File name: Pandora53s1_Potchefstroom-METSI_20230924_L2Fit_fout2c2d20230223p1-8.txt File generation date: 20240824T151912.0Z 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_20230924_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: 20230924 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 20230924T050454.7Z 8667.211745 171 1 51.26 2 76.17 83.37 126.82 185.79 0.00 1 0.00 1 0 25 2.346e-01 1.168e-02 1.456e-01 4.048e-03 5.123490e-01 2.170952e-03 5.147533e-03 -6.000000e+00 1.410707e-01 227.89 -2.00 3.06 -2.00 319.95 0.00e+00 3.561976e-04 7.062001e-04 3.984776e-04 -6.000000e+00 6.527978e-03 279.92 -2.00 20.00 -2.00 319.34 0.00e+00 4.091 0.000 302.00 328.00 3 4.8960e+00 6.3376e-03 4.1691e-02 -6.0000e+00 3.5076e-01 -5.7562e-02 7.6582e-03 2.3644e-02 -6.0000e+00 3.8029e-01 -1.5525e-02 6.6429e-03 1.1720e-02 -6.0000e+00 2.2527e-01 -3.4176e-03 3.4093e-03 3.5893e-03 -6.0000e+00 9.4780e-02 7.1706e-05 5.1871e-04 1.2626e-04 4.4194e-05 -6.0000e+00 7.2895e-03 1.5818e-02 0.0000e+00 12 8 8 10 0 0 93.60 17.36 0.68 0.01582 0.01972 19 4 1 5 0 2697.400 20.46 15.01 17.36 21.32 47.10 15.0 887.58 -59936 -95302 -69198 900000 -31318 86900 900000 14509 -23036 -769 900000 -27206 183994 21650 24138 -65504 14503 -4540 30263 11033 6995 25010 21269 -17661 -7714 -6939 -34457 19201 28792 12063 7989 17435 -826 -4330 -5608 -15649 -6150 -8597 3418 -2293 -1065 -908 -924 5671 -2751 4887 -518 -1070 -151 3902 2446 1345 790 5551 -22 790 3989 5053 1506 219 -846 4137 1526 297 2274 2003 2372 702 621 2576 -2920 -2353 -1897 -72 1519 -799 551 -10724 -915 1223 -1435 -284 -1514 -1496 -2237 -273 124 367 -249 1202 854 2096 1636 1063 3543 278 945 505 -37 604 -857 -935 -398 -388 -1546 -817 -1628 -978 80 -341 -48 -385 175 -12 772 235 632 -24 481 -298 -105 -711 -387 622 413 143 477 1802 1101 813 134 190 -294 -210 -831 403 27 -424 -135 -77 -204 82 -99 -847 -2193 -1297 900000 -371 343 900000 146 -348 -11 900000 -555 726 399 524 -4049 448 -185 935 435 297 905 839 -1115 -477 -449 -2980 947 1269 658 512 1169 -75 -429 -555 -1729 -679 -1150 492 -382 -197 -181 -192 1133 -605 1010 -114 -241 -35 910 630 386 249 1796 -8 275 1485 1866 567 83 -311 1569 660 142 1108 958 1101 337 323 1485 -1827 -1537 -1234 -44 907 -443 280 -6036 -505 758 -982 -217 -1279 -1264 -2035 -260 124 377 -258 1191 797 1798 1339 880 3093 284 1026 619 -46 758 -1037 -1102 -435 -425 -1818 -1013 -2029 -1288 112 -499 -76 -640 288 -19 1148 335 940 -36 745 -488 -173 -1160 -611 938 598 210 677 2573 1628 1330 228 341 -529 -397 -1679 810 56 -904 -289 -161 -406 162 -192 SS 20230924T052025.8Z 8667.222521 177 1 50.16 2 72.73 81.52 127.05 181.70 0.00 1 0.00 1 0 25 7.876e-02 9.657e-03 4.746e-02 3.800e-03 4.232005e-01 1.990210e-03 4.366444e-03 -6.000000e+00 4.699990e-02 227.89 -2.00 3.06 -2.00 319.28 0.00e+00 2.232142e-04 5.152711e-04 4.805641e-04 -6.000000e+00 2.057731e-03 279.92 -2.00 20.00 -2.00 318.64 0.00e+00 3.320 0.000 302.00 328.00 3 5.3616e+00 5.5623e-03 3.4051e-02 -6.0000e+00 1.1681e-01 -4.0464e-02 6.4577e-03 1.9519e-02 -6.0000e+00 1.2656e-01 -3.9881e-03 4.8758e-03 9.5286e-03 -6.0000e+00 7.5280e-02 -7.6146e-03 2.5470e-03 2.7715e-03 -6.0000e+00 3.1646e-02 9.1672e-05 2.6976e-05 1.1883e-04 3.3923e-05 -6.0000e+00 2.3920e-03 1.7920e-02 0.0000e+00 12 8 8 10 0 0 99.96 17.52 0.45 0.01792 0.01812 31 6 1 5 0 1617.790 20.67 15.01 17.52 23.05 48.90 15.0 897.87 -12590 -41425 -31417 24037 -2949 -5406 33909 2427 -181 -3223 -1650 -5732 33084 -3980 1586 -34212 -4340 -3707 10608 3419 4642 3518 11814 -1834 -2268 2769 -9035 18178 8135 10497 3742 9902 -564 -5512 -3547 -9520 -5008 -6063 -1755 -4727 -434 -1212 -2149 4544 -1803 3077 -2621 396 -418 -75 2010 -201 1574 2662 1247 385 1616 2379 1700 2225 -1348 3054 815 1212 1537 1104 2177 455 1113 995 -421 -2781 -992 -475 235 -636 -304 -7063 -1626 1259 -1078 -161 -1765 -1104 -2142 -663 35 -69 440 688 958 1736 2091 1040 2139 766 1019 418 169 462 -642 -1260 -78 -364 -983 -1028 -593 -876 -437 -62 -20 -135 27 471 39 14 160 237 303 -212 -322 -520 -528 -398 585 740 540 1561 429 1125 219 278 -113 190 -709 224 70 -446 -132 -164 -188 70 -182 -305 -1463 -1048 459 -69 -127 597 64 -5 -108 -55 -218 1025 -207 90 -3064 -324 -295 777 282 388 302 972 -180 -240 292 -1081 1648 790 1019 415 1160 -81 -847 -524 -1496 -822 -1179 -383 -1250 -120 -359 -670 1351 -576 942 -851 125 -135 -25 705 -77 636 1137 554 178 757 1108 785 1016 -658 1537 450 721 934 650 1218 260 677 664 -306 -2171 -762 -349 163 -404 -181 -4396 -1018 848 -828 -134 -1589 -1049 -2151 -686 38 -76 482 743 987 1679 1892 941 2040 809 1162 525 224 611 -817 -1517 -89 -418 -1183 -1316 -780 -1200 -624 -93 -32 -219 45 743 59 20 232 347 462 -336 -521 -831 -836 -607 860 1061 746 2158 631 1759 364 477 -199 342 -1341 435 141 -905 -267 -331 -371 132 -340 SS 20230924T053204.2Z 8667.230604 180 1 51.13 2 70.15 80.08 127.07 178.63 0.00 1 0.00 1 0 25 2.690e-02 5.927e-03 1.433e-02 2.062e-03 3.734496e-01 1.073404e-03 3.860948e-03 -6.000000e+00 1.605787e-02 227.89 -2.00 3.06 -2.00 318.56 0.00e+00 4.033577e-04 2.226342e-04 1.571245e-04 -6.000000e+00 7.027712e-04 279.92 -2.00 20.00 -2.00 317.90 0.00e+00 2.915 0.000 302.00 328.00 3 4.7701e+00 2.9116e-03 2.9839e-02 -6.0000e+00 3.9910e-02 -5.9183e-02 3.3176e-03 1.6908e-02 -6.0000e+00 4.3236e-02 6.6491e-03 2.2619e-03 8.3042e-03 -6.0000e+00 2.5717e-02 -8.7871e-03 1.1755e-03 2.4234e-03 -6.0000e+00 1.0816e-02 2.4704e-04 2.1661e-04 6.4046e-05 2.9493e-05 -6.0000e+00 8.1687e-04 1.4950e-02 0.0000e+00 10 0 0 10 0 0 99.98 17.65 0.27 0.01495 0.01658 52 10 1 5 0 983.130 20.77 15.01 17.65 24.02 47.90 15.1 905.27 -5139 -18064 -12077 935 -7957 -5434 1263 -1468 -3765 -2292 722 -1348 7658 6937 1702 -9375 -1858 -731 2053 -416 1104 807 3133 -3205 -927 -229 -308 1973 3268 3276 1203 3931 627 -1856 -2887 -3195 -1166 -3125 390 -1922 -1631 -862 -1497 -211 -1203 10 -1158 -707 -1237 702 511 483 1037 1593 1305 632 991 1434 784 648 281 1807 991 961 689 922 408 351 674 699 209 -583 -248 -661 669 -61 -488 -2753 -536 372 -514 -650 -1534 -1017 -1249 -570 -414 -287 240 435 621 601 886 576 1198 1098 234 544 -171 187 -327 -638 -391 -368 -814 -435 -969 -850 -27 -110 105 -116 31 189 -45 324 73 322 -104 -46 -352 -78 -314 64 548 445 969 773 684 741 456 339 -279 81 -371 13 12 -159 -61 -248 -362 -310 -14 -211 -941 -615 40 -348 -227 52 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