# Differences

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 k-factor [2021/03/31 07:32]rowlesmr3 added link in description. k-factor [2021/03/31 07:34]rowlesmr3 Both sides previous revision Previous revision 2021/03/31 07:35 rowlesmr3 2021/03/31 07:34 rowlesmr3 2021/03/31 07:33 rowlesmr3 fixed comment characters2021/03/31 07:32 rowlesmr3 added link in description.2020/07/16 11:29 external edit2016/07/05 11:00 martin_fisch 2016/07/05 10:59 martin_fisch 2016/07/05 10:58 martin_fisch 2016/07/05 10:56 martin_fisch 2016/07/05 10:55 martin_fisch created Next revision Previous revision 2021/03/31 07:35 rowlesmr3 2021/03/31 07:34 rowlesmr3 2021/03/31 07:33 rowlesmr3 fixed comment characters2021/03/31 07:32 rowlesmr3 added link in description.2020/07/16 11:29 external edit2016/07/05 11:00 martin_fisch 2016/07/05 10:59 martin_fisch 2016/07/05 10:58 martin_fisch 2016/07/05 10:56 martin_fisch 2016/07/05 10:55 martin_fisch created Last revision Both sides next revision Line 13: Line 13: '​-------------------------------------------------------- '​-------------------------------------------------------- ' K Factor calculation from external standard starts here ' K Factor calculation from external standard starts here - ' ​O'​Connor ​& Raven, Powder Diffraction 3(1) (1988) 2-6 + ' ​OConnor ​& Raven, Powder Diffraction 3(1) (1988) 2-6 '​-------------------------------------------------------- '​-------------------------------------------------------- - xdd "​External_Standard_Corundum.xy"​ 'XRD Pattern of external standard + xdd "​External_Standard_Corundum.xy"​ 'XRD Pattern of external standard' rebin_with_dx_of 0.02 rebin_with_dx_of 0.02 Line 26: Line 26: start_X 20 start_X 20 - str '​Többens,​ D.M. et al., Mat. Sci. Forum 378 (2001) 288-293 + str '​Többens,​ D.M. et al., Mat. Sci. Forum 378 (2001) 288-293' phase_name "​Corundum"​ phase_name "​Corundum"​ a a_Corundum ​ 4.76 min 4.74 max 4.78 a a_Corundum ​ 4.76 min 4.74 max 4.78 Line 50: Line 50: prm Corundum_Lac = Get(mixture_MAC) Get(mixture_density_g_on_cm3);:​ 0 prm Corundum_Lac = Get(mixture_MAC) Get(mixture_density_g_on_cm3);:​ 0 - '​Calculation of K-Factor from external standard + '​Calculation of K-Factor from external standard' prm !KFactor = Scale_Corundum * ( 1.660538921 * (Mass_Corundum/​Volume_Corundum) ) * Volume_Corundum^2 * MAC_Corundum ​ / (Crystallinity_Corundum) ;: 0 prm !KFactor = Scale_Corundum * ( 1.660538921 * (Mass_Corundum/​Volume_Corundum) ) * Volume_Corundum^2 * MAC_Corundum ​ / (Crystallinity_Corundum) ;: 0 - 'Macro for wt.-% from scale, MAC, cell volume and KFactor + 'Macro for wt.-% from scale, MAC, cell volume and KFactor' macro wt_percent_K_MAC(result) { prm = ( ( Get(scale) * ( 1.660538921 * (Get(cell_mass)/​Get(cell_volume)) ) * (Get(cell_volume))^2) * MAC_Sample ) / KFactor ;: result } macro wt_percent_K_MAC(result) { prm = ( ( Get(scale) * ( 1.660538921 * (Get(cell_mass)/​Get(cell_volume)) ) * (Get(cell_volume))^2) * MAC_Sample ) / KFactor ;: result } - 'Dummy phases are used for energy dependent oxide MAC calculation + 'Dummy phases are used for energy dependent oxide MAC calculation' macro d_str { dummy_str space_group P1 scale 0 a 1 b 1 c 1 site } macro d_str { dummy_str space_group P1 scale 0 a 1 b 1 c 1 site } d_str Si occ Si+4 = 1; site O  occ O-2  = 2; prm MAC_SiO2 ​   = Get(phase_MAC);​ :  35.81264 d_str Si occ Si+4 = 1; site O  occ O-2  = 2; prm MAC_SiO2 ​   = Get(phase_MAC);​ :  35.81264 Line 80: Line 80: '​----------------------------------------------------------------------------- '​----------------------------------------------------------------------------- - xdd "​Sample_Pattern.xy"​ 'XRD Pattern of sample + xdd "​Sample_Pattern.xy"​ 'XRD Pattern of sample' rebin_with_dx_of 0.02 rebin_with_dx_of 0.02 Line 88: Line 88: Specimen_Displacement(@,​ 0) Specimen_Displacement(@,​ 0) - 'XRF wt.-% data of sample (change prm_with_error to prm for version 5) + 'XRF wt.-% data of sample (change prm_with_error to prm for version 5)' prm_with_error !SiO2     0_0 prm_with_error !SiO2     0_0 prm_with_error !Al2O3 ​   0_0 prm_with_error !Al2O3 ​   0_0 Line 104: Line 104: prm_with_error !ZrSiO4 ​  0_0 prm_with_error !ZrSiO4 ​  0_0 prm_with_error !LaB6     0_0 prm_with_error !LaB6     0_0 - prm_with_error !LOI_CO2 ​ 0_0 'Loss on ignition + prm_with_error !LOI_CO2 ​ 0_0 'Loss on ignition' - prm_with_error !LOI_H2O ​ 0_0 'Loss on ignition + prm_with_error !LOI_H2O ​ 0_0 'Loss on ignition' - 'MAC calculation from XRF data + 'MAC calculation from XRF data' prm !MAC_Sample = prm !MAC_Sample = SiO2*0.01*MAC_SiO2 + Al2O3*0.01*MAC_Al2O3 + SiO2*0.01*MAC_SiO2 + Al2O3*0.01*MAC_Al2O3 + Line 135: Line 135: ​ Strain_L ​ Strain_L ​ scale ​ scale - ​ wt_percent_K_MAC( 0) 'This macro reports phase amounts using the K-factor method + ​ wt_percent_K_MAC( 0) 'This macro reports phase amounts using the K-factor method' - for xdds { '​Instrument description for both XDD's + for xdds { '​Instrument description for both XDDs' lam ymin_on_ymax 0.0001 lam ymin_on_ymax 0.0001 Lam_recs Lam_recs