File name: Pandora159s1_Wakkerstroom_20210524_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T030352.8Z 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_20210524_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: 20210524 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 20210524T050439.1Z 7814.211564 135 1 46.25 2 85.37 63.69 126.40 234.41 0.00 1 0.00 1 0 25 7.045e-01 7.477e-02 5.502e-01 6.263e-02 9.483427e-01 3.864529e-02 9.630460e-03 -6.000000e+00 4.133116e-01 224.85 -2.00 3.06 -2.00 322.08 0.00e+00 2.136197e-04 1.550567e-02 2.566771e-03 -6.000000e+00 1.956537e-02 278.35 -2.00 20.00 -2.00 321.58 0.00e+00 10.436 0.007 302.00 328.00 3 1.1150e+00 1.2971e-01 9.4590e-02 -6.0000e+00 1.0339e+00 1.9275e+00 1.5217e-01 4.3061e-02 -6.0000e+00 1.1399e+00 -2.0527e+00 9.2382e-02 2.1724e-02 -6.0000e+00 6.6463e-01 7.3553e-01 5.1096e-02 6.9088e-03 -6.0000e+00 2.8297e-01 1.0359e-05 -3.4189e-03 1.8066e-03 1.2233e-04 -6.0000e+00 2.0781e-02 7.4832e-03 12 9 9 12 9 1 75.81 18.42 1.35 0.00748 -0.01821 13 3 4 8 0 3291.250 14.99 18.42 5.85 20.87 20.87 15.9 826.26 -8358 223412 38292 67019 900000 20141 29928 -99924 900000 -14170 -1436 219765 900000 900000 900000 91090 900000 247022 -10662 900000 900000 47011 -25113 900000 -10867 -13232 95042 900000 900000 900000 900000 -52476 900000 74815 900000 900000 900000 -17469 900000 900000 84318 39348 80845 900000 -5559 900000 -33188 -65372 25296 900000 -6001 900000 47300 900000 228011 126252 153783 90175 900000 -47279 140367 10092 177085 102059 154998 7201 167335 900000 123533 121460 21126 105873 -14871 96546 22477 109925 -47614 77024 150269 23188 -15935 31742 -2767 -13141 -1581 11819 17188 -5945 12756 13368 24652 -8135 18925 -4963 -3775 521 7135 -4380 -6503 11043 -3593 10720 -18528 7178 -20872 1193 -5510 5712 4246 -10156 734 -6576 13370 4014 10868 -6764 2320 -6143 5526 -1767 -3391 4731 -283 3166 -1576 9623 -12792 10331 4162 3247 3598 -1762 1749 -2213 -2806 516 4464 -3158 -598 -2555 4440 -3469 3589 -1035 13568 2884 4070 900000 1223 1818 -16200 900000 -966 -87 13346 900000 900000 900000 5532 900000 15002 -1318 900000 900000 2855 -2665 900000 -1031 -1244 5772 900000 900000 900000 900000 -7657 900000 4544 900000 900000 900000 -1874 900000 900000 5121 3511 4910 900000 -691 900000 -5119 -13988 2308 900000 -853 900000 4673 900000 13847 7667 9339 6168 900000 -10546 8525 1344 10754 7049 9413 1316 10162 900000 8204 9339 4669 10401 -4563 9069 3817 6942 -13040 6461 9126 4554 -5411 7795 -1050 -5812 -657 4515 6439 -2831 4970 4946 7595 -3259 5752 -2036 -1765 277 4197 -3353 -5617 8154 -2869 6602 -13465 3981 -16172 792 -4133 4154 3516 -11266 841 -8858 15356 5027 12326 -8825 2803 -8476 7162 -2532 -4794 5834 -350 3697 -1875 9990 -16097 11036 5528 5127 6387 -3594 3696 -5248 -7178 1354 11448 -8816 -1614 -6725 10072 -7803 7182 SS 20210524T051907.1Z 7814.221610 138 1 49.26 2 82.51 61.87 128.80 231.36 0.00 1 0.00 1 0 25 5.676e-01 8.524e-03 3.241e-01 5.050e-03 7.646689e-01 2.787237e-03 7.318220e-03 -6.000000e+00 3.185432e-01 224.85 -2.00 3.06 -2.00 321.84 0.00e+00 7.984127e-03 1.522911e-03 3.112802e-03 -6.000000e+00 1.410317e-02 278.35 -2.00 20.00 -2.00 321.36 0.00e+00 7.132 0.002 302.00 328.00 3 8.9193e-01 1.0231e-02 7.1976e-02 -6.0000e+00 7.8740e-01 1.5820e-01 1.5527e-02 5.0150e-02 -6.0000e+00 8.5851e-01 -1.6880e-01 1.7523e-02 2.0425e-02 -6.0000e+00 5.1122e-01 5.3327e-02 8.0783e-03 1.1080e-02 -6.0000e+00 2.1894e-01 3.0652e-04 -1.3318e-03 1.4189e-04 9.4420e-05 -6.0000e+00 1.5257e-02 6.7185e-03 11 8 0 10 0 0 90.18 18.42 0.29 0.00672 -0.00329 134 29 4 8 0 367.590 15.00 18.42 6.94 20.87 20.87 15.9 832.44 900000 -206608 -50702 -246882 -238863 -228864 -174892 -221778 -152154 -163067 -46020 -27862 -89189 34405 -116717 -60302 -65816 -81759 -112666 -91151 -88712 -56223 -30633 -64795 -5431 -10346 56398 -40956 15560 -63971 5771 -27181 6153 -14418 1010 -23696 -12016 -5838 13324 -1199 9973 -7585 6013 7137 -5227 -3465 -2684 2707 1981 1421 13846 9047 3647 7021 8619 3314 2279 -1310 6449 -1449 -1944 -2699 4969 3571 1300 8690 2664 3411 980 4824 1112 3501 517 954 -497 -79 -1437 -1584 1114 -251 1916 -2076 -568 -1791 1 -1461 -575 -707 -219 -1415 1874 -156 687 1146 964 131 485 763 -1172 226 -266 -176 -70 -335 -2524 -983 -15 -1734 -349 -749 -511 -93 137 -151 411 1403 794 365 -50 -965 -275 643 -474 257 369 335 1462 1699 100 -289 434 272 445 345 -285 -441 107 -282 -762 -205 277 259 243 900000 -1202 -250 -2321 -1925 -1639 -861 -1787 -749 -964 -227 -137 -439 169 -1254 -505 -619 -1025 -2118 -1469 -1430 -654 -317 -928 -51 -107 305 -585 130 -1231 77 -572 110 -342 20 -594 -296 -162 376 -47 393 -387 285 348 -297 -202 -162 165 130 103 1004 782 369 751 964 408 291 -172 759 -182 -257 -404 801 670 267 1649 538 718 237 1302 343 1095 163 280 -134 -19 -333 -383 303 -84 743 -884 -262 -890 1 -820 -336 -425 -130 -819 1069 -85 364 636 615 91 395 716 -1229 234 -258 -152 -60 -286 -2170 -880 -14 -1785 -394 -968 -740 -144 213 -229 589 1921 1105 535 -79 -1570 -436 961 -687 359 496 435 1986 2233 154 -512 848 572 987 819 -730 -1188 293 -786 -2122 -543 680 593 537 SS 20210524T052523.7Z 7814.225969 141 1 50.27 2 81.29 61.06 129.81 229.96 0.00 1 0.00 1 0 25 3.693e-01 6.482e-03 2.342e-01 2.626e-03 6.856745e-01 1.408208e-03 6.733108e-03 -6.000000e+00 2.072284e-01 224.85 -2.00 3.06 -2.00 321.49 0.00e+00 3.760865e-03 7.038638e-04 2.928539e-03 -6.000000e+00 9.124379e-03 278.35 -2.00 20.00 -2.00 320.97 0.00e+00 6.249 0.001 302.00 328.00 3 7.2343e-01 4.8410e-03 6.2482e-02 -6.0000e+00 5.1227e-01 5.0044e-02 7.0287e-03 4.1468e-02 -6.0000e+00 5.5835e-01 -4.7893e-02 7.7691e-03 1.7897e-02 -6.0000e+00 3.3248e-01 7.0595e-03 3.6655e-03 7.1165e-03 -6.0000e+00 1.4139e-01 7.9390e-04 -9.7557e-04 7.3565e-05 6.7441e-05 -6.0000e+00 9.8690e-03 6.5592e-03 11 8 0 10 0 0 79.86 18.42 0.26 0.00656 -0.00077 232 50 2 8 0 213.000 15.00 18.42 7.45 20.87 20.87 16.0 835.66 7260 -176796 -111629 -166975 -45172 -126591 -67946 -118066 -114213 -11837 -143407 -39808 -125204 78062 -73717 -12303 -62690 -14590 -46784 -18975 28692 -16996 -32544 -38927 -13885 -34185 721 -22191 -1608 -34033 7836 -1053 9046 198 -524 8161 -14198 12905 -9648 226 -5770 -506 -8771 4330 3293 1238 1354 -616 4128 -968 8481 -569 7634 -2002 5273 -972 3965 -2616 2758 407 2281 425 2623 2130 286 2010 -52 3797 383 1712 -294 257 -718 431 -260 -1182 1853 -805 683 -950 503 -1317 -839 -1476 -842 -851 -415 -481 -264 456 397 1516 286 1762 390 914 435 434 -574 -252 -102 11 1334 182 -1459 -1285 -364 -762 -288 -689 -182 -388 -86 376 722 1353 682 416 -377 -812 -791 -153 -293 26 598 124 1308 1315 390 253 147 81 310 163 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