File name: Pandora159s1_Wakkerstroom_20210804_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031850.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210804_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20210804 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 77: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 79: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 80: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20210804T050449.1Z 7886.211679 104 1 48.01 2 85.34 67.93 56.52 24.14 0.00 1 0.00 1 0 17 9.364e-01 3.195e-01 6.093e-01 2.507e-01 8.681910e-01 1.377908e-01 9.550021e-03 -6.000000e+00 5.520549e-01 226.04 -2.00 3.06 -2.00 317.07 0.00e+00 2.885940e-02 1.661609e-02 3.569661e-04 -6.000000e+00 2.694959e-02 276.68 -2.00 20.00 -2.00 316.42 0.00e+00 10.393 0.007 302.00 328.00 3 1.8141e+00 3.4500e-01 9.3772e-02 -6.0000e+00 1.3750e+00 3.0002e+00 3.9226e-01 5.4007e-02 -6.0000e+00 1.5087e+00 -1.9766e+00 2.2422e-01 1.6741e-02 -6.0000e+00 8.8782e-01 5.0524e-01 1.0696e-01 1.5424e-02 -6.0000e+00 3.7608e-01 2.7780e-06 8.9790e-03 6.0477e-03 1.6223e-04 -6.0000e+00 2.6600e-02 5.0859e-03 12 8 8 10 0 0 -56.19 18.41 3.28 0.00509 0.07256 12 3 4 8 0 4000.000 14.99 18.41 7.65 20.87 20.87 16.2 833.25 151766 900000 900000 18330 284008 -28500 900000 -17152 900000 900000 58196 -55133 31374 118608 900000 57965 -34412 121019 900000 119688 900000 214757 75539 76363 -12205 900000 -54438 62472 94595 121747 35217 9392 -2628 -82665 900000 900000 -7520 30863 900000 278 85996 900000 -17445 58479 -35882 900000 138301 900000 19917 32765 46380 43380 172731 -13043 2929 108345 453852 84798 58908 -58952 45610 202958 30104 157870 -40600 87942 394900 2905 122080 -1556 -4533 331877 24635 40261 900000 -28626 -11160 77005 56568 258901 -14252 -34609 66559 73205 -29848 -43231 49203 6779 34265 53637 75139 15153 24825 61567 9661 -2207 15622 24862 23620 26625 541 23479 -30579 11893 1244 -45255 -15597 26819 -164 9768 -8493 8552 40655 16241 -16700 28682 -15936 59128 -11552 29865 14152 26646 -18652 11957 15367 15180 -25292 70844 3924 -20879 -6737 4653 -14419 7725 5402 -13365 19398 23273 17565 -25338 6997 12025 23608 36977 900000 900000 9995 69197 -15796 900000 -6336 900000 900000 14179 -28057 9515 28898 900000 23500 -35419 29486 900000 29161 900000 52324 18405 18605 -4653 900000 -26362 15221 23048 29663 11184 4346 -1417 -87385 900000 900000 -3268 9951 900000 132 20952 900000 -9899 15935 -23850 900000 33696 900000 8241 12510 16580 16589 42085 -8668 1596 26398 110579 20660 14353 -43212 13047 49450 12450 38464 -35022 21427 96215 1614 29744 -1056 -3194 80860 11367 14051 900000 -14813 -4795 18762 16552 63080 -10826 -34638 26343 27808 -31105 -52393 24948 5043 18756 22616 23562 7902 11794 22674 6788 -2039 14029 22836 22663 23468 542 16437 -33099 8797 1070 -63049 -17244 21554 -192 11783 -13346 11779 40469 19572 -26214 28775 -25237 47889 -19151 32827 17085 26854 -27876 12871 15472 14760 -36640 46136 5667 -43309 -13270 8739 -34554 16003 12075 -36716 39082 45388 35142 -71558 13384 20522 36166 SS 20210804T052037.2Z 7886.222652 107 1 50.13 2 82.11 65.97 55.25 20.18 0.00 1 0.00 1 0 25 5.124e-01 3.203e-02 3.788e-01 1.432e-02 7.399725e-01 8.088784e-03 9.555243e-03 -6.000000e+00 2.940682e-01 226.04 -2.00 3.06 -2.00 321.85 0.00e+00 1.681876e-02 4.299283e-03 8.977928e-03 -6.000000e+00 1.528077e-02 276.68 -2.00 20.00 -2.00 321.39 0.00e+00 6.817 0.002 302.00 328.00 3 2.6816e+00 2.8930e-02 7.2465e-02 -6.0000e+00 7.3052e-01 3.5936e-01 4.0553e-02 4.8515e-02 -6.0000e+00 7.9835e-01 -4.6417e-01 4.2689e-02 3.2905e-02 -6.0000e+00 4.7189e-01 1.7817e-01 2.0083e-02 1.5867e-02 -6.0000e+00 2.0079e-01 6.2494e-05 -9.1072e-04 4.1538e-04 3.1249e-04 -6.0000e+00 1.4299e-02 4.6185e-03 12 8 8 10 0 0 49.03 18.41 0.61 0.00462 -0.00223 30 6 4 8 0 1670.760 14.99 18.41 8.45 20.87 20.87 16.3 839.23 -202898 900000 -35490 900000 -254335 900000 157767 -160091 900000 -146577 900000 -189019 900000 -56727 900000 -89223 5848 900000 -19721 -17530 -91948 -58187 -116110 -34763 -29507 900000 12159 900000 -96338 -47547 14993 -31513 -24168 -26610 24432 -52444 -52520 -56231 152018 -9971 91940 1007 46913 26011 97170 -27936 7803 6120 -11523 29515 15379 35673 11250 35065 15847 14067 -3141 -6317 13348 10435 17416 -5941 5304 16644 17094 16636 15755 3194 28072 -699 12095 5453 4687 12091 -2355 1360 7278 143 -5493 11698 577 1488 -2126 -273 4973 -960 1204 -2101 5419 -4628 5638 -3800 1621 144 1153 -4563 4598 -1113 30 -1941 -2631 -654 -196 3223 -1174 631 -23552 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5.207e-01 2.068e-02 3.326e-01 6.458e-03 6.990843e-01 3.503549e-03 6.928645e-03 -6.000000e+00 2.935948e-01 226.04 -2.00 3.06 -2.00 321.57 0.00e+00 7.534159e-03 1.758096e-03 5.590381e-03 -6.000000e+00 1.324471e-02 276.68 -2.00 20.00 -2.00 321.09 0.00e+00 5.949 0.001 302.00 328.00 3 2.3383e+00 1.2082e-02 6.8375e-02 -6.0000e+00 7.2923e-01 1.3925e-01 1.7512e-02 5.9296e-02 -6.0000e+00 7.9469e-01 -1.8238e-01 1.9246e-02 1.9231e-02 -6.0000e+00 4.7135e-01 6.0169e-02 9.0443e-03 1.0320e-02 -6.0000e+00 1.9987e-01 1.8914e-04 -1.4575e-03 1.8250e-04 6.9757e-05 -6.0000e+00 1.3937e-02 4.5662e-03 12 8 8 10 0 0 49.34 18.41 0.41 0.00457 -0.00639 62 13 4 8 0 795.260 15.00 18.41 9.04 20.87 20.87 16.4 842.02 -81040 -123973 -164533 -144876 -171664 -47224 -248350 -190586 -220002 900000 -18276 -117687 -127686 14017 31051 -44908 18397 87939 226993 -53632 -1688 -61286 -4756 -23034 -29359 31397 -14198 21951 -36775 68606 -25910 56581 -20198 10556 -22044 5645 12907 17365 30002 20240 -1128 4318 15679 4630 -1837 -2243 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