BUCHI NIRCal - Manual (Page 148)

NIRCal 5.5 Software Manual
148 NIRCal 5.5 Manual, Version A
Row Name Description
56 Method Selected calculation method / algorithm
57 Max Iterations Calculation steps before default stop (max. 3000)
58 Mean Centering Mean centering after pretreatment is activated: yes / no
59 Number of Primary PCs Number of selected primary principal components
60 Secondary/Calibration
PCs Numbers of selected secondary principal components
62 Blow Up Parameter Title
63 Residual Blow Up Factor for residual limit calculation (default: 2)
64 Score Blow Up Factor for score limit calculation (default: 1.05)
65 Radii Blow Up Factor for radii limit calculation (default: 1)
66 Radii Formula Formula for radii calculation: 1 / 2 (SIMCA: 3)
68 Max C-Set Spectra
Residual Highest value of the C-Set residuals
69 Max Allowed Residual
for Calibration Residual limit of the calibration for the application (max.* 2)
72
Q-Value Q-Value of the calibration
73 Validation Method Selected Validation method: only Validation Set
75 C-Set false identified Should be zero (indicates wrong user settings)
76 C-Set not identified Should be zero (indicates wrong user settings)
77 V-Set false identified Should be zero (indicates wrong sample or calibration)
78 V-Set not identified Should be zero (residual or distance problem)
79 Cluster Index (No. Cluster- No. Property): should be zero
80 Property Uniformity Should be small: the spectra spreading in the clusters is uniform
81 Property Interference Should be small: the clusters are independent from each other