File 1 : H:\instruments-archive\XRD-current\Austin\MCTeCO\ML_McNulty_20240116_4_AMF-RbCTeCO_T7_dried+Si_std_2hr_last_check.raw
Range Number :  1

R-Values 

Rexp : 1.09    Rwp : 1.79     Rp  : 1.29   GOF : 1.65
Rexp`: 6.97    Rwp`: 11.47    Rp` : 14.55  DW  : 0.83

Quantitative Analysis - Rietveld 
   Phase 1  : Structure                      92.65(18) %
   Phase 2  : Structure                      7.35(18) %

Background 
   Chebychev polynomial, Coefficient  0      7896(4)
                                      1      -3607(7)
                                      2      609(6)
                                      3      206(6)
                                      4      126(6)
                                      5      -431(6)
                                      6      329(6)
                                      7      -67(5)
                                      8      -87(5)
                                      9      58(5)
                                      10     6(5)

Instrument 
   Primary radius (mm)                       200.5
   Secondary radius (mm)                     200.5
   Linear PSD 2Th angular range (°)          3
      FDS angle (°)                          0.6

Corrections 
   Specimen displacement                     0.121(6)
   LP Factor                                 0

Miscellaneous 
   Convolution Steps                         3
   Start X                                   12
   Finish X                                  60

Structure 1 
   Phase name                                Structure
   R-Bragg                                   0.514
   Spacegroup                                C2/c
   Scale                                       0.000189(3)
   Cell Mass                                 2467(3)
   Cell Volume (Ã…^3)                         757.30(4)
   Wt% - Rietveld                            92.65(18)
   Double-Voigt|Approach 
      Cry size Lorentzian                    84.2(19)
      k:  1  LVol-IB (nm)                    54(2)
      k:  0.89  LVol-FWHM (nm)               75(3)
   Strain 
      Strain L                               0.048(8)
      e0                                     0.00010(11)
   Crystal Linear Absorption Coeff. (1/cm)   1217.43(8)
   Crystal Density (g/cm^3)                  5.410(7)
   Preferred Orientation Spherical Harmonics 
      Order                                  4
      y00                                    1
      y20                                    -0.334(18)
      y22m                                   -0.91(3)
      y22p                                   0.111(5)
      y40                                    -0.069(13)
      y42m                                   0.006(15)
      y42p                                   0.058(5)
      y44m                                   -0.108(8)
      y44p                                   -0.492(17)
   Lattice parameters
      a (Ã…)                                  12.6727(4)
      b (Ã…)                                  5.20635(18)
      c (Ã…)                                  11.6213(4)
      beta  (°)                              99.008(3)

Site  Np    x           y           z         Atom Occ       Beq  
Co1    8   0.2715(5)  0.3112(16)  0.1497(6)   Co   0.955(9)  1.4(3)
Te1    4   0.50000    0.6534(7)   0.25000     Te   1.000(7)  0.88(18)
Te2    8   0.3622(2)  0.3082(5)   0.4442(3)   Te   0.990(8)  1.29(15)
O1     8   0.4169(17) 0.453(5)    0.159(2)    O    0.92(2)   2.0(9)
O2     8   0.3756(18) 0.601(4)    0.360(2)    O    1.00(3)   1.0(8)
O3     8   0.2925(16) 0.148(5)    0.320(2)    O    0.97(3)   1.0(8)
O4     8   0.254(2)   0.437(4)    0.470(2)    O    0.99(2)   2.0(9)


Structure 2 
   Phase name                                Structure
   R-Bragg                                   0.496
   Spacegroup                                Fd-3m
   Scale                                       0.000779(17)
   Cell Mass                                 224.684
   Cell Volume (Ã…^3)                         160.14989
   Wt% - Rietveld                            7.35(18)
   Double-Voigt|Approach 
      Cry size Gaussian                      310(50)
      k:  1  LVol-IB (nm)                    290(60)
      k:  0.89  LVol-FWHM (nm)               270(50)
   Crystal Linear Absorption Coeff. (1/cm)   148.024
   Crystal Density (g/cm^3)                  2.330
   Preferred Orientation Spherical Harmonics 
      Order                                  4
      k00                                    1
      k41                                    -1.17(7)
   Lattice parameters
      a (Ã…)                                  5.4305300

Site  Np    x           y           z         Atom Occ       Beq  
Si1    8   0.00000    0.00000     0.00000     Si   1         0.54