File name: Pandora159s1_Wakkerstroom_20210411_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T025751.8Z 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_20210411_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: 20210411 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 20210411T043322.0Z 7771.189838 17 1 48.02 2 86.65 78.76 76.98 82.16 0.00 1 0.00 1 0 33 1.047e+00 2.134e-01 6.308e-01 1.398e-01 7.854533e-01 8.582133e-02 8.020342e-03 -6.000000e+00 6.715154e-01 226.27 -2.00 3.06 -2.00 321.21 0.00e+00 -2.355877e-02 2.067830e-02 1.465067e-02 -6.000000e+00 4.066096e-02 280.82 -2.00 20.00 -2.00 320.57 0.00e+00 12.844 0.013 302.00 328.00 3 7.0447e-01 2.7240e-01 1.6902e-01 -6.0000e+00 1.6691e+00 1.8491e+00 3.0840e-01 1.7495e-01 -6.0000e+00 1.8507e+00 -2.1479e+00 1.5337e-01 1.6230e-02 -6.0000e+00 1.0806e+00 7.6658e-01 9.7437e-02 5.0089e-02 -6.0000e+00 4.5586e-01 3.4317e-06 3.5723e-03 4.7038e-03 2.9611e-04 -6.0000e+00 3.2716e-02 1.3014e-02 12 8 8 10 0 0 -10.62 19.32 1.69 0.01301 0.03986 12 3 4 8 0 4000.000 14.99 19.32 11.56 21.58 21.48 16.1 859.11 164576 900000 93952 -67963 900000 307917 900000 900000 98310 900000 900000 900000 87134 900000 258734 285030 900000 900000 -34197 900000 196926 900000 900000 45814 9863 900000 900000 -93885 28 -75793 900000 900000 900000 -51071 900000 900000 900000 -41893 900000 40644 4453 900000 3212 900000 29685 238347 47365 900000 900000 900000 62191 155246 900000 -2515 900000 900000 900000 -33849 142256 -9687 105247 900000 900000 900000 70495 -6670 144615 303451 -12709 231092 -733 432667 -22901 900000 7726 900000 51399 198565 65963 66487 900000 40319 345817 -17026 43999 74187 75536 -4818 23831 -40284 115749 -1096 -33371 113350 23724 61509 -53439 2500 3018 15482 -21038 15863 36208 18079 29873 21862 -61069 12875 17133 -22572 32110 -3123 12917 2721 20604 25450 48851 -3459 1466 28942 15107 17750 -7149 1675 -4507 8690 -12748 51636 21101 28168 -2345 6085 -6809 -11048 -1200 -2091 1951 -7315 5895 -5158 2835 -334 8359 22237 900000 12694 -32414 900000 41604 900000 900000 13283 900000 900000 900000 11773 900000 34959 38512 900000 900000 -9893 900000 26608 900000 900000 6190 1922 900000 900000 -34818 4 -19043 900000 900000 900000 -11106 900000 900000 900000 -9271 900000 5492 901 900000 608 900000 4011 32204 6400 900000 900000 900000 8403 20976 900000 -493 900000 900000 900000 -9348 19221 -1753 14220 900000 900000 900000 9525 -1366 19540 41001 -3273 31224 -202 58460 -7535 900000 1514 900000 6945 26829 8913 8983 900000 8756 46725 -7451 11293 14966 15568 -2189 7984 -23807 15639 -394 -16519 15315 8420 17468 -53315 1648 2098 9347 -16772 7980 14088 8791 14071 11747 -78388 8754 12615 -27987 26171 -3810 13627 3099 18912 21915 34439 -4302 1846 28634 16685 18413 -9234 1946 -5433 8942 -16073 38323 24432 34746 -4299 11017 -14969 -27448 -2907 -5383 4932 -20593 14354 -13364 6351 -725 16602 SS 20210411T044210.7Z 7771.195957 21 1 49.38 2 84.73 77.72 75.10 81.07 0.00 1 0.00 1 0 17 5.673e-01 3.267e-02 4.214e-01 1.424e-02 9.125466e-01 8.523440e-03 8.622849e-03 -6.000000e+00 3.321517e-01 226.27 -2.00 3.06 -2.00 322.39 0.00e+00 1.458154e-02 5.312774e-03 1.372721e-02 -6.000000e+00 1.687149e-02 280.82 -2.00 20.00 -2.00 321.95 0.00e+00 9.490 0.005 302.00 328.00 3 2.8757e-01 3.5229e-02 1.3167e-01 -6.0000e+00 8.2825e-01 9.0802e-01 5.1653e-02 1.4551e-01 -6.0000e+00 9.0984e-01 -1.1213e+00 5.1414e-02 4.3836e-02 -6.0000e+00 5.3226e-01 4.3797e-01 2.3059e-02 1.5772e-02 -6.0000e+00 2.2194e-01 6.8941e-05 -2.6032e-03 4.0141e-04 1.0852e-04 -6.0000e+00 1.6073e-02 1.3263e-02 12 9 8 11 8 0 35.88 19.31 0.61 0.01326 -0.00630 68 15 4 8 0 726.060 15.00 19.31 12.51 21.58 21.48 16.2 864.99 -108817 -77951 -162212 900000 -118332 900000 -196135 900000 -234064 900000 -108995 -117317 900000 -158902 900000 9554 900000 -94337 4953 17368 900000 -99776 900000 -20051 -47015 900000 900000 86853 -99142 900000 5929 900000 -16476 900000 -41881 900000 -31407 116632 105202 16621 154201 -10536 30659 59310 172323 27414 53456 4233 157214 20113 88387 39773 27878 64083 47760 21550 -8779 9209 49566 8069 2367 28928 688 15747 31034 15975 36227 8173 8103 12717 8722 9313 27583 10177 18071 8097 12323 -4498 8340 7423 5149 5981 -865 -1190 -1812 4084 -3979 973 -1721 1452 -335 3943 -2834 -3795 606 -771 -1985 -3286 -2011 -2168 -821 -1938 1321 -3192 -4950 -2639 85444 -1275 -3178 -1887 -2887 -1878 -2632 -163 -957 1955 277 -15 -487 1057 -314 1263 997 387 2581 126 3282 -703 366 669 433 962 494 1271 -170 72 -24 -35 -1061 1328 -672 -644 -1507 -1506 -1079 -3063 900000 -1638 900000 -3608 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9.547866e-03 280.82 -2.00 20.00 -2.00 320.96 0.00e+00 6.585 0.002 302.00 328.00 3 1.5561e-01 4.1812e-03 6.4595e-02 -6.0000e+00 5.3457e-01 5.5704e-02 6.0933e-03 4.0964e-02 -6.0000e+00 5.8199e-01 -4.2169e-02 6.6314e-03 1.7623e-02 -6.0000e+00 3.4668e-01 6.4320e-03 3.0990e-03 7.7116e-03 -6.0000e+00 1.4717e-01 1.0753e-03 -9.8786e-04 6.1341e-05 6.5929e-05 -6.0000e+00 1.0233e-02 1.2509e-02 10 0 0 10 0 0 -9.79 19.30 0.29 0.01251 0.00509 330 71 2 8 0 149.700 14.99 19.30 14.04 21.58 21.48 16.2 873.56 -164940 -151903 -121485 -153683 -87352 -87041 -129659 -114834 -132877 -93377 -102742 -89800 -59099 -45109 -60473 -43069 31801 -33447 -31441 -30088 -23753 -17390 -32254 -25175 -18950 -22074 -18950 -9877 -12695 -23586 -9490 -2685 -5547 -10215 -6641 -10278 -3698 -7452 -243 -2311 857 -2804 209 -1748 1358 539 2640 699 3520 4004 3639 2135 3313 4404 411 1450 1139 -818 856 487 1985 128 1537 1129 1378 1582 1348 2264 1697 693 657 -224 -517 -220 -397 -118 -568 194 567 -605 -580 -1052 -1601 -679 -1308 -874 -260 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