How To ... ?

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                   HOW TO... 	                  HOW TO...
                                  HOW TO...
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HOW TO CREATE ....
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.... INPUT FILES FOR A NEW COMPOUND ?     - tutorial 07Handouts_D_E_PhaseDiagram_vs2.pdf
                                                     00howto_quickly_create_input_files
                                          - programs cif2mcphas, makenn
                                                     setup_jqfit, setup_mcphasjforfit
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HOW TO CALCULATE ...
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.... CRYSTAL FIELD PARAMETERS             - tutorial 03crystal_fields_singleion
                                          - examples Gd3GaO6
                                          - manual   chapter programs for specific
                                                     tasks ... pointc
                                          - programs pointc, mpe (editor of sipf files)
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.... CRYSTAL FIELD SPECTRA ?              - tutorial 03crystal_fields_singleion
                                          - examples PrNi2B2C, NdCu2
                                          - manual   chapters singleion
                                          - programs single1ion, convolute, gauss,ic1ion, 
                                                     display, pointc
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.... NEUTRON DIFFRACTION PATTERN ?        - tutorial 07Handouts_D_E_PhaseDiagram_vs2.pdf
                                                     04magnetic_phases_mcphas
                                          - examples NdBa2Cu3O7, NdCu2b_new
                                          - manual   chapter mcdiff
                                          - programs mcdiff, convolute, gauss,lorentz
                                                     [mcphas,spins]
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.... MAGNETIC PHASE DIAGRAMS ?            - tutorial 04magnetic_phases_mcphas
                                          - examples NdCu2*
                                          - manual   chapter mcphas
                                          - programs mcphas, displaycontour
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.... SUSCEPTIBILITY AND MAGNETIZATION ?   - tutorial 03crystal_fields_singleion
                                                     04magnetic_phases_mcphas
                                          - examples PrNi2B2C, NdCU2 
                                          - manual   chapter mcphas
                                          - programs singleion, mcphas, display
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.... SPECIFIC HEAT ?                      - tutorial 03crystal_fields_singleion
                                                     04magnetic_phases_mcphas
                                          - examples PrNi2B2C, NdCu2
                                          - manual   chapter mcphas
                                          - programs cpsingleion, mcphas, dif
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HOW TO DISPLAY ....
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.... SIMPLE XY GRAPHS ?                   - tutorial 01some_programs
                                          - manual   chapter Programs f. graph. display
                                          - programs display
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.... MAGNETIC STRUCTURE ?                 - tutorial 04magnetic_phases_mcphas
                                          - examples NdCu2
                                          - manual   chapter Programs f. graph. display
                                          - programs display_density,display_densities,javaview
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.... CHARGE DENSITIES ?                   - tutorial 03crystal_fields_singleion
                                          - examples NdCu2, PrNi2Si2, PrNi2B2C,testic1ion
                                          - manual   chapter Programs f. graph. display
                                          - programs display_density,display_densities,javaview
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.... SPIN AND ORBITAL WAVES ?             - tutorial 05excitations_mcdisp
                                          - examples NdCu2, PrNi2Si2 
                                          - manual   chapter Programs f. graph. display
                                          - programs display_density,display_densities,javaview

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HOW TO FIT ...
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.... DIFFRACTION DATA ?                   - tutorial 02fitting
                                          - examples NdBa2Cu3O7
                                          - manual   chapters  on fitting and on mcdiff
                                          - programs mcdiff, simannfit, display,
                                                     displaytext, rpvalue, chi2,
                                                     substitute, factcol, ...
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.... INTERACTION PARAMETERS ?             - tutorial 02fitting
                                          - examples CeCu2a, PrNi2B2C
                                          - manual   chapter Searchspace and Simannfit
                                          - programs simannfit, searchspace, singleion
                                                     mcphas, mcdisp, mcdiff ...
                                                     substitute, factcol, addcol, ... 
                                                     display, displaytext, ... 
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.... CRYSTAL FIELD SPECTRA ?             - tutorial 02fitting
                                                     06fitting_crystal_field_spectra
                                          - examples PrNi2B2C
                                          - manual   chapters on singleion and on fitting
                                          - programs simannfit, searchspace, 
                                                     singleion, pointc
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.... SPIN WAVE DISPERSION ?               - tutorial 02fitting
                                          - examples CeCu2a
                                          - manual   chapter mcphas, mcdiff,fitting
                                          - programs simannfit, searchspace, 
                                                     mcphas, mcdisp, 
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HOW TO TREAT/INCLUDE ...
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.... RARE EARTH IONS ?
                                          - examples NdCu2, any rare earth based 
                                          - manual   chapter singleion
                                          - programs singlein, so1ion
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.... TRANSITION METAL and ACTINIDE IONS
                                          - examples testic1ion
                                          - manual   chapter  ic1ion
                                          - programs singleion, ic1ion
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.... BIQUADRATIC/QUADRUPOLAR ORBITAL INTERACTIONS ? 
                                          - examples GdRu2Si2, DyCu2
                                          - manual   chapter Including Quadrupolar and 
                                                     Higher Order Interactions
                                          - programs mcphas, mcdisp
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Martin Rotter 2017-01-10