File name: Pandora159s1_Wakkerstroom_20211027_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033902.8Z 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_20211027_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: 20211027 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 20211027T041359.2Z 7970.176380 201 1 49.45 2 77.43 98.11 58.35 336.32 0.00 1 0.00 1 0 25 2.924e-01 1.175e-02 2.656e-01 9.476e-03 5.699864e-01 4.984414e-03 5.742126e-03 -6.000000e+00 1.661405e-01 228.13 -2.00 3.06 -2.00 320.83 0.00e+00 2.548692e-03 2.008039e-03 1.214793e-03 -6.000000e+00 7.245321e-03 279.01 -2.00 20.00 -2.00 320.26 0.00e+00 4.474 0.001 302.00 328.00 3 3.8396e+00 1.5589e-02 4.5454e-02 -6.0000e+00 4.1373e-01 1.0075e-01 2.0038e-02 2.8502e-02 -6.0000e+00 4.4977e-01 -7.0451e-02 1.9040e-02 1.3486e-02 -6.0000e+00 2.6724e-01 2.0889e-02 9.4355e-03 4.6405e-03 -6.0000e+00 1.1298e-01 1.4670e-04 -1.2534e-03 2.7303e-04 4.8514e-05 -6.0000e+00 7.8186e-03 3.5163e-03 12 8 8 10 0 0 99.99 18.76 0.56 0.00352 -0.00590 96 21 4 8 0 515.030 15.00 18.76 18.43 21.17 21.17 17.8 885.02 -80356 -57172 -137456 -146167 -87738 49905 29839 -122729 -96476 30556 82644 -74107 -4655 -77561 9892 -43200 -55267 -13123 16866 341 9195 15619 -25772 -11180 -10917 -26156 -4804 -21586 23686 17501 -18839 -3474 22708 13038 3999 9479 23948 -1004 -6917 -3444 -1482 1459 -8120 2449 3445 2053 -1108 12435 4865 17014 6667 10406 8819 459 -2608 1816 3791 1800 -122 3842 930 2961 1831 3810 840 2236 771 984 1085 2021 -1868 -1072 -1380 1513 -420 -42 2362 3132 1592 2190 -3199 -1369 -3357 -120 -8 -1420 -1909 -436 354 804 1186 787 724 1917 815 283 374 -142 -1071 -921 -383 1005 -906 704 -2005 -2062 -1024 33 -959 114 23 -1032 309 647 799 1579 1742 -135 644 -1099 -827 -411 -724 -235 1261 602 1742 2278 490 983 588 126 -285 508 -322 -669 -304 58 -521 -245 513 -624 274 -879 -579 -3149 -3528 -1124 461 276 -2648 -1827 282 764 -1407 -57 -2337 161 -1358 -2153 -376 392 10 248 398 -1006 -412 -434 -1254 -191 -976 690 574 -1003 -188 1087 724 232 517 1249 -78 -694 -393 -185 189 -1205 336 476 293 -165 1672 725 2392 1133 1896 1762 107 -661 457 960 465 -31 935 240 821 577 1309 308 783 265 344 418 883 -928 -550 -705 710 -185 -16 846 1119 636 1017 -1803 -857 -2322 -85 -6 -1158 -1646 -381 306 666 915 568 495 1325 627 250 376 -162 -1337 -1144 -443 1035 -879 681 -2148 -2337 -1206 41 -1294 168 36 -1753 514 1028 1192 2237 2467 -203 1019 -1851 -1384 -665 -1131 -354 1800 829 2285 3062 743 1652 1076 242 -574 1067 -725 -1588 -734 142 -1280 -582 1143 -1331 560 SS 20211027T042001.6Z 7970.180574 203 1 49.67 2 76.10 97.46 58.88 334.91 0.00 1 0.00 1 0 25 4.136e-01 1.631e-02 2.669e-01 1.099e-02 5.136419e-01 5.742105e-03 5.158236e-03 -6.000000e+00 2.350675e-01 228.13 -2.00 3.06 -2.00 320.50 0.00e+00 2.426532e-03 2.098732e-03 8.919944e-04 -6.000000e+00 1.045618e-02 279.01 -2.00 20.00 -2.00 319.91 0.00e+00 4.073 0.000 302.00 328.00 3 4.4984e+00 1.7401e-02 4.1021e-02 -6.0000e+00 5.8538e-01 8.3676e-02 2.1643e-02 2.5174e-02 -6.0000e+00 6.3635e-01 -5.4460e-02 1.9684e-02 1.1924e-02 -6.0000e+00 3.7844e-01 2.2382e-02 9.9530e-03 4.5796e-03 -6.0000e+00 1.6105e-01 1.1059e-04 -6.5928e-04 3.2177e-04 4.2838e-05 -6.0000e+00 1.1090e-02 2.9778e-03 12 8 8 10 0 0 99.96 18.76 0.47 0.00298 -0.00198 63 14 4 8 0 788.270 15.00 18.76 18.58 21.17 21.17 17.7 885.63 -141368 900000 -89311 28466 -109614 141735 -43139 36972 -26837 -2708 29754 -81052 900000 -58854 82223 -44270 24120 -2575 358071 -18770 50342 19849 25581 -3092 34706 11353 -6216 14698 -33016 56271 -778 38593 -18306 37117 -3987 -1641 -6294 36210 -3104 -6067 2139 -2963 15787 -2711 9399 -10721 17993 -1999 5912 11051 139 6199 1959 8294 -5194 2384 -4004 7767 -6281 7002 -1152 4603 2263 2267 1380 2336 2275 -1358 3126 -3511 3059 -3149 1447 -3874 2140 -3202 4891 4315 -1578 -26 -4004 931 -5559 2469 -3368 192 -468 345 -709 460 530 -201 2726 285 2071 6 2019 -968 99 -1624 765 325 1584 1327 -1544 -1154 -1257 -166 -1579 1770 -2004 349 -1076 957 755 833 995 208 585 -577 -1 -1270 956 -1262 2895 -1530 1612 828 1875 -307 308 37 232 199 -1022 272 -22 669 -1526 636 -896 -93 651 -4591 900000 -2129 305 -2796 1518 -624 396 -423 -36 319 -2538 900000 -2231 1011 -2042 645 -95 3836 -907 1305 684 868 -147 1249 531 -345 646 -2217 1726 -46 1839 -1670 2106 -318 -127 -559 2541 -382 -897 324 -501 2339 -489 1523 -2139 2753 -376 1056 1971 30 1397 495 2120 -1579 699 -1275 2203 -1987 1932 -355 1470 823 909 575 925 869 -543 1313 -1799 1610 -1826 795 -2128 1023 -1452 1896 1671 -713 -14 -2464 614 -4218 1831 -2803 165 -427 321 -663 410 440 -155 1944 210 1645 5 2068 -1148 125 -2072 891 346 1545 1324 -1704 -1341 -1534 -212 -2199 2614 -3327 591 -1818 1510 1117 1175 1403 309 919 -956 -1 -2060 1470 -1917 4052 -2150 2109 1117 2771 -511 548 69 447 403 -2213 614 -51 1558 -3617 1436 -1941 -189 1283 SS 20211027T042538.8Z 7970.184477 206 1 10.50 2 74.86 96.85 59.41 333.61 0.00 1 0.00 1 0 25 6.117e-02 6.575e-03 4.585e-02 2.571e-03 4.833923e-01 1.303157e-03 4.956003e-03 -6.000000e+00 3.476643e-02 228.13 -2.00 3.06 -2.00 319.57 0.00e+00 1.063738e-03 3.678608e-04 6.387651e-04 -6.000000e+00 1.516091e-03 279.01 -2.00 20.00 -2.00 318.95 0.00e+00 3.760 0.000 302.00 328.00 3 2.3147e+00 3.6853e-03 3.7790e-02 -6.0000e+00 8.6578e-02 4.3525e-02 4.3638e-03 2.2556e-02 -6.0000e+00 9.4114e-02 -1.6811e-02 3.6125e-03 1.0946e-02 -6.0000e+00 5.5920e-02 -7.5773e-04 1.8985e-03 3.3645e-03 -6.0000e+00 2.3644e-02 1.3287e-03 -6.5354e-04 7.1736e-05 3.4022e-05 -6.0000e+00 1.6359e-03 2.5110e-03 12 9 1 12 1 1 99.92 18.76 0.32 0.00251 -0.00240 28 30 4 8 0 355.990 15.01 18.76 18.72 21.17 21.17 17.7 886.61 -15425 -11826 -22690 6780 -9040 23783 -30881 9332 -35287 3950 -17833 1295 -13687 -14889 -3654 -6814 5618 -932 3955 -10157 13 -5565 -1753 -5652 -543 -4597 -5638 -2797 -432 1132 300 5822 1451 634 -2809 2965 -3237 247 -393 -1433 -1534 -1715 -914 -942 -207 -37 1003 -371 -944 956 864 180 447 719 557 1926 370 1488 -86 1073 238 1253 1581 909 -921 1053 1066 943 1801 525 -492 -468 91 -659 -189 63 1304 902 1160 -583 -418 -1072 -2026 -901 -845 -536 -720 -125 -400 -56 666 389 973 1697 1232 691 444 178 -529 -389 -65 118 1250 374 -1183 -1210 -621 -828 -34 42 -353 -308 -163 277 237 1219 775 231 -181 -928 -816 -210 -146 -357 712 601 1259 1659 586 285 175 48 -3 392 -393 -415 52 52 -426 -252 -196 -22 137 -245 -206 -461 100 -143 270 -638 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