File name: Pandora53s1_Potchefstroom-METSI_20230803_L2Fit_fout2c0d20220413p1-8.txt File generation date: 20230804T212954.4Z 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_20230803_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: 20230803 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 20230803T052112.1Z 8615.223057 286 1 50.26 2 84.34 67.16 79.19 259.05 0.00 1 0.00 1 0 17 5.999e-01 2.166e-02 2.650e-01 6.741e-03 1.003241e+00 4.062929e-03 9.444192e-03 -6.000000e+00 3.683540e-01 226.26 -2.00 3.06 -2.00 322.00 0.00e+00 -1.430220e-03 2.390858e-03 1.905329e-03 -6.000000e+00 1.789616e-02 278.96 -2.00 20.00 -2.00 321.57 0.00e+00 8.973 0.004 302.00 328.00 3 1.3193e+00 1.5622e-02 9.0070e-02 -6.0000e+00 9.1750e-01 8.5579e-01 2.3103e-02 5.1819e-02 -6.0000e+00 9.9813e-01 -1.0650e+00 2.3750e-02 2.7670e-02 -6.0000e+00 5.8781e-01 4.1423e-01 1.0707e-02 8.5698e-03 -6.0000e+00 2.4621e-01 2.6452e-05 -1.0834e-03 1.8571e-04 1.3593e-04 -6.0000e+00 1.9684e-02 -3.7467e-02 -1.4009e-04 12 9 9 12 4 4 76.12 15.49 0.47 -0.03747 -0.04561 54 10 1 5 0 930.510 19.04 15.01 15.49 6.81 31.10 14.0 788.97 -156309 -195530 -217648 900000 45074 -251369 900000 -248468 900000 -197685 900000 -179970 900000 32207 -109634 -91936 -88434 900000 1037 23420 118021 900000 900000 -106950 100963 -93979 -31482 -51863 900000 900000 -26951 900000 -45574 99427 -30878 11724 15457 -42933 41009 -18019 30369 5323 70508 29681 46680 41514 -4165 50904 29859 91364 15164 45543 8952 76670 19817 25506 56948 36677 50326 12075 19206 29302 20522 18150 14893 23986 10757 35503 2827 22300 2799 5710 996 -2666 17410 -4704 8521 -32453 5181 6229 -1221 3401 3552 2696 -5249 2560 -105 4233 -721 -2597 1303 2155 5845 -1984 5195 -3142 -1246 123 -2545 738 -3136 -653 -1335 -1181 -2555 -3755 -2678 -4319 -609 -2336 -1233 -1663 734 224 -152 -184 -848 717 1196 1393 944 362 79 782 2052 1644 1302 2264 1623 133 535 775 46 350 -1374 648 -67 -38 -317 -215 -3 -423 -937 -1398 -2915 -4153 900000 296 -5546 900000 -6075 900000 -3419 900000 -3327 900000 211 -2027 -1700 -1793 900000 10 182 774 900000 900000 -3316 662 -2858 -507 -990 900000 900000 -530 900000 -1522 913 -939 231 313 -1818 905 -849 996 241 1724 1097 1448 1362 -221 1639 1282 2577 940 2363 747 3566 1749 2236 3736 2909 3331 1123 1672 2499 2178 2251 2087 3190 1687 4658 527 4242 652 1345 242 -625 3281 -993 1494 -8214 1034 1485 -377 1169 1371 1136 -2548 1212 -53 2099 -373 -1320 603 946 2473 -975 2738 -1980 -917 104 -2450 709 -2999 -552 -1025 -869 -1970 -3101 -2332 -4171 -639 -2678 -1606 -2407 1091 338 -226 -268 -1247 1075 1862 2215 1478 543 113 1070 2692 2108 1661 3026 2500 227 1038 1557 101 827 -3551 1631 -175 -101 -825 -535 -8 -962 -2038 SS 20230803T053311.0Z 8615.231377 289 1 50.60 2 81.88 65.69 81.75 257.91 0.00 1 0.00 1 0 25 5.918e-01 8.569e-03 9.226e-02 1.739e-03 7.921283e-01 9.645370e-04 7.625330e-03 -6.000000e+00 3.568461e-01 226.26 -2.00 3.06 -2.00 321.10 0.00e+00 3.198533e-03 4.579129e-04 8.669357e-04 -6.000000e+00 1.568960e-02 278.96 -2.00 20.00 -2.00 320.60 0.00e+00 6.646 0.002 302.00 328.00 3 1.1845e+00 3.1719e-03 6.7106e-02 -6.0000e+00 8.8357e-01 1.5189e-01 4.4230e-03 3.8543e-02 -6.0000e+00 9.5791e-01 -1.5487e-01 4.6606e-03 2.0140e-02 -6.0000e+00 5.7044e-01 5.0677e-02 2.2176e-03 8.5274e-03 -6.0000e+00 2.3942e-01 2.6024e-04 -3.2484e-04 4.8283e-05 9.3737e-05 -6.0000e+00 1.8670e-02 -3.8805e-02 -1.1584e-04 12 9 1 12 4 4 67.12 15.56 0.27 -0.03881 -0.04125 205 38 1 5 0 246.810 19.04 15.00 15.56 7.62 32.80 14.0 795.01 -260146 -222663 -229591 -112421 -215267 -124234 -187885 -175164 -156006 -178207 -146963 -168238 -25349 -112502 -73363 -109899 -55641 -60466 -50761 -47405 -55248 -13274 -42230 -53487 -43713 -34118 -37881 -43170 -17754 -17885 -26986 -15210 -12770 -17480 -14153 -10488 -16048 -8779 -6718 -3724 -5337 -204 -1098 3287 3357 4873 1875 -594 2817 5958 6701 4845 5420 8761 4454 4020 3230 5108 2026 4171 2453 5187 3829 4240 4347 2775 3346 2870 2332 1845 1054 337 9 -66 445 159 -451 -2909 -251 -485 -424 -1075 -1445 -1622 -1723 -848 -498 -286 -597 128 225 785 906 620 541 211 155 -18 -521 37 -145 -526 292 -174 -827 -831 -1077 -1020 -512 -166 -429 -391 -67 -26 483 477 748 625 108 -214 -27 -84 -359 116 594 471 1026 1188 444 506 196 81 -96 163 -252 -233 10 -260 -386 -136 -21 2 -16 -2768 -2153 -2372 -400 -2081 -485 -1498 -1396 -1164 -1844 -1246 -2112 -99 -1393 -796 -2125 -736 -954 -801 -772 -1012 -164 -738 -1143 -927 -700 -829 -1003 -331 -373 -746 -459 -402 -628 -500 -364 -646 -390 -357 -230 -384 -15 -89 264 276 408 169 -58 286 644 809 619 770 1323 755 722 604 940 377 751 464 1048 894 1116 1236 821 1000 839 759 685 436 147 4 -27 168 55 -148 -1001 -95 -217 -225 -614 -922 -1118 -1268 -612 -376 -222 -463 96 170 559 630 451 412 188 151 -20 -606 44 -174 -579 292 -170 -847 -901 -1242 -1193 -659 -240 -656 -613 -107 -41 773 739 1154 999 172 -352 -45 -140 -572 178 873 671 1510 1713 721 885 365 165 -198 357 -567 -552 24 -614 -909 -322 -47 5 -35 SS 20230803T054906.4Z 8615.242435 294 1 50.51 2 78.66 63.66 85.13 256.36 0.00 1 0.00 1 0 25 2.105e-01 6.153e-03 1.481e-02 6.427e-04 6.146762e-01 3.443087e-04 6.144969e-03 -6.000000e+00 1.269567e-01 226.26 -2.00 3.06 -2.00 319.91 0.00e+00 1.793207e-03 1.129015e-04 5.413572e-04 -6.000000e+00 5.581016e-03 278.96 -2.00 20.00 -2.00 319.33 0.00e+00 4.919 0.001 302.00 328.00 3 9.8187e-01 9.9380e-04 4.9976e-02 -6.0000e+00 3.1436e-01 7.1989e-02 1.2076e-03 2.8405e-02 -6.0000e+00 3.4079e-01 -4.7069e-02 1.0757e-03 1.4127e-02 -6.0000e+00 2.0294e-01 5.7317e-03 5.5343e-04 5.1277e-03 -6.0000e+00 8.5190e-02 1.5209e-03 -1.0665e-04 1.8825e-05 5.6190e-05 -6.0000e+00 6.6415e-03 -3.9744e-02 -1.0976e-04 12 1 1 12 4 4 35.57 15.65 0.25 -0.03974 -0.04055 537 99 1 5 0 94.040 19.12 15.00 15.65 8.96 34.60 14.1 804.54 -76549 -82134 -73378 -66858 -75273 -72043 -72443 -66647 -68467 -56283 -57581 -49869 -30754 -27452 -14074 -22834 -11867 -13725 -4934 -10209 -8982 -7771 -8550 -7449 -10825 -5189 -10873 -7366 -5568 -4189 -2253 -1639 -358 -3010 -1065 -2816 -1795 -1342 418 -774 -976 654 -767 1006 533 917 710 571 1331 1343 1864 1092 2102 1325 1032 888 497 587 272 1214 1258 1904 1643 1100 941 1017 711 666 1281 823 304 -245 -386 -220 -220 91 -107 -14 -59 -184 -364 -1008 -1518 -1260 -1187 -1087 -491 -366 -392 81 564 714 813 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