File name: Pandora53s1_Potchefstroom-METSI_20230503_L2Fit_fout2c2d20230223p1-8.txt File generation date: 20240824T144718.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Stuart Piketh Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 53 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora53_OF_v5d20210210.txt Instrument calibration file used: Pandora53s1_CF_v2d20230223.txt Level 1 file used: Pandora53s1_Potchefstroom-METSI_20230503_L1_smca1c2d20230223p1-8.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: 20230503 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: Modification of session 103 "redoing cal analysis" First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0454 305.1861 305.3267 305.4673 305.6079 305.7485 305.8891 306.0297 306.1702 306.3108 306.4513 306.5919 306.7324 306.8729 307.0134 307.1539 307.2943 307.4348 307.5752 307.7157 307.8561 307.9965 308.1369 308.2773 308.4177 308.5581 308.6984 308.8388 308.9791 309.1194 309.2597 309.4000 309.5403 309.6806 309.8209 309.9611 310.1014 310.2416 310.3818 310.5220 310.6622 310.8024 310.9426 311.0827 311.2229 311.3630 311.5031 311.6433 311.7834 311.9234 312.0635 312.2036 312.3437 312.4837 312.6237 312.7638 312.9038 313.0438 313.1837 313.3237 313.4637 313.6036 313.7436 313.8835 314.0234 314.1633 314.3032 314.4431 314.5830 314.7228 314.8627 315.0025 315.1424 315.2822 315.4220 315.5618 315.7015 315.8413 315.9811 316.1208 316.2605 316.4002 316.5400 316.6797 316.8193 316.9590 317.0987 317.2383 317.3780 317.5176 317.6572 317.7968 317.9364 318.0760 318.2155 318.3551 318.4946 318.6342 318.7737 318.9132 319.0527 319.1922 319.3317 319.4711 319.6106 319.7500 319.8894 320.0288 320.1683 320.3076 320.4470 320.5864 320.7257 320.8651 321.0044 321.1437 321.2831 321.4224 321.5616 321.7009 321.8402 321.9794 322.1187 322.2579 322.3971 322.5363 322.6755 322.8147 322.9538 323.0930 323.2321 323.3713 323.5104 323.6495 323.7886 323.9277 324.0668 324.2058 324.3449 324.4839 324.6229 324.7620 324.9010 --------------------------------------------------------------------------------------- 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 20230503T053513.7Z 8523.232798 159 1 50.01 2 78.54 65.94 131.88 239.01 0.00 1 0.00 1 0 25 2.300e-01 1.371e-02 1.067e-01 4.448e-03 5.265167e-01 2.359531e-03 5.308683e-03 -6.000000e+00 1.369900e-01 225.65 -2.00 3.06 -2.00 320.09 0.00e+00 -3.287233e-03 8.141484e-04 3.797522e-04 -6.000000e+00 6.170748e-03 281.71 -2.00 20.00 -2.00 319.46 0.00e+00 4.871 0.001 302.00 328.00 3 4.4023e+00 6.9751e-03 4.7355e-02 -6.0000e+00 3.3848e-01 -2.8098e-02 8.5198e-03 2.4471e-02 -6.0000e+00 3.6751e-01 -4.0771e-02 7.3437e-03 1.2163e-02 -6.0000e+00 2.1845e-01 9.5272e-03 3.7444e-03 4.7819e-03 -6.0000e+00 9.2126e-02 6.3331e-05 1.6551e-04 1.3748e-04 5.1873e-05 -6.0000e+00 7.1222e-03 2.5111e-02 0.0000e+00 12 9 8 11 32 0 95.14 17.28 0.04 0.02511 0.02635 17 3 1 5 0 2941.300 20.46 15.00 17.28 19.21 43.10 14.5 870.33 -90522 -112941 -76302 900000 -2523 -69394 900000 -36281 -12365 -63147 61859 -43397 123939 26280 -15243 -64440 8487 32462 3932 -10930 11450 10893 8939 -33630 9191 5594 -33191 10159 21514 23006 -6988 29408 -10069 -18175 -16234 -8049 -5928 -9507 26 -5261 3841 3245 1446 9950 -4633 7255 -1079 1771 2109 5443 3809 1085 -1096 9292 1903 1771 5674 6405 5492 107 333 3061 2773 2821 2008 2785 2576 3140 -991 2305 -2433 -2168 -1373 -5665 2064 -1223 974 -13843 -2957 1198 -976 656 -1418 209 -1565 449 -1312 809 -25 501 68 1469 1425 743 3242 -669 -233 1879 170 620 -1333 -1181 -179 -1470 -1003 -718 -764 -1271 -489 -184 551 -463 373 319 753 337 111 -124 505 91 -222 -651 -413 440 896 1048 548 1072 938 555 645 463 -320 -369 -804 18 -262 -607 -152 138 -13 160 -164 -1744 -2991 -1507 900000 -24 -1221 900000 -589 -186 -1635 553 -1103 815 492 -488 -3682 272 915 153 -506 449 442 394 -2374 476 319 -2749 541 1024 1121 -489 1681 -931 -1872 -1619 -770 -601 -1191 4 -896 673 600 283 1867 -987 1383 -225 365 446 1180 918 290 -327 2705 620 605 1922 2160 1835 37 119 1157 1141 1267 941 1266 1149 1426 -501 1247 -1486 -1386 -869 -3577 1139 -647 480 -7687 -1598 700 -657 481 -1137 173 -1383 415 -1275 793 -24 485 62 1258 1189 631 2865 -669 -254 2222 216 787 -1637 -1379 -197 -1647 -1168 -869 -962 -1683 -683 -272 863 -755 603 503 1136 496 163 -186 786 146 -362 -1059 -651 674 1332 1520 775 1546 1428 906 1126 833 -598 -717 -1642 38 -563 -1314 -329 292 -27 318 -322 SS 20230503T054207.7Z 8523.237590 162 1 51.27 2 77.14 65.03 133.13 237.53 0.00 1 0.00 1 0 25 1.212e-01 8.582e-03 6.112e-02 3.019e-03 4.809925e-01 1.576903e-03 4.891038e-03 -6.000000e+00 7.168398e-02 225.65 -2.00 3.06 -2.00 319.63 0.00e+00 -7.192947e-04 4.709369e-04 2.011779e-04 -6.000000e+00 3.190501e-03 281.71 -2.00 20.00 -2.00 318.97 0.00e+00 4.376 0.000 302.00 328.00 3 4.2072e+00 4.5008e-03 4.2611e-02 -6.0000e+00 1.7711e-01 -4.6130e-02 5.3544e-03 2.1754e-02 -6.0000e+00 1.9222e-01 -9.9743e-04 4.3629e-03 1.0808e-02 -6.0000e+00 1.1466e-01 -8.3521e-03 2.2669e-03 3.1014e-03 -6.0000e+00 4.8452e-02 1.1903e-04 1.4053e-04 9.2652e-05 3.8813e-05 -6.0000e+00 3.6807e-03 2.4909e-02 0.0000e+00 11 8 0 10 0 0 95.32 17.31 0.22 0.02491 0.02596 25 5 1 5 0 2050.320 20.46 14.99 17.31 19.60 43.10 14.4 873.32 -16507 -51379 -46675 60616 -21568 -44485 11926 -26326 -9275 -27510 50278 -27274 38572 5716 -7723 -29086 -6996 -120 3181 6696 -1442 4273 9536 -15700 1230 -7745 -7311 4496 12899 3402 -4491 10758 -6546 -2862 -8457 -7240 -5674 -8440 -821 -4759 -76 -1314 981 1421 -2914 2348 -1877 1196 1433 3598 629 1188 699 4518 614 154 2031 2624 3279 196 405 2860 1467 1362 752 1311 489 1568 180 2132 -2236 -1240 -696 -19 1266 -1080 1143 -7013 -346 928 -1299 -733 -1107 -980 -1327 78 -671 560 305 539 96 159 1001 -515 2135 247 443 936 -335 621 -800 -829 -384 -3 -1113 -816 -793 -1012 -119 -32 186 -302 461 490 653 10 78 24 88 185 -328 -604 -667 471 826 368 354 1258 787 734 739 189 -405 -408 -784 167 -76 -127 -134 14 -381 94 -41 -237 -1146 -1041 478 -353 -889 157 -564 -189 -709 673 -827 742 180 -322 -1676 -367 -6 175 373 -87 257 573 -1283 92 -668 -634 336 893 262 -418 979 -768 -340 -1045 -895 -762 -1343 -147 -1019 -17 -327 242 357 -771 612 -501 313 383 991 194 390 251 1679 244 64 853 1098 1341 82 175 1308 736 726 416 701 256 826 104 1334 -1570 -884 -493 -13 815 -646 635 -4182 -208 604 -969 -599 -969 -895 -1275 77 -705 588 321 559 95 150 890 -466 2035 260 508 1154 -441 811 -1022 -994 -438 -4 -1343 -1023 -1031 -1376 -170 -48 296 -487 746 771 982 14 114 36 137 296 -534 -968 -1055 722 1230 537 501 1798 1185 1175 1258 332 -733 -766 -1521 334 -154 -263 -279 28 -762 181 -79 SS 20230503T054835.0Z 8523.242071 165 1 50.55 2 75.83 64.16 134.27 236.08 0.00 1 0.00 1 0 25 7.013e-02 6.998e-03 3.094e-02 2.442e-03 4.434307e-01 1.268437e-03 4.549751e-03 -6.000000e+00 4.146224e-02 225.65 -2.00 3.06 -2.00 319.25 0.00e+00 -5.003631e-04 3.333043e-04 1.868463e-04 -6.000000e+00 1.845421e-03 281.71 -2.00 20.00 -2.00 318.57 0.00e+00 3.999 0.000 302.00 328.00 3 4.1697e+00 3.5395e-03 3.9023e-02 -6.0000e+00 1.0244e-01 -5.3314e-02 4.1304e-03 2.0007e-02 -6.0000e+00 1.1118e-01 -2.1853e-04 3.1533e-03 9.8961e-03 -6.0000e+00 6.6318e-02 -5.0878e-03 1.6524e-03 2.8134e-03 -6.0000e+00 2.8024e-02 1.7502e-04 1.5019e-04 7.5283e-05 3.5382e-05 -6.0000e+00 2.1290e-03 2.5055e-02 0.0000e+00 11 8 0 10 0 0 97.26 17.33 0.23 0.02506 0.02618 32 6 1 5 0 1579.410 20.46 15.00 17.33 20.09 43.10 14.4 876.43 -30010 -46060 -19833 11001 -8164 -17572 17297 -20834 -9382 -21330 1890 -11524 16915 7596 3265 -22774 -7171 -262 3180 -4161 -1033 -768 6504 -6836 -2412 358 -115 3065 5002 4564 692 9970 -3489 -2266 -2626 -4228 -2628 -3227 -365 -3285 -1818 -91 -405 507 -1016 1492 -1039 75 -418 2043 543 608 563 2196 297 883 1886 1797 1570 -75 251 1740 1808 1313 385 1044 344 834 202 1269 -699 -1276 -30 66 828 -820 -271 -4815 -786 168 -633 -861 -660 -1230 -1232 -522 -526 565 35 19 446 735 973 657 1464 745 481 1096 -8 374 -596 -601 -436 -609 -907 -1008 -1056 -644 -256 -100 135 -168 392 128 18 368 134 181 3 -297 3 -455 -336 113 981 543 697 975 822 823 351 403 -390 -19 -502 -111 -55 -388 -108 -207 -141 -46 -1 -740 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