File name: Pandora159s1_Wakkerstroom_20210929_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T032637.8Z 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_20210929_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: 20210929 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 20210929T045306.6Z 7942.203549 187 1 48.01 2 74.81 84.85 55.65 345.55 0.00 1 0.00 1 0 25 3.492e-01 5.095e-02 3.300e-01 3.994e-02 4.912371e-01 2.122350e-02 5.564995e-03 -6.000000e+00 2.014141e-01 227.76 -2.00 3.06 -2.00 320.18 0.00e+00 3.680936e-03 6.359469e-03 2.188895e-03 -6.000000e+00 1.008579e-02 277.90 -2.00 20.00 -2.00 319.56 0.00e+00 3.746 0.000 302.00 328.00 3 6.5123e+00 6.1823e-02 3.8985e-02 -6.0000e+00 5.0094e-01 2.9288e-01 7.3068e-02 2.5361e-02 -6.0000e+00 5.4598e-01 -4.1710e-01 5.5004e-02 1.2371e-02 -6.0000e+00 3.2127e-01 2.0663e-01 2.8331e-02 3.3547e-03 -6.0000e+00 1.3834e-01 1.8860e-05 -1.8963e-03 1.1993e-03 5.5053e-05 -6.0000e+00 9.6374e-03 9.7776e-05 12 8 8 10 0 0 99.92 19.18 2.01 0.00010 -0.01415 12 3 2 8 0 4000.000 14.99 19.18 18.96 21.48 21.48 17.6 889.97 900000 900000 -93693 19823 -76142 900000 900000 -69398 9281 49342 900000 900000 900000 -10315 9253 102641 30773 -48946 214029 29015 900000 900000 -16207 900000 47973 62780 -6809 -7842 -14636 101763 28861 72876 95733 52502 19404 -6812 37008 143829 -32282 6055 -5959 -22390 22476 -7877 30708 -1088 17271 11884 35815 12600 8222 35803 37956 -4055 -10604 108 -6095 13252 -11500 8476 -7119 32282 10755 2873 24434 6491 -3169 -880 8225 12304 -537 11589 -3416 4121 -5912 10628 16052 -10552 7765 -1239 10862 -7324 -3124 105 -5618 3124 -5700 -3626 -6996 2663 -2890 -6020 12453 6760 11843 -6067 -5060 -10761 799 -3682 -3620 998 -682 -6821 -1482 2661 17588 -6055 -3948 3170 3276 2620 3451 5205 1666 843 86 7239 -3914 -2326 -926 -3498 547 -1055 1032 -6562 4725 8606 2560 -1996 4094 5744 -253 1348 -877 -4492 1980 -1902 -442 -408 1237 -2010 475 900000 900000 -9386 771 -5305 900000 900000 -4707 361 1918 900000 900000 900000 -649 571 3990 1866 -6679 8320 2005 900000 900000 -1683 900000 2922 3399 -707 -776 -1482 3956 2200 4131 4824 4135 1978 -856 3276 5591 -7612 1140 -1382 -6376 4280 -2033 5468 -264 3501 2542 6152 2780 2028 7403 8196 -1390 -4022 38 -2290 4084 -4371 2607 -2611 8768 3979 1255 8925 2689 -1371 -373 3443 5636 -304 6068 -2054 2188 -3181 4387 5763 -4803 3203 -643 5780 -5210 -2307 79 -4764 2590 -5437 -3488 -6944 2321 -2486 -4922 7986 4582 8318 -5767 -5401 -13674 979 -4712 -4349 1041 -670 -7185 -1598 2929 17559 -8032 -5510 4526 5077 4257 5489 7761 2395 1161 119 9761 -6252 -3832 -1519 -5720 831 -1570 1441 -9452 5842 10396 3595 -3233 6749 9738 -467 2568 -1806 -10077 4267 -4321 -989 -884 2490 -3953 877 SS 20210929T050354.0Z 7942.211041 192 1 41.50 2 72.42 83.55 56.29 342.81 0.00 1 0.00 1 0 25 8.328e-02 7.191e-03 6.987e-02 4.284e-03 4.219056e-01 2.177015e-03 4.303355e-03 -6.000000e+00 4.727463e-02 227.76 -2.00 3.06 -2.00 319.90 0.00e+00 2.761901e-03 6.550277e-04 3.826413e-04 -6.000000e+00 2.054878e-03 277.90 -2.00 20.00 -2.00 319.29 0.00e+00 3.267 0.000 302.00 328.00 3 4.3572e+00 6.2600e-03 3.2930e-02 -6.0000e+00 1.1767e-01 -2.5024e-02 7.4534e-03 1.9935e-02 -6.0000e+00 1.2795e-01 -3.6826e-03 6.2291e-03 9.7306e-03 -6.0000e+00 7.6000e-02 -5.6979e-03 3.2466e-03 3.9915e-03 -6.0000e+00 3.2141e-02 2.8299e-04 -7.5395e-04 1.2553e-04 3.6539e-05 -6.0000e+00 2.2264e-03 -1.4866e-06 12 9 1 12 1 1 99.93 19.18 0.47 -0.00000 -0.00567 25 7 4 8 0 1585.490 15.00 19.18 19.30 21.48 21.48 17.5 891.37 -34835 10971 -48578 -30880 -14145 13016 -31596 22664 -35043 -8642 21180 -7963 -5093 8624 1515 -6939 15486 -4732 12599 4118 2344 -1695 -3687 -4093 -2171 -892 -4484 -2070 4264 1267 10834 3615 -2194 -5354 -6766 2225 -4983 3468 227 -4561 -2536 -170 -2045 -3379 2 -1522 2499 -1560 1565 2245 -975 4662 739 1806 -431 1936 -1194 1327 -945 1149 1416 1564 1934 5 -410 2054 221 1315 1852 -1021 792 -717 936 -350 -333 -237 1064 320 350 1991 -803 -810 -2597 -1063 -912 -578 -310 -159 -161 -77 679 819 900 1930 1773 1179 593 -93 -234 -645 -452 -961 561 640 -1377 -1190 -719 -818 -231 113 -151 -66 -416 203 673 1405 214 275 -134 -548 -687 289 -48 -184 680 596 1028 1419 281 -397 401 -157 201 543 -315 -379 316 -132 -493 -22 -223 -182 185 -752 173 -1426 -735 -260 180 -716 345 -1038 -209 393 -211 -156 282 63 -361 704 -279 670 250 149 -112 -255 -304 -169 -72 -375 -162 305 97 843 343 -245 -643 -789 233 -615 464 38 -933 -563 -39 -500 -854 0 -387 615 -401 394 581 -280 1396 246 635 -161 726 -472 513 -365 431 550 661 901 3 -216 1008 105 618 937 -605 502 -482 614 -223 -197 -127 517 154 181 1164 -546 -613 -2147 -911 -829 -558 -315 -166 -168 -78 637 714 734 1549 1538 1154 653 -114 -307 -842 -556 -1090 591 691 -1623 -1474 -929 -1110 -329 175 -248 -111 -693 321 992 1957 301 405 -210 -904 -1140 469 -75 -282 997 840 1385 1939 420 -648 693 -280 368 1035 -638 -800 679 -290 -1089 -46 -461 -364 360 SS 20210929T052222.8Z 7942.223875 198 1 50.32 2 68.35 81.23 57.63 338.25 0.00 1 0.00 1 0 17 3.108e-01 1.063e-01 2.139e-01 1.948e-02 1.392797e-01 9.395839e-03 4.852974e-03 -6.000000e+00 1.765696e-01 227.76 -2.00 3.06 -2.00 319.15 0.00e+00 -1.025194e-03 2.275595e-03 4.726202e-03 -6.000000e+00 7.672614e-03 277.91 -2.00 20.00 -2.00 318.53 0.00e+00 2.687 0.000 302.00 328.00 3 7.2809e+00 2.6163e-02 2.9791e-02 -6.0000e+00 4.3949e-01 -6.3099e-01 2.9927e-02 2.7995e-02 -6.0000e+00 4.7779e-01 2.7251e-01 2.1601e-02 7.7040e-03 -6.0000e+00 2.8380e-01 2.6890e-03 1.1487e-02 2.2729e-03 -6.0000e+00 1.2011e-01 4.4929e-05 6.8336e-03 5.9153e-04 1.1564e-05 -6.0000e+00 8.3090e-03 -4.6948e-03 12 9 8 11 8 0 99.98 19.18 1.66 -0.00469 0.04666 13 3 4 8 0 3870.370 15.00 19.18 20.50 21.48 21.48 17.7 898.15 215061 -24033 9347 23217 113702 -55236 162297 29370 -12462 135429 40303 -15361 66246 60196 6623 -1763 -18218 -12383 -4529 4356 -5018 -10909 44715 26846 -2649 -7669 -10122 11384 19351 19527 26858 -6440 -8198 -9477 -35010 -13655 -10948 20189 7158 5644 187 6140 -7095 1165 6177 20 -7827 -896 9128 -5997 -3053 -4241 -6204 -5796 -1414 -3563 -2565 594 4827 7506 9049 6995 10171 7177 -6313 -3896 -8324 1416 1468 -755 -4312 -2927 -2731 -533 -3319 -424 2764 458 5734 2562 4693 3819 -1404 1861 4538 5261 5366 1484 5505 7250 5338 4139 7557 7820 6453 4754 970 1587 -1180 -883 -4212 -522 3032 10070 9494 6583 -47652 9450 10108 7817 6549 -163 -3037 -4072 -4438 1834 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