File name: Pandora53s1_Potchefstroom-METSI_20231203_L2Fit_fout2c0d20220413p1-8.txt File generation date: 20231203T220616.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c0p1-8 Local principal investigator: Stuart Piketh Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 53 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora53_OF_v5d20210210.txt Instrument calibration file used: Pandora53s1_CF_v103d20220413.txt Level 1 file used: Pandora53s1_Potchefstroom-METSI_20231203_L1_smca1c0d20220413p1-8.txt Full location name: Gerhard Minnebron Mooi River Ecosystem Trails for Scientific Investigations Short location name: Potchefstroom-METSI Country of location: South Africa Location latitude [deg]: -26.4907 Location longitude [deg]: 27.1322 Location altitude [m]: 1440 Local noon date: 20231203 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0881 305.2288 305.3695 305.5101 305.6508 305.7914 305.9321 306.0727 306.2133 306.3539 306.4945 306.6351 306.7757 306.9162 307.0568 307.1973 307.3378 307.4784 307.6189 307.7593 307.8998 308.0403 308.1807 308.3212 308.4616 308.6020 308.7424 308.8828 309.0232 309.1636 309.3040 309.4443 309.5847 309.7250 309.8653 310.0056 310.1459 310.2862 310.4264 310.5667 310.7069 310.8472 310.9874 311.1276 311.2678 311.4080 311.5482 311.6883 311.8285 311.9686 312.1088 312.2489 312.3890 312.5291 312.6692 312.8092 312.9493 313.0893 313.2294 313.3694 313.5094 313.6494 313.7894 313.9294 314.0694 314.2093 314.3493 314.4892 314.6291 314.7690 314.9089 315.0488 315.1887 315.3285 315.4684 315.6082 315.7480 315.8878 316.0276 316.1674 316.3072 316.4470 316.5867 316.7265 316.8662 317.0059 317.1456 317.2853 317.4250 317.5647 317.7044 317.8440 317.9836 318.1233 318.2629 318.4025 318.5421 318.6816 318.8212 318.9608 319.1003 319.2398 319.3794 319.5189 319.6584 319.7978 319.9373 320.0768 320.2162 320.3556 320.4951 320.6345 320.7739 320.9133 321.0526 321.1920 321.3314 321.4707 321.6100 321.7493 321.8887 322.0279 322.1672 322.3065 322.4458 322.5850 322.7242 322.8635 323.0027 323.1419 323.2810 323.4202 323.5594 323.6985 323.8377 323.9768 324.1159 324.2550 324.3941 324.5332 324.6722 324.8113 324.9503 --------------------------------------------------------------------------------------- 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: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: 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 78: 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 79: 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 80: 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 81: 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 82: 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 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Azimuth motor temperature [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20231203T041311.5Z 8737.175827 180 1 49.97 2 77.80 108.75 50.82 335.33 0.00 1 0.00 1 0 25 2.518e-01 8.274e-02 1.716e-01 4.341e-03 6.022020e-01 2.419679e-03 8.080794e-03 -6.000000e+00 1.561947e-01 228.13 -2.00 3.06 -2.00 319.93 0.00e+00 -3.674906e-02 8.164067e-04 4.115327e-03 -6.000000e+00 7.452302e-03 282.74 -2.00 20.00 -2.00 319.28 0.00e+00 4.597 0.001 302.00 328.00 3 5.0379e+00 7.1352e-03 4.7817e-02 -6.0000e+00 3.8863e-01 -5.1764e-02 8.7644e-03 3.1608e-02 -6.0000e+00 4.2128e-01 2.0802e-01 7.7906e-03 5.1275e-02 -6.0000e+00 2.4785e-01 -1.4507e-01 3.9678e-03 4.5286e-02 -6.0000e+00 1.0343e-01 3.8329e-05 -3.2411e-03 1.3711e-04 4.7744e-04 -6.0000e+00 8.2177e-03 -3.9336e-02 -9.5665e-05 12 9 9 12 12 4 -1.11 17.73 0.33 -0.03934 -0.06369 13 2 1 5 0 3841.900 20.77 15.00 17.73 23.47 49.40 15.7 890.81 32939 -139453 -85683 900000 -40268 900000 900000 900000 20112 79025 900000 34642 900000 62708 37380 -92077 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3476 1687 869 1159 2037 2213 2363 2889 3928 2821 4204 5616 -86334 8762 6439 6944 3835 2190 1442 393 1125 1561 2916 2751 4736 5812 5944 5930 6525 6224 6748 7609 6201 6991 3212 839 987 -740 798 523 786 1496 832 -366 -694 -1051 -2012 -1615 -3101 -1668 -960 2154 3920 4968 3816 2786 -844 -1356 -3338 -2329 -1903 -2417 -920 660 824 -44 -146 -4205 -4795 -4447 -2935 -3594 -3567 -3607 450 1059 796 1666 2721 2978 3601 3015 SS 20231203T041849.1Z 8737.179735 183 1 50.38 2 76.61 108.21 51.33 333.80 0.00 1 0.00 1 0 25 2.381e-01 5.621e-02 1.321e-01 3.498e-03 5.382650e-01 1.902093e-03 5.955920e-03 -6.000000e+00 1.456330e-01 228.13 -2.00 3.06 -2.00 319.59 0.00e+00 -1.772974e-02 5.683512e-04 1.974310e-03 -6.000000e+00 6.543929e-03 282.74 -2.00 20.00 -2.00 318.92 0.00e+00 4.214 0.000 302.00 328.00 3 5.0032e+00 5.4463e-03 4.3168e-02 -6.0000e+00 3.6164e-01 -1.5385e-02 6.4914e-03 2.5774e-02 -6.0000e+00 3.9145e-01 1.0150e-01 5.3468e-03 2.4181e-02 -6.0000e+00 2.3254e-01 -7.7152e-02 2.7657e-03 2.0175e-02 -6.0000e+00 9.7398e-02 5.5749e-05 -2.0333e-03 1.0984e-04 2.1479e-04 -6.0000e+00 7.6353e-03 -3.8293e-02 -1.0252e-04 12 9 9 12 4 4 60.21 17.77 0.39 -0.03829 -0.05357 16 3 1 5 0 3147.720 20.87 15.01 17.77 24.06 49.10 15.7 894.74 -48153 -75407 -93353 900000 -29155 20426 900000 129466 14715 -11615 134394 10083 95978 23303 -16223 -66641 -8439 -7180 -11788 -11131 -11722 499 -1397 -2965 121 18684 -9528 22652 30073 7892 4437 11782 -13755 -15388 -8650 -14971 -6480 -10334 3858 3250 9272 10244 7777 8780 959 4982 -1999 -2054 -3055 -444 -1925 201 1867 5040 5333 6560 10953 14341 13411 10445 4432 5521 2189 2485 1693 3361 3547 2764 2906 4701 1334 1986 4429 -55544 8463 5468 7066 4428 2585 2169 -1218 226 67 1996 1311 3128 3428 3030 2777 3714 4645 4348 4849 3924 4290 1813 666 540 -281 1198 609 359 820 562 -745 -931 -861 -1548 -940 -921 -1048 -747 922 1432 2070 2167 571 -318 -1129 -1303 -1170 -561 -631 -85 923 603 289 617 -1411 -1584 -1211 -1104 -1269 -1192 -1311 381 124 271 506 419 1041 1044 762 -530 -1186 -1848 900000 -301 137 900000 441 185 -223 708 191 886 493 -567 -4114 -336 -296 -545 -543 -606 24 -76 -192 9 1284 -873 1484 1715 548 337 925 -1509 -1785 -975 -1789 -789 -1583 628 654 1990 2375 1917 2145 249 1224 -520 -534 -820 -122 -572 65 640 1834 2099 2674 4508 5812 5393 4206 1891 2449 1069 1284 918 1772 1862 1455 1653 2901 925 1425 3138 -60621 5406 3272 3907 2439 1525 1414 -903 184 58 1814 1259 3089 3493 3196 2938 3843 4573 4086 4305 3505 3992 1890 750 666 -364 1559 776 430 945 643 -891 -1164 -1114 -2098 -1312 -1357 -1652 -1218 1490 2267 3129 3157 830 -477 -1737 -2067 -1882 -897 -977 -129 1346 860 406 869 -2106 -2525 -2030 -1935 -2269 -2214 -2516 749 251 557 1042 844 2049 1983 1425 SS 20231203T042451.2Z 8737.183926 186 1 51.28 2 75.32 107.64 51.92 332.19 0.00 1 0.00 1 0 25 1.415e-01 7.614e-03 6.377e-02 2.818e-03 4.853849e-01 1.502019e-03 4.969455e-03 -6.000000e+00 8.588933e-02 228.13 -2.00 3.06 -2.00 319.28 0.00e+00 3.346339e-04 4.034082e-04 5.419449e-04 -6.000000e+00 3.809732e-03 282.74 -2.00 20.00 -2.00 318.60 0.00e+00 3.868 0.000 302.00 328.00 3 4.9369e+00 4.2092e-03 3.9415e-02 -6.0000e+00 2.1332e-01 2.7050e-02 4.9241e-03 2.2402e-02 -6.0000e+00 2.3082e-01 -8.4405e-03 3.8215e-03 1.0882e-02 -6.0000e+00 1.3757e-01 -9.0536e-03 1.9975e-03 3.1978e-03 -6.0000e+00 5.7720e-02 8.0202e-05 -1.4792e-04 8.7607e-05 3.9476e-05 -6.0000e+00 4.4663e-03 -3.8256e-02 -1.5351e-04 12 9 1 12 4 4 70.60 17.82 0.33 -0.03826 -0.03937 20 4 1 5 0 2562.960 20.87 15.00 17.82 24.88 49.10 15.7 900.39 -16263 -14095 -26799 108195 -13488 16825 58530 48263 -6514 -6551 49400 -12573 60500 8991 12629 -23335 -215 612 -2079 6753 -4140 5524 8045 -5833 -7263 -868 -12563 4395 12153 -1930 5901 9344 -1674 -8159 -7126 -5046 -2926 -1732 -435 -3831 -2463 -1572 -2643 888 -1721 -1225 -315 -1473 839 356 996 1067 -148 3815 203 920 839 2185 1458 1333 940 2238 1490 629 888 1749 1140 1052 351 1095 -1599 -1144 -750 -291 394 -544 593 -211 415 32 -192 -1232 -1410 -1240 -1130 -827 -572 -341 -481 851 364 1237 1734 905 2145 686 527 79 -424 467 -687 -791 43 245 -898 -887 -1169 -752 -343 -74 -293 -501 -21 -38 360 910 1033 93 -91 -345 -707 -242 -386 -49 510 267 933 1600 645 581 539 227 168 81 -118 -59 -218 -172 -460 -112 -369 -207 124 -281 -271 -618 673 -254 238 601 603 -154 -168 791 -402 1131 323 523 -1558 -13 39 -145 452 -319 395 585 -510 -695 -82 -1348 400 1006 -185 580 1011 -220 -1204 -1037 -725 -448 -307 -90 -936 -651 -444 -788 262 -526 -377 -97 -463 264 118 345 405 -61 1605 92 427 400 1031 683 621 453 1122 812 367 536 1026 666 621 220 747 -1181 -884 -578 -214 273 -353 360 -129 264 22 -150 -1058 -1299 -1196 -1139 -870 -622 -375 -530 912 375 1218 1635 858 2111 728 614 100 -563 619 -892 -978 50 284 -1093 -1128 -1546 -1019 -489 -111 -461 -814 -33 -59 546 1325 1508 139 -140 -549 -1130 -383 -603 -74 752 383 1306 2252 956 918 896 389 295 146 -222 -114 -432 -342 -921 -220 -716 -387 227 SS 20231203T043549.1Z 8737.191540 189 1 50.74 2 72.98 106.63 53.06 329.35 0.00 1 0.00 1 0 25 2.557e-02 6.047e-03 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