AXES 1.9A List of all commands and their availability in version B. Name Characteristics Version B Pattern Data Import/Export Imp denotes that import is available. Exp denotes that export is available. 1. AXES Binary (Imp/Exp); * 2. Diffrac-AT 1 & 3 (Imp/Exp); 3. PEAK 91 (Exp); 4. DBWS+WYRIET 2/3 (Imp/Exp); 5. RIETAN (Imp/Exp); 6. XRS 82 (Imp/Exp); * 7. Allmann DIFFRAC (Imp/Exp); 8. ICDD *.REF (Imp/Exp); * 9. ICDD *.PD3 (Imp/Exp); * 10. SCANPI (Imp); 11. Y only (e.g. FULLPROF *.BAC) (Imp/Exp); * 12. X-Y pairs (e.g. WYRIET *.CAL) (Imp/Exp); * 13. DiffracINEL (Imp); 14. HUBER G600 v5.13 (Imp); 15. Synchrotron SRS (Imp); 16. PROFIT (Exp); 17. FULLPROF *.DAT (Imp/Exp); * 18. FULLPROF *.PRF (Imp/Exp); * 19. Guinier Tbingen 1 (Imp); 20. Guinier Tbingen 2 (Imp); 21. GSAS standard type (Imp/Exp); 22. DIFFaX data (Imp); 23. Philips data *.RD (Imp/Exp); 24. Seifert ASCII data (Imp); 25. EXTRA ASCII data (Imp/Exp); 26. STOE Binary data (Imp); Peak Data Import/Export 1. AXES Binary (Imp/Exp); * 2. AXES ASCII (Imp/Exp); * 3. DIFFRAC 1&3 (Imp/Exp); 4. PEAK 91 (Imp); 5. ITO (Exp); 6. TREOR (Imp/Exp); * 7. DICVOL (Exp); 8. LSUCRE (Imp/Exp); * 9. Grapher (Exp); 10. ICDD *.RED (Exp); 11. Allmann LATCO (Imp/Exp); 12. Lazy-Pulverix (Imp); 13. XLAT (Exp); 14. PowderCell *.d_i (Imp); * 15. PowderCell *.2éi (Imp); * Max Number of Points per Pattern: 15500 (200 000 for Version L) 8000 Max Number of Peaks per Pattern <= 300 300 Structure Data Import/Export 1. ICSD *.txt (Imp/Exp); 2. FULLPROF *.pcr (Imp/Exp); * 3. LazyPulverix *.inp (Exp); 4. PrecPlot *.inp (Exp); 5. Schakal *.inp (Exp); 6. MOLDRAW *.mol (Imp/Exp); 7. PowderCell *.inp (Imp/Exp); * 8. GSAS *.exp (Imp); Graphical User Interface (GUI) Full set of commands for a graphical work with a pattern (Zoom In/Out, Insert/Delete, Save ASCII for GRAPHER) * Print Graphics External: 1. Grapher; * 2. WordPerfect Presentation Pattern Preprocessing 1. Smoothing; * 2. Strip background and Kà2; * 3. Detect peaks; * 4. Print preprocessing parameters; * 5. Accept peaks; * 6. Accept all * Manual Background Detection Interpolation by a cubic spline; * Commands: Mark, Subtract, Import, Export * Compare Patterns Up to 16 Peak or Pattern arrays: 4 Import, Scale, Shift, Sum, Difference, * Export Sum & Difference; * Exchange the Peak and Pattern data; * FingerPrint HPGL output; PatternPrint HPGL output; Peak Fitting up to 178 free parameters; Eight peak shape functions: * Gaussian; Asymmetric basic- intermediate- and modified Lorentzian; Pearson VII type with split- and common exponents; pseudo-Voigtian; asymmetric pseudo-Voigtian; Three background models: * polynomial (up to 3 order); Toraya; modified Toraya; individual peak fitting; * whole pattern fitting, 150 peaks; Pattern Simulation Internal: all peak/pattern models from peak fitting dialog; External: 1. LAZY-PULVERIX 2. PowderCell * Pattern Manipulation Edit, Scale, Compress, Scissors, Merge Peak Editor Edit/Delete/Insert parameters of up to 300 peaks * 2 Calibration Peak and pattern shift on the bases of a measured SRM data; internal database includes data of 11 SRM's. Intensity Calibration Calculation of Instrument Sensitivity Correction Function (ISCF) and applying it for correction of measured intensities; internal database includes data of 11 SRM's. Phase Analysis (Search/Match) Internal: Search/Match using peak data and full PDF-2 database; Selectors by: elements, subfiles, max missed peaks, min matched peaks, 6 preselected entries in the database; Parameters: d relative error, 2 error, max 2 offset, miss level, 5 figure of merit weights. Databases External: 1. ICDD PDF-2; 2. ICSD RETRIEVE; Indexing External: 1. ITO; 2. TREOR; * 3. DICVOL; Lattice Refinement External: 1. LSUCRE; * 2. LATCO; 3. XLAT; Unit Cell Parameters Commands: Edit, * Lattice type, * Systematic extinctions, * Reflection generation (all systems, up to 2500 reflections) * Structure Data Editor Edit and prepare parameters and codewords of a FULLPROF (ver 3.3, Aug97) *.PCR file * Crystallite Size/Strain 1. Voight analysis + Williamson-Hall plot; * 2. Cylindrical and spherical shape models * 3. Fourier analysis + Warren-Averbach approximation; Structure Refinement External: 1. WYRIET; 2. FULLPROF; * 3. GSAS; * Structure Visualization External: 1. SCHAKAL; 2. ATOM87; 3. MOLDRAW; 4. ORTEP; 5. ORTEX; 6. PowderCell * List of External Programs Linked with AXES 1. User_NET-shell; 2. User_Measurement; 3. User_TextEditor; * 4. GRAPHER, PLOT; 5. WordPerfect, DrawPerfect; * 6. WP-Presentation; * 7. PEAK; 8. ITO; 9. TREOR; * 10. DICVOL; 11. LSUCRE; * 12. LATCO; 13. XLAT; 14. PowderCell; * 15. PROFIT; 16. LAZY-PULVERIX; 17. PC-PDF; 18. RETRIEVE; 19. GSAS; 20. FULLPROF; * 21. WYRIET; 22. PrecPlot; 23. NewMod; 24. DIFFaX Other programs called by axes 1. PERTABLE; * 2. MOLDCONV; Online Help Context sensitive Help for most of commands, buttons and parameters * Other Commands 1. DOS shell; * 2. Print/Save/Retrieve Parameters; 3. Save/Retrieve State; * 4. Edit Sample/Diffr./Measurement parameters; * 5. Change directory; * 6. Calculator; * 7. Hardware par.: printer/mouse/ screen/graphics; * 8. Reset all *