File name: Pandora159s1_Wakkerstroom_20211127_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033931.7Z 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_20211127_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: 20211127 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 20211127T060435.5Z 8001.253189 235 1 51.27 2 50.68 95.85 53.63 320.67 0.00 1 0.00 1 0 25 2.184e-02 1.274e-02 2.024e-02 7.392e-03 1.983617e-01 3.693071e-03 2.153025e-03 -6.000000e+00 1.241611e-02 228.11 -2.00 3.06 -2.00 317.31 0.00e+00 -2.883041e-05 5.136757e-04 1.434492e-04 -6.000000e+00 5.445161e-04 280.40 -2.00 20.00 -2.00 316.58 0.00e+00 1.575 0.000 302.00 328.00 3 3.8613e+00 9.7615e-03 1.5691e-02 -6.0000e+00 3.0903e-02 -1.7131e-02 1.0975e-02 9.0649e-03 -6.0000e+00 3.3580e-02 3.4474e-02 6.5009e-03 4.4571e-03 -6.0000e+00 1.9969e-02 -1.4351e-02 3.1422e-03 1.2600e-03 -6.0000e+00 8.4595e-03 2.4758e-03 -2.0666e-04 2.1579e-04 1.4952e-05 -6.0000e+00 5.8389e-04 -1.1444e-03 12 8 8 10 0 0 99.51 18.75 0.61 -0.00114 -0.00270 1995 429 3 8 0 24.000 14.99 18.75 16.56 21.17 21.17 18.1 873.62 -21 -5203 -199 -10362 2007 -4512 4039 -981 5175 -3495 4120 325 189 848 1203 720 -2182 2760 -4107 3088 -3610 3704 1064 2920 -544 29 748 1153 3310 1525 5978 2413 4521 -3444 923 161 3056 -475 2206 -1759 -3293 -1481 -2336 -951 -3322 172 -3511 710 -1901 2997 222 -707 670 202 763 2163 1799 -758 2163 138 3552 -654 932 -663 -569 502 1457 1231 1827 1431 -1941 -151 -1843 921 -1371 1655 1774 4509 3084 1346 732 -1562 -1806 -1388 -120 -1796 120 -1796 22 -899 624 869 2385 2583 1770 1503 -317 675 -1367 224 -875 1154 408 2305 -1434 -275 -3463 -249 310 -447 -614 -1595 -43 -893 1445 793 1736 899 723 -536 -749 -171 -278 318 624 987 1156 2956 788 1179 40 425 103 696 -305 -877 188 -558 -521 -1073 307 -664 807 -3 -813 -30 -1600 248 -571 500 -142 782 -592 641 53 34 169 267 173 -551 685 -1123 816 -1032 980 294 833 -169 9 235 339 892 408 1591 709 1386 -1153 279 48 960 -179 959 -910 -1870 -861 -1402 -569 -2024 101 -2088 393 -1047 1575 125 -428 419 133 514 1464 1241 -534 1458 94 2425 -497 748 -570 -485 389 1026 844 1320 1169 -1781 -142 -1768 830 -1185 1258 1215 2843 2046 1012 616 -1467 -1806 -1445 -131 -2147 149 -2340 28 -1124 715 904 2223 2320 1682 1563 -370 857 -1862 297 -1100 1313 448 2580 -1804 -362 -4881 -356 457 -705 -1015 -2675 -68 -1328 1923 999 2153 1175 1012 -815 -1175 -264 -420 459 854 1286 1428 3572 1032 1632 59 632 155 1081 -504 -1535 335 -1022 -962 -1962 535 -1132 1326 SS 20211127T060934.9Z 8001.256654 237 1 0.80 2 49.58 95.36 54.31 319.49 0.00 1 0.00 1 0 17 1.256e-02 9.481e-03 7.958e-03 5.286e-03 1.965873e-01 2.693419e-03 2.128228e-03 -6.000000e+00 7.138427e-03 228.11 -2.00 3.06 -2.00 315.09 0.00e+00 2.773308e-04 2.339296e-04 3.567146e-05 -6.000000e+00 3.130659e-04 280.40 -2.00 20.00 -2.00 314.51 0.00e+00 1.539 0.000 302.00 328.00 3 2.9294e+00 6.9164e-03 1.5360e-02 -6.0000e+00 1.7767e-02 2.7294e-02 7.6935e-03 8.8793e-03 -6.0000e+00 1.9307e-02 -5.8841e-03 4.4026e-03 4.3709e-03 -6.0000e+00 1.1481e-02 -8.6065e-04 1.9533e-03 1.2445e-03 -6.0000e+00 4.8634e-03 6.4804e-03 -4.6414e-04 1.4686e-04 1.6104e-05 -6.0000e+00 3.3573e-04 -6.8426e-04 12 9 9 12 1 1 999.00 18.75 0.36 -0.00068 -0.00417 1 34 4 8 0 310.230 15.00 18.75 16.94 21.17 21.17 18.2 876.65 -3274 2459 -3799 -1083 -2931 1309 1922 705 -483 -2385 1073 1528 3007 -350 973 -450 -474 -2533 -235 337 -919 2066 2224 1854 151 1260 -1448 502 184 3121 1631 2254 1315 -2270 -773 7 699 -27 -723 -2824 -2228 -1749 -354 745 -850 -1497 -526 38 -1218 1964 88 81 80 1655 415 1498 175 1051 92 977 1500 1348 1324 1014 -1114 236 200 1573 1654 371 -90 -630 -1231 -344 -461 -223 -294 407 964 -554 -781 -1555 -1762 -679 -1391 103 -435 -870 -862 -156 729 17 1302 2243 1136 -45 323 488 -76 -697 -516 12 871 464 -1239 -246 -563 -649 -521 -524 -332 -734 -613 380 883 1125 1740 732 520 -877 -653 -413 246 -141 518 -64 1885 3034 698 -298 4 712 -55 127 -577 -145 -134 -98 -690 -357 -547 35 -195 -1050 801 -1298 -342 -857 357 544 220 -164 -841 363 520 1083 -141 422 -208 -223 -1228 -115 167 -466 1019 1105 953 82 686 -796 260 91 1486 805 1156 709 -1265 -408 4 378 -16 -489 -2113 -1748 -1402 -286 600 -688 -1211 -417 30 -931 1468 69 66 67 1401 359 1301 155 921 80 844 1317 1235 1265 1002 -1107 221 178 1359 1478 360 -92 -660 -1296 -353 -456 -207 -256 342 822 -508 -766 -1617 -1895 -745 -1593 122 -533 -1085 -1077 -190 849 19 1352 2265 1187 -49 377 602 -98 -883 -631 14 981 537 -1514 -308 -725 -855 -701 -728 -472 -1053 -857 508 1118 1372 2107 913 677 -1193 -903 -568 332 -186 665 -81 2265 3615 870 -387 5 953 -74 175 -822 -213 -199 -147 -1045 -534 -806 50 -278 SS 20211127T061412.9Z 8001.259871 240 1 0.93 2 48.55 94.91 54.96 318.41 0.00 1 0.00 1 0 17 1.017e-02 7.962e-03 1.884e-03 1.280e-03 1.928996e-01 6.525398e-04 2.081445e-03 -6.000000e+00 5.779665e-03 228.11 -2.00 3.06 -2.00 314.99 0.00e+00 2.150048e-05 5.553857e-05 2.342206e-05 -6.000000e+00 2.534782e-04 280.40 -2.00 20.00 -2.00 314.43 0.00e+00 1.508 0.000 302.00 328.00 3 7.7411e-01 1.6749e-03 1.5043e-02 -6.0000e+00 1.4385e-02 1.4705e-02 1.8635e-03 8.6809e-03 -6.0000e+00 1.5632e-02 -4.2330e-03 1.0650e-03 4.2734e-03 -6.0000e+00 9.2959e-03 -1.6270e-04 4.6976e-04 1.1951e-03 -6.0000e+00 3.9376e-03 5.8058e-02 -4.2050e-04 3.5584e-05 1.5484e-05 -6.0000e+00 2.7184e-04 -4.0704e-04 12 9 1 12 1 1 86.06 18.75 0.29 -0.00041 -0.00357 18 323 2 8 0 32.160 15.00 18.75 17.36 21.17 21.17 18.3 879.11 -2049 -1636 -2965 -3280 -970 -118 1343 2111 839 -762 267 1755 310 -10 531 -701 303 318 303 479 -118 1228 1674 771 635 146 -1119 -328 1194 2193 2087 2835 1366 -1504 -450 551 252 461 -137 -1419 -1902 -1123 -1476 -1316 -818 -1251 -1017 -436 -782 758 641 765 764 492 522 1166 397 383 940 1026 1428 1028 826 257 -1019 79 91 1094 1778 150 -322 -478 -401 -46 -274 521 650 1147 1525 -369 -641 -1367 -2199 -1052 -1070 -1181 -723 -679 -298 -474 579 271 1034 1931 1133 741 759 200 -806 -664 -225 -235 739 677 -910 -788 -696 -641 -62 -103 -272 -398 -61 102 433 1199 943 771 235 -520 -754 -373 -151 59 1002 610 1196 1580 611 273 28 -88 133 402 -217 -360 -141 -158 -508 -232 -161 -428 -133 -671 -573 -1055 -1080 -297 -34 402 655 292 -279 94 616 121 -4 243 -329 144 155 152 247 -62 629 865 397 344 82 -626 -170 598 1051 1038 1493 734 -840 -246 290 136 275 -93 -1071 -1489 -907 -1222 -1092 -671 -1024 -807 -348 -606 575 508 614 644 415 450 1016 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