File name: Pandora159s1_Wakkerstroom_20201227_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T023512.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes 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_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20201227_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: 20201227 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 20201227T033524.0Z 7666.149583 109 1 48.01 2 84.70 113.54 125.24 275.07 0.00 1 0.00 1 0 41 7.519e-01 1.832e-01 5.544e-01 1.503e-01 8.835602e-01 8.714743e-02 8.909866e-03 -6.000000e+00 4.609227e-01 227.78 -2.00 3.06 -2.00 320.17 0.00e+00 1.622162e-02 1.755737e-02 5.159599e-04 -6.000000e+00 2.403958e-02 281.76 -2.00 20.00 -2.00 319.38 0.00e+00 9.439 0.005 302.00 328.00 3 2.5036e+00 2.4558e-01 8.6990e-02 -6.0000e+00 1.1663e+00 2.3466e+00 2.8552e-01 4.8360e-02 -6.0000e+00 1.2920e+00 -1.9184e+00 1.5698e-01 1.8434e-02 -6.0000e+00 7.4984e-01 6.3654e-01 7.9752e-02 1.3042e-02 -6.0000e+00 3.1083e-01 3.7710e-06 4.4641e-03 4.0640e-03 2.4435e-04 -6.0000e+00 2.2454e-02 7.3684e-03 12 8 8 10 0 0 -107.45 19.37 3.69 0.00737 0.04091 12 3 4 8 0 4000.000 14.99 19.37 21.46 21.58 21.58 14.2 919.62 109347 900000 -21904 900000 900000 63761 13715 156071 900000 12880 -10075 900000 900000 -26441 900000 -9471 900000 900000 900000 12166 235894 900000 70709 94001 -33352 900000 -58718 176855 -88433 900000 3600 159017 900000 900000 900000 900000 900000 -43642 183335 295814 900000 -42471 900000 95579 900000 -26563 56079 900000 900000 26526 -6146 900000 -33826 900000 88887 61847 26850 59290 222708 119477 76601 63031 137813 51445 -49767 -21960 900000 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4165 21386 11292 20334 -3868 10835 3690 21236 -25555 7496 -1278 13223 4468 19260 -7685 16842 8312 -24784 28753 -38696 27748 -5332 39105 14963 -1846 -22493 25828 -19795 -5290 12500 5014 15616 -1451 9503 -42552 12894 -12073 4729 9371 36138 -9835 24561 1293 -24961 8066 -15761 9357 -15835 4982 -8011 11020 22796 6265 -14369 -1751 6808 SS 20201227T034937.9Z 7666.159466 112 1 49.80 2 81.79 112.05 128.28 273.69 0.00 1 0.00 1 0 17 4.228e-01 2.432e-02 3.205e-01 1.263e-02 7.443149e-01 7.315774e-03 8.001555e-03 -6.000000e+00 2.448346e-01 227.78 -2.00 3.06 -2.00 321.76 0.00e+00 2.917141e-02 3.904760e-03 3.748471e-03 -6.000000e+00 1.286336e-02 281.76 -2.00 20.00 -2.00 321.25 0.00e+00 6.580 0.002 302.00 328.00 3 2.7323e+00 2.6615e-02 8.0533e-02 -6.0000e+00 6.0911e-01 5.5621e-01 3.7443e-02 8.2614e-02 -6.0000e+00 6.6481e-01 -6.0229e-01 3.7515e-02 2.1661e-02 -6.0000e+00 3.9562e-01 2.2668e-01 1.7454e-02 3.2784e-02 -6.0000e+00 1.7033e-01 6.2647e-05 -3.1589e-03 3.6143e-04 2.8108e-04 -6.0000e+00 1.1716e-02 6.7470e-03 12 8 8 10 0 0 44.53 19.37 0.55 0.00675 -0.01699 27 6 4 8 0 1843.880 15.00 19.37 22.14 21.58 21.58 14.2 923.47 900000 900000 -216576 900000 -116303 900000 -80694 -61311 -194902 60694 900000 -203763 900000 900000 29720 -81858 -40877 900000 900000 900000 59637 900000 900000 -46220 20914 900000 -50779 -18361 -98070 900000 -7242 52283 66367 43948 29843 -26830 40601 -6592 62262 -36211 47511 40572 18112 -29392 -3694 4717 21469 56722 177 13854 19402 58994 21265 41113 5723 12379 -8041 24374 -860 -2052 -3230 -1450 11867 -2878 19781 50 15912 -1737 17051 10102 26927 7042 1344 -1361 5217 -73 8345 6839 -429 2628 -2383 7965 -4564 1490 -7413 1820 -2901 -2313 -4122 -18 1590 -2462 4268 -4269 849 -3598 -1511 -80 7 -2241 -636 -1520 315 -540 -4217 -2056 17608 -1192 -2955 379 -2488 -519 -1456 894 258 1725 277 -1497 574 -466 1808 406 -254 -228 1351 368 2330 2459 330 -1230 438 772 -701 1707 -723 641 592 439 -1576 306 -748 -62 -789 900000 900000 -7837 900000 -1428 900000 -991 -753 -3838 745 900000 -4890 900000 900000 365 -2159 -854 900000 900000 900000 732 900000 900000 -1087 257 900000 -1156 -311 -3865 900000 -183 940 1223 1077 792 -1172 971 -277 1551 -2613 1667 1622 965 -2621 -271 340 1395 2800 16 1168 1709 3942 2206 3753 752 1522 -1187 2574 -112 -272 -462 -230 1922 -619 3668 11 2996 -398 3558 2571 6356 2070 409 -395 1291 -17 1686 1453 -113 813 -915 3159 -2234 723 -4134 984 -1727 -1410 -2556 -10 847 -1271 1985 -2244 481 -2519 -1221 -74 7 -2363 -622 -1338 245 -417 -3609 -1824 13682 -1193 -3323 468 -3531 -773 -2216 1291 357 2274 374 -2156 860 -733 2738 598 -361 -313 1770 473 2845 3125 488 -2109 821 1541 -1491 3768 -1733 1592 1500 1129 -4130 759 -1760 -135 -1667 SS 20201227T035605.8Z 7666.163956 115 1 49.55 2 80.45 111.39 129.66 273.06 0.00 1 0.00 1 0 25 4.313e-01 1.046e-02 2.281e-01 5.471e-03 6.486263e-01 2.946514e-03 6.350513e-03 -6.000000e+00 2.462196e-01 227.78 -2.00 3.06 -2.00 321.39 0.00e+00 1.051134e-02 1.453932e-03 1.812078e-03 -6.000000e+00 1.082527e-02 281.76 -2.00 20.00 -2.00 320.83 0.00e+00 5.756 0.001 302.00 328.00 3 2.4195e+00 1.0174e-02 5.8399e-02 -6.0000e+00 6.1318e-01 1.2019e-01 1.3983e-02 4.0581e-02 -6.0000e+00 6.6698e-01 -1.8576e-01 1.4203e-02 1.7067e-02 -6.0000e+00 3.9529e-01 7.0797e-02 6.7534e-03 1.3728e-02 -6.0000e+00 1.6692e-01 2.1528e-04 -1.1037e-03 1.5609e-04 1.1047e-04 -6.0000e+00 1.1714e-02 6.2579e-03 12 8 8 10 0 0 81.23 19.36 0.39 0.00626 -0.00204 61 13 4 8 0 812.100 15.00 19.36 22.52 21.58 21.58 14.2 925.81 -205859 -146832 -181142 -68377 -163324 -112286 -166821 900000 -162951 -9498 -132605 -15370 -62525 -75286 -76646 -71751 25634 -40281 50407 -16311 -17181 -23464 -37573 -60254 17108 -26376 -44107 -24041 -35752 13174 -16565 4942 -7340 1302 5148 -8110 -11945 629 -3552 -2850 -226 -4079 4800 524 8610 3881 10109 -2335 13032 10255 8936 6118 9155 5158 4866 7351 -2820 3329 -889 1110 2645 3370 4955 2398 -742 4921 3839 1827 2430 2607 2660 2185 1044 789 -225 40 705 -2819 -168 -1084 365 -1228 -3483 -1035 -1206 -1064 -401 120 -427 133 9 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