File name: Pandora159s1_Wakkerstroom_20210527_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T030441.0Z 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_20210527_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: 20210527 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 20210527T050524.8Z 7817.212093 181 1 48.01 2 85.55 63.19 85.46 246.58 0.00 1 0.00 1 0 33 9.543e-01 1.088e-01 5.614e-01 8.204e-02 9.430944e-01 4.851895e-02 9.334850e-03 -6.000000e+00 5.532746e-01 224.82 -2.00 3.06 -2.00 321.92 0.00e+00 3.031408e-02 1.904659e-02 1.509029e-02 -6.000000e+00 3.215178e-02 278.21 -2.00 20.00 -2.00 321.40 0.00e+00 10.744 0.007 302.00 328.00 3 1.0883e+00 1.6381e-01 1.5378e-01 -6.0000e+00 1.3756e+00 2.1313e+00 1.8518e-01 1.7065e-01 -6.0000e+00 1.5060e+00 -2.0729e+00 1.0749e-01 2.6402e-02 -6.0000e+00 8.8569e-01 7.0749e-01 6.1060e-02 3.6765e-02 -6.0000e+00 3.7990e-01 7.1049e-06 9.7095e-04 2.2419e-03 1.9951e-04 -6.0000e+00 2.6989e-02 6.6610e-03 12 8 8 10 0 0 78.31 18.40 1.75 0.00666 0.01396 12 3 4 8 0 4000.000 15.04 18.40 5.45 20.87 20.87 15.7 823.75 -2632 900000 19372 -6069 29256 900000 22545 144982 900000 900000 900000 472970 900000 -74388 900000 -53874 10029 -22965 900000 900000 74914 18164 900000 900000 -19686 900000 -74957 900000 25697 900000 -42847 900000 24852 108531 122023 -89862 -88428 108523 900000 -26156 900000 -45416 900000 307578 245776 900000 174633 450004 -3383 25965 -33731 247911 -18998 -26461 114306 298178 34392 1349 -42868 -43928 57421 57287 51933 -29954 81307 14073 39830 900000 126252 10212 70842 -3138 -45844 228414 12287 -17473 -9565 175673 -38459 110029 5347 103155 -12486 18363 13505 -354 3037 2727 90347 -9952 39683 -6979 24632 -15542 36548 4394 62605 -19090 15279 4118 19607 17870 -3373 -11056 10618 14400 -5401 7750 -9360 -1519 -6388 -6672 -1939 -1995 3258 3114 15555 -3557 -3337 -10090 7396 -3199 5926 -9792 5317 -2355 2948 16172 -932 3912 -2927 6252 -2707 8313 -6625 7080 -4378 -337 -1295 2589 -2451 1353 420 -306 900000 1871 -639 2331 900000 1796 11551 900000 900000 900000 37681 900000 -11061 900000 -9818 1065 -3510 900000 900000 5968 1447 900000 900000 -1568 900000 -7821 900000 2047 900000 -5077 900000 2039 8647 9721 -17809 -17362 8646 900000 -3452 900000 -7572 900000 24504 19581 900000 13913 35851 -450 2737 -6918 19751 -3816 -5874 9107 23755 3788 191 -8774 -8840 4575 5026 5553 -8106 7762 2550 5595 900000 10058 2430 9796 -885 -18404 18197 2178 -3667 -1779 13996 -12283 10024 1601 13488 -5424 6141 4941 -154 1322 1202 16665 -4611 10529 -2751 7079 -7178 12024 2381 22979 -18052 11308 3370 12696 10307 -2130 -7499 6200 8553 -4120 5710 -9270 -1624 -8149 -9206 -2601 -2638 3934 3702 16779 -4891 -4833 -15869 9402 -4263 6934 -12974 5938 -2756 3235 17202 -1389 6489 -5854 12395 -6266 18564 -18342 17892 -12516 -937 -3589 6543 -5983 2938 895 SS 20210527T052004.1Z 7817.222270 184 1 49.45 2 82.68 61.35 88.29 245.04 0.00 1 0.00 1 0 25 5.042e-01 1.037e-02 3.036e-01 5.105e-03 7.298684e-01 2.882307e-03 6.959445e-03 -6.000000e+00 2.862046e-01 224.82 -2.00 3.06 -2.00 321.85 0.00e+00 4.862338e-03 1.580722e-03 2.444042e-03 -6.000000e+00 1.431690e-02 278.21 -2.00 20.00 -2.00 321.37 0.00e+00 7.268 0.002 302.00 328.00 3 9.4555e-01 1.0596e-02 7.0138e-02 -6.0000e+00 7.0997e-01 1.2283e-01 1.6218e-02 4.3381e-02 -6.0000e+00 7.7613e-01 -1.5828e-01 1.8120e-02 1.9877e-02 -6.0000e+00 4.5924e-01 5.5081e-02 8.3197e-03 8.0311e-03 -6.0000e+00 1.9747e-01 2.7994e-04 -1.1234e-03 1.5080e-04 8.0533e-05 -6.0000e+00 1.3976e-02 6.9083e-03 12 8 8 10 0 0 55.10 18.46 0.33 0.00691 -0.00153 124 27 4 8 0 398.710 15.04 18.46 6.74 20.96 20.87 16.0 832.44 900000 -185039 900000 -83489 -137983 -150810 -179143 900000 -230381 900000 -253537 900000 -193125 900000 -148412 900000 -46841 24870 25265 71758 -1093 -43212 57427 -55766 41328 -62930 900000 -25530 48845 -47235 2066 -11862 -14070 5041 -10264 15111 -43873 -10798 -22788 19116 -2900 14713 12804 11538 10345 12897 23704 3526 5139 -6675 11111 -4872 7141 189 4602 3800 1554 5717 3383 4055 3178 7779 63 10433 770 11413 955 6285 2085 4268 2661 1922 158 -254 3618 -1719 1517 -3121 4165 -1061 1795 -3026 -77 -2146 -1188 80 -1814 -370 -664 1167 93 126 -244 2173 -996 2080 1394 -214 -664 -1189 -187 -819 1913 -551 -1528 -2405 -447 -1310 -166 -186 -469 -536 -259 361 166 1786 837 959 -694 -532 -1046 788 -98 -5 986 285 2476 771 517 -440 329 277 158 199 -17 -463 -205 82 -353 -192 47 300 -163 900000 -1087 900000 -415 -686 -750 -1052 900000 -2915 900000 -4697 900000 -3054 900000 -2616 900000 -423 124 137 357 -8 -508 285 -857 261 -1194 900000 -335 309 -875 29 -236 -337 107 -246 280 -1626 -346 -1019 674 -144 665 625 589 547 688 1178 226 346 -552 869 -464 669 21 515 449 193 677 398 467 384 1005 10 1733 150 1976 183 1198 466 1080 754 571 47 -71 883 -397 320 -716 1020 -330 642 -1305 -36 -1073 -629 45 -1082 -223 -400 664 50 64 -120 1098 -593 1410 1112 -200 -682 -1229 -178 -700 1448 -431 -1300 -2185 -421 -1340 -186 -238 -671 -818 -398 534 233 2378 1137 1367 -1067 -845 -1642 1161 -140 -6 1303 366 3017 1008 778 -764 627 564 340 457 -41 -1211 -546 221 -951 -496 112 673 -355 SS 20210527T052622.7Z 7817.226652 187 1 50.48 2 81.45 60.53 89.50 244.35 0.00 1 0.00 1 0 25 3.840e-01 7.688e-03 1.698e-01 2.675e-03 6.553089e-01 1.411667e-03 6.350939e-03 -6.000000e+00 2.154436e-01 224.82 -2.00 3.06 -2.00 321.36 0.00e+00 4.495060e-03 6.937121e-04 2.184910e-03 -6.000000e+00 9.481585e-03 278.21 -2.00 20.00 -2.00 320.85 0.00e+00 6.354 0.002 302.00 328.00 3 6.9583e-01 4.7656e-03 6.1260e-02 -6.0000e+00 5.3256e-01 8.1491e-02 6.8099e-03 3.7085e-02 -6.0000e+00 5.8050e-01 -8.1943e-02 7.3734e-03 1.6458e-02 -6.0000e+00 3.4565e-01 2.0902e-02 3.4977e-03 7.7036e-03 -6.0000e+00 1.4698e-01 7.7374e-04 -9.4390e-04 7.4979e-05 6.1908e-05 -6.0000e+00 1.0261e-02 6.3890e-03 11 8 0 10 0 0 13.89 18.48 0.32 0.00639 -0.00070 224 48 2 8 0 220.400 15.00 18.48 7.60 20.96 20.96 16.2 838.08 -184009 35536 -159549 -54813 -115053 -106688 -162467 -148886 -43895 -139250 -81299 -137495 -1767 -75833 -15911 -46110 -30994 -37206 -28539 -17745 -16714 -11236 -25236 -2720 -30103 -2877 -38897 -12643 -30886 7201 -13138 4415 -2900 -3658 7824 -3294 6992 -1846 1782 -3440 1288 2932 1821 -728 -891 465 1586 2918 1523 8424 1976 5081 2664 4442 850 5833 180 1609 160 622 3579 1732 3283 1419 1942 1036 2644 867 3539 166 1271 -30 -958 1072 -1651 -38 -2109 1231 -444 899 -921 -221 -2603 -677 -1060 -1297 -364 -1003 471 -77 1564 -718 1369 604 1072 -77 1064 473 -387 -471 -31 188 455 719 -2209 -830 228 -568 -543 -305 -653 -455 176 348 950 965 1111 202 -89 -1268 -707 -209 55 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