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SingleCrystal software

SingleCrystal - releases history

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Version Change log
SingleCrystal 5.0.0 Jan 5, 2024
SingleCrystal 4.1.9 Jul 27, 2022
SingleCrystal 4.1.8 Jun 21, 2022
SingleCrystal 4.1.7 Mar 3, 2022
SingleCrystal 4.1.6 Dec 8, 2021
SingleCrystal 4.1.5 Nov 1, 2021
SingleCrystal 4.1.2 Mar 4, 2021 Expanded Structures Library. 10 new crystal structures have been added to the library, bringing the total close to 1200. The new structures correspond to the minerals: Alabandite, Coloradoite, Daubreelite, Ferrihydrite, Mackinawite, Polydymite, Pseudorutile, Trevorite, Tungstenite, Vysotskite.
Miscellaneous Changes. This version includes miscellaneous enhancements and fixes:
Improved licensing agreement viewer (as accessed via the Licence button in the "About" window. This no longer requires users to explicitly "agree" or "disagree" when merely reviewing the content.
This version includes additional stability improvements and integrity checks to ensure safe operation.
SingleCrystal 4.1.1 Jan 19, 2021 Expanded Structures Library. 35 new crystal structures have been added to the library. These correspond to the minerals: Akimotoite, Annite, Arcanite, Arsenolite, Augelite, Avicennite, Baddeleyite, Bityite, Brewsterite, Bromellite, Brownmillerite, Cattierite, Chlorapatite, Claudetite, Edingtonite, Ferrierite, Gamma-Fe2SiO4, Garronite, Gonnardite, Hafnon, Heazelwoodite, Hydroxyapatite, Karelianite, Kirschsteinite, Liebenbergite, Loellingite, Matlockite, Montroydite, Neighborite, Otavite, Smythite, Thenardite, Vaesite, Violarite and Whitlockite.
The old "Apatite" structure has been replaced by a newer, Fluorapatite structure. The non-mineral CaAl12O19 structure has been removed, as it corresponds to the mineral "Hibonite", which is already present in the library.
Miscellaneous Changes. This version includes updated documentation and Preferences Panel.
Improved "About" window now displays the licensed software edition (e.g., Student, Education, Standard or Demo).
SingleCrystal 4.0.2 Jun 3, 2020 Kikuchi ThresholdA new slider control permits the setting of a minimum "threshold", below which weaker Kikuchi Lines are hiddenThis greatly speeds the resulting display, especially at low magnification when lines from widely-ranging zone axes may be visible.
Extended Crystals LibraryAn additional 23 crystal structures have been added, including the minerals AwaruiteLorenzenite, Mesolite, Proustite, Pyrargyrite, Pyrophanite, Pyroxferroite, Romanechite, Roscoelite, Scolecite, Sinhalite, Tennantite, Tenorite, Thomsonite, Thorite and Tincalconite; plus 4 superconductors: Bi2Sr2Ca2Cu3O10, HgBa2Ca2Cu3O8, HgBa2CaCu2O6 and Tl2Ba2Ca2Cu3O10.
Miscellaneous ChangesThis version includes an improved Preferences panel, better "fast" Kikuchi Line display, plus miscellaneous bug fixes.
Adding symmetry-related poles to the stereogram now results in the colours and other attributes of the original poles being applied to the new, symmetry-related poles.
SingleCrystal 4.0.1 Mar 30, 2020 Crystal Structures Library. This version now includes an integrated library of over 1,000 crystal structures (including over 500 mineral species) ready for instant diffraction simulation. The structures can be browsed using the File > Add to Window > Crystal from Library command, or the Add popup in the window toolbar.
Structures can be browsed by folder, or in a flat view. They can be sorted by name, chemical formula, space group, density or unit cell volume. A search command lets you find structures by name, notes (embedded metadata) or chemical formula.
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