![]() ![]() CrystalDiffract now tries harder to infer site occupancy information from files which omit the (important!) site occupancy symbol data. ![]() We now respect the original symbols.įixed an issue reading from legacy session files. Improved crystal editor: it is now possible to toggle the "On" setting for all selected rows simply by clicking a single checkbox.įixed a rare issue with CIF import in which non-standard element symbols (e.g., "Va") were replaced with standard equivalents (e.g., "V"). Increased the maximum TEM voltage from 1000 to 9000 keV. This version includes an improved crystal editor, higher TEM voltages, plus miscellaneous fixes and enhancements.Īuto-open Patterns List when importing a multi-structure file. As a result, zooming in to high magnifications should reveal smooth, continuous profiles, without abrupt steps. Thanks to the faster peak-profile generation, we are now able to simulate extremely-wide peak "tails" for Lorentzian and Pseudo-Voigt peak profiles. CrystalDiffract now uses multi threading to dramatically speed the process of profile calculation. The Check for Update command is now available when running in "Demo Mode".įaster Profile Generation. (This corrects a potential - although very-rare - issue in which the program could become bogged down drawing excessive numbers of tickmarks when the minimum and maximum values were almost equal.)įixed a crash when clicking on the Recent Files button and the list is empty.įixed an issue showing the version in the About dialog. Improvements to the diffraction graph's y-axis scaling for very small values. Similarly, the Structure Factors data file uses "I(Integrated)" in place of "Intensity". For example, the integrated intensity column in the Reflexions list is now labelled as "I(int)". To avoid potential confusion between peak intensity (height) and integrated intensity (area), various "Intensity" labels have been renamed. This version includes miscellaneous fixes and enhancements.ĬMTX files containing numeric site labels (or labels whose first character begins with a numeral) can now be imported safely. A complex dataset analysis applicationĬrystalDiffract helps you analyze and run various simulations on sampled mineral data, in order to determine all its chemical, physical, optical and structural properties.Miscellaneous Changes. In addition, you can easily monitor each simulation, as the application offers you extensive control over several aspects of your experiment, such as wavelength, peak shapes, zero correction and strain broadening.ĬrystalDiffract offers you the possibility to customize the display of imported or simulated data patterns, so that you can have a clearer view of your analysis.īesides, you can process your observed data, by applying offsets and relative intensity scaling or by removing any background noises, thus smoothing data. You can use the program to import multiple experimental datasets, then compare them with your simulated data, in order to find out certain particularities of each crystal or mineral. Furthermore, you can simulate certain phase transformations by on-the-fly editing any current properties. The application helps you analyze X-ray or neutron powder diffraction patterns, in order to accurately determine the chemical and physical properties of a sampled mineral. The program allows you to import various X-ray and neutron powder diffraction test results, then analyze them or perform simulations on the saved data samples. In order to analyze them, you need a powerful and reliable software application that can run simulations on your result data, in order to accurately determine the chemical and physical properties of a mineral or crystal.ĬrystalDiffract helps you do just that. The most common tests performed are X-ray crystallography and neutron powder diffraction, since they provide you with precise information about a mineral's qualities. Mineralogy is a scientific branch of geology that is specialized in the scientific study of crystal structure, chemical and physical properties of minerals. ![]()
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