Uncategorized – WinXAS

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Change log v4.0.3 (7/13/23)
- QoL and naming changes to “time-resolved” menu and “automatic analysis” dialog box
- added dialog for defining range and procedure of energy calibration to “create multi column file”
- optimized procedure for “multiple FEFF files” XAFS refinement

Change log v4.0.2b (6/16/23)
- re-enabled save R-range to options
- “Run FEFF”/RasMol takes path from last XAFS simulation

Change log v4.0.2 (5/26/23)
- fixed “Run FEFF” compatibility with latest RasMol
- clarified use of “Run FEFF” and added “Load Files.Dat” option
- moved “Write FEFF “Files.dat”” to XAFS menu
- added option to “Write FEFF “Files.dat”” to save parameters from simulation to create custom Files.dat

Change log v4.0.1 (5/19/23)
- optimized calculation of confidence limits and F-test
- fixed calculation of confidence limits and F-test for certain parameters and correlations
- adjusted automated R range for XAFS fits
- changed default for individual Eo in XAFS fits to “correlated”
- table with single-scattering paths in Results window always shows structural parameters
- changed options for calculating DW factor of MS paths
- added description for DW polynomial fit to Results