY,EAAE,MAAM,CAAC;QACrB,uCAAuC;QACvC,QAAQ,EAAE,MAAM,CAAC;QACjB,sCAAsC;QACtC,WAAW,EAAE,MAAM,CAAC;QACpB,yBAAyB;QACzB,aAAa,EAAE,MAAM,CAAC;QACtB,4EAA4E;QAC5E,SAAS,EAAE,MAAM,CAAC;QAClB,yEAAyE;QACzE,YAAY,EAAE,MAAM,CAAC;QACrB;;;WAGG;QACH,SAAS,EAAE,MAAM,CAAC;KACnB,CAAC;IACF,6BAA6B;IAC7B,MAAM,EAAE;QACN,mCAAmC;QACnC,eAAe,EAAE,MAAM,CAAC;QACxB,0BAA0B;QAC1B,SAAS,EAAE,MAAM,CAAC;QAClB,6BAA6B;QAC7B,cAAc,EAAE,MAAM,CAAC;QACvB,+CAA+C;QAC/C,QAAQ,EAAE,MAAM,CAAC;QACjB,uCAAuC;QACvC,OAAO,EAAE,MAAM,CAAC;KACjB,CAAC;IACF,4CAA4C;IAC5C,IAAI,EAAE,MAAM,CAAC,kBAAkB,EAAE,cAAc,CAAC,CAAC;IACjD,sDAAsD;IACtD,KAAK,EAAE;QACL,8BAA8B;QAC9B,MAAM,EAAE,MAAM,CAAC;QACf,iCAAiC;QACjC,OAAO,EAAE,MAAM,CAAC;QAChB,+BAA+B;QAC/B,SAAS,EAAE,MAAM,CAAC;QAClB,4BAA4B;QAC5B,UAAU,EAAE,MAAM,CAAC;QACnB,kEAAkE;QAClE,MAAM,EAAE,MAAM,CAAC;KAChB,CAAC;CACH;AAED;;;;;;;;;GASG;AACH,eAAO,MAAM,eAAe,EAAE,cAuF7B,CAAC"}
@@ -47,6 +47,7 @@ export const PROJECTION_COPY = {
47
47
  notOutlined: 'Not outlined: too few samples.',
48
48
  projected: 'Hollow = added after the map was built',
49
49
  shapes: 'Shape = what each mark is.',
50
+ shapedBy: 'Shape = {shapes}.',
50
51
  },
51
52
  sentence: {
52
53
  sharesFirst: 'Component 1 accounts for {percent} of the differences between your samples.',
@@ -1 +1 @@
1
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@@ -0,0 +1,44 @@
1
+ /**
2
+ * How the groupings a page hands in become what a figure draws: the one that
3
+ * colours the dots, painted from the shared palette, and the one that shapes
4
+ * them, given one shape per group.
5
+ *
6
+ * Both are cut the same way — the page's own order first, then every group in
7
+ * the order its first row names it — so a group keeps its colour and its shape
8
+ * however the rows are filtered.
9
+ */
10
+ import type { ProjectionGrouping, ProjectionSamples, ResolvedProjectionGroups, ResolvedProjectionShapes } from './projectionSamples.ts';
11
+ /**
12
+ * The grouping a set of samples is coloured by, in a shape a legend and a plot
13
+ * can both read.
14
+ *
15
+ * A group named in `order` but held by no row is kept, so a legend does not
16
+ * reshuffle when a filter empties one; a row naming a group that is not in
17
+ * `order` is appended in the order it appears.
18
+ * @param grouping - The grouping, or nothing when the dots are not coloured.
19
+ * @param count - How many rows there are, which is the score matrix's height.
20
+ * @returns The resolved groups. No grouping gives no entries at all, and every
21
+ * row lands at `-1`.
22
+ */
23
+ export declare function resolveProjectionGroups(grouping: ProjectionGrouping | undefined, count: number): ResolvedProjectionGroups;
24
+ /**
25
+ * The grouping a set of samples is shaped by, one shape per group.
26
+ *
27
+ * A grouping of more groups than there are shapes is refused as a whole rather
28
+ * than drawn with two groups sharing a shape, or with the last ones falling
29
+ * back to a disc: either would put two groups under one mark, which is the one
30
+ * thing a key cannot undo.
31
+ * @param grouping - The grouping, or nothing when the dots are not shaped.
32
+ * @param count - How many rows there are, which is the score matrix's height.
33
+ * @returns The resolved shapes, or `null` when there is no grouping or its
34
+ * groups outnumber the shapes.
35
+ */
36
+ export declare function resolveProjectionShapes(grouping: ProjectionGrouping | undefined, count: number): ResolvedProjectionShapes | null;
37
+ /**
38
+ * The grouping carrying an id.
39
+ * @param samples - Who the rows are.
40
+ * @param id - The id asked for.
41
+ * @returns The grouping, or `undefined` when none carries it.
42
+ */
43
+ export declare function projectionGrouping(samples: ProjectionSamples, id: string): ProjectionGrouping | undefined;
44
+ //# sourceMappingURL=projectionGroupings.d.ts.map
@@ -0,0 +1 @@
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