File name: Pandora159s1_Wakkerstroom_20220112_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035251.1Z 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_20220112_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: 20220112 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 20220112T061423.6Z 8047.259996 125 1 47.85 2 52.91 97.43 167.32 143.72 0.00 1 0.00 1 0 17 2.310e-02 9.774e-03 1.807e-02 7.319e-03 1.971440e-01 3.660891e-03 2.081423e-03 -6.000000e+00 1.312840e-02 227.64 -2.00 3.06 -2.00 316.87 0.00e+00 1.848572e-04 4.669642e-04 1.303294e-04 -6.000000e+00 5.811461e-04 282.40 -2.00 20.00 -2.00 316.14 0.00e+00 1.654 0.000 302.00 328.00 3 6.5987e+00 9.6054e-03 1.6071e-02 -6.0000e+00 3.2618e-02 6.4051e-02 1.0787e-02 8.8184e-03 -6.0000e+00 3.5430e-02 5.8126e-03 6.3106e-03 4.3312e-03 -6.0000e+00 2.1103e-02 -6.5176e-03 3.0092e-03 1.2200e-03 -6.0000e+00 8.9755e-03 1.4816e-04 1.1005e-04 2.1061e-04 1.4032e-05 -6.0000e+00 6.1762e-04 -8.2938e-03 12 8 8 10 0 0 99.86 19.38 0.93 -0.00829 -0.00747 14 3 1 8 0 3417.200 15.00 19.38 24.24 21.69 21.58 20.0 912.54 -5753 -6749 2121 -6382 10475 2713 4243 10030 4059 4694 -4017 1207 3483 4589 -5668 3288 2288 605 604 3523 -3169 -2034 -698 -1751 -889 -538 -1994 -512 -2017 978 5288 2057 929 304 -2972 3568 -1778 -1900 4339 -2571 -1281 -164 -594 361 38 -3577 -1702 -604 -233 -216 1323 -751 609 798 79 1430 -807 20 1057 2414 2641 1451 1226 1796 -1118 463 223 224 2281 -558 -148 -1377 501 -933 -1440 228 -500 -1148 2182 -330 207 -1266 -1511 426 102 622 -859 662 649 -593 870 458 -392 1443 1225 -1108 -287 -278 -386 -725 -300 -405 1334 -384 -1908 -879 -406 -1287 -40 229 1002 748 -521 845 -716 542 722 -859 419 -543 -358 348 258 -37 1403 733 882 790 -182 221 -497 -464 -1087 -63 86 646 -185 1164 835 -332 -167 -952 -838 -981 -1258 364 -1109 1373 363 588 1476 702 837 -764 220 679 1000 -1529 875 636 174 180 1050 -1025 -646 -221 -587 -311 -193 -720 -170 -633 290 1558 666 325 109 -1022 1120 -637 -793 2026 -1480 -786 -104 -387 234 24 -2379 -1086 -369 -137 -126 798 -490 412 563 58 1043 -610 15 767 1725 1937 1147 1043 1601 -1014 382 169 163 1720 -487 -140 -1372 490 -897 -1304 184 -365 -795 1509 -260 181 -1222 -1546 448 115 742 -1094 856 843 -752 1014 487 -384 1334 1186 -1197 -338 -357 -522 -974 -377 -471 1455 -442 -2409 -1157 -555 -1837 -59 353 1606 1209 -821 1224 -963 678 894 -1121 581 -806 -547 525 380 -53 1877 942 1073 955 -234 302 -710 -675 -1609 -96 136 1073 -316 2019 1457 -576 -282 -1564 -1342 SS 20220112T074502.1Z 8047.322941 169 1 1.66 2 32.84 87.93 150.98 104.22 0.00 1 0.00 1 0 17 1.092e-02 9.109e-03 5.913e-03 4.691e-03 1.388372e-01 2.412432e-03 1.508177e-03 -6.000000e+00 6.204702e-03 227.64 -2.00 3.06 -2.00 314.07 0.00e+00 2.139272e-04 1.755870e-04 1.571896e-05 -6.000000e+00 2.747022e-04 282.40 -2.00 20.00 -2.00 313.57 0.00e+00 1.190 0.000 302.00 328.00 3 3.8342e+00 6.1382e-03 1.1506e-02 -6.0000e+00 1.5416e-02 2.8883e-02 6.7957e-03 6.2638e-03 -6.0000e+00 1.6746e-02 3.4599e-03 3.9036e-03 3.0802e-03 -6.0000e+00 9.9743e-03 -3.4140e-03 1.6874e-03 8.7758e-04 -6.0000e+00 4.2414e-03 3.9158e-03 -1.8960e-04 1.2960e-04 1.2075e-05 -6.0000e+00 2.9196e-04 -7.0391e-03 12 9 1 12 1 1 999.00 19.41 0.26 -0.00704 -0.00846 1 16 1 8 0 653.530 15.00 19.41 25.13 21.69 21.69 19.6 913.98 -1598 -2487 -2438 -2911 504 41 1939 2198 2282 -22 -781 290 -859 462 -845 -777 -4 592 1747 1344 1347 -288 1964 759 436 371 -237 138 468 2272 1268 3112 1159 -2571 -99 -255 -201 768 -659 -1919 -1742 -1616 -838 -1713 112 -1250 -1080 -288 -1322 998 -318 1004 834 1460 -823 1816 553 1030 324 708 1878 1807 1019 103 -1056 -143 485 91 1716 -117 -355 -96 -542 -133 -847 708 783 486 1344 619 -1193 -842 -2020 -681 -1187 -855 -951 -280 326 -1023 182 290 646 1020 1325 387 745 131 -1052 -654 -346 143 964 979 -1450 -996 -829 -1024 80 153 -744 -280 567 350 775 950 33 1038 1000 -154 -803 -57 -264 -212 735 829 1632 1777 870 581 58 -211 -338 -33 -283 -368 223 -179 -692 -395 442 -510 -686 -725 -1189 -1161 -1319 204 16 766 941 1044 -11 -365 134 -420 241 -475 -455 -2 350 1042 818 828 -177 1198 478 283 246 -156 86 278 1296 740 1852 721 -1646 -60 -151 -125 521 -502 -1602 -1518 -1439 -751 -1548 100 -1116 -946 -245 -1103 814 -267 866 738 1318 -761 1670 515 955 298 650 1740 1740 1025 107 -1093 -140 445 81 1568 -116 -370 -103 -579 -139 -861 671 695 414 1156 567 -1175 -871 -2169 -743 -1348 -1011 -1162 -347 404 -1252 212 319 668 1023 1355 417 846 157 -1307 -804 -410 162 1057 1099 -1728 -1224 -1040 -1316 105 204 -1023 -384 755 446 935 1102 38 1227 1233 -199 -1062 -75 -343 -269 902 990 1875 2027 1027 708 72 -266 -429 -42 -376 -504 309 -252 -981 -554 608 -693 -922 SS 20220112T084802.3Z 8047.366693 203 1 1.43 2 18.98 76.80 137.82 93.94 0.00 1 0.00 1 0 17 9.634e-03 7.979e-03 2.264e-03 1.883e-03 1.247632e-01 9.717039e-04 1.378823e-03 -6.000000e+00 5.473833e-03 227.64 -2.00 3.06 -2.00 313.72 0.00e+00 9.836922e-05 6.662603e-05 1.548667e-05 -6.000000e+00 2.423417e-04 282.41 -2.00 20.00 -2.00 313.26 0.00e+00 1.057 0.000 302.00 328.00 3 2.6536e+00 2.4660e-03 1.0287e-02 -6.0000e+00 1.3600e-02 2.1401e-02 2.7252e-03 5.6715e-03 -6.0000e+00 1.4773e-02 -1.2891e-03 1.5692e-03 2.7992e-03 -6.0000e+00 8.7993e-03 -2.9223e-04 6.7388e-04 7.9204e-04 -6.0000e+00 3.7419e-03 1.4711e-02 -3.0308e-04 5.1868e-05 1.1417e-05 -6.0000e+00 2.5756e-04 -7.2140e-03 12 9 1 12 1 1 85.53 19.41 0.28 -0.00721 -0.00949 6 61 1 8 0 174.860 15.00 19.41 25.28 21.69 21.69 20.2 918.51 -923 -1565 -1791 -3511 -136 199 2244 1600 1206 -665 -94 1298 -53 1151 269 -735 -143 266 198 594 -336 881 1425 748 628 -466 -1022 -209 1089 2370 3023 1946 1520 -1724 -484 1143 -61 176 -436 -1866 -1498 -1269 -1363 -982 -635 -899 -744 -353 -860 318 630 456 714 422 667 906 473 393 850 823 1385 748 865 363 -955 307 143 691 1963 363 -429 -36 -607 -206 -326 234 562 1280 1021 -754 -689 -1535 -2047 -873 -814 -1111 -543 -893 -301 -538 195 11 694 1565 1144 913 550 318 -742 -70 26 47 497 788 -772 -725 -737 -645 -192 -110 -232 -360 130 255 286 963 870 183 404 -385 -672 -255 -50 228 904 652 1113 1834 748 564 -57 -440 87 366 -259 -257 -56 -74 -544 -499 -149 -668 -24 -468 -828 -949 -1776 -62 87 994 765 616 -350 -48 656 -28 650 162 -463 -90 169 127 387 -222 573 929 501 432 -328 -715 -139 683 1432 1840 1227 988 -1149 -305 700 -39 124 -342 -1599 -1337 -1158 -1258 -905 -582 -821 -666 -307 -733 266 536 400 641 388 620 847 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