File name: Pandora159s1_Wakkerstroom_20211108_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033836.6Z 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_20211108_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: 20211108 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 20211108T034759.0Z 7982.158322 47 1 49.85 2 81.42 104.33 113.49 138.57 0.00 1 0.00 1 0 25 5.311e-01 1.573e-02 3.577e-01 9.429e-03 7.761549e-01 5.230132e-03 7.499797e-03 -6.000000e+00 3.022580e-01 228.20 -2.00 3.06 -2.00 321.80 0.00e+00 6.618696e-03 2.788736e-03 1.013014e-03 -6.000000e+00 1.387369e-02 279.55 -2.00 20.00 -2.00 321.31 0.00e+00 6.334 0.002 302.00 328.00 3 2.5613e+00 1.9052e-02 6.4003e-02 -6.0000e+00 7.5277e-01 3.5257e-01 2.7012e-02 4.0830e-02 -6.0000e+00 8.1844e-01 -5.1594e-01 2.7670e-02 2.0048e-02 -6.0000e+00 4.8650e-01 2.1404e-01 1.2861e-02 9.3467e-03 -6.0000e+00 2.0628e-01 1.0073e-04 -1.8631e-03 2.6255e-04 1.0286e-04 -6.0000e+00 1.4331e-02 9.6237e-05 12 9 8 11 8 0 98.63 19.07 0.35 0.00010 -0.01390 38 8 4 8 0 1310.470 14.99 19.07 18.30 21.38 21.38 18.0 884.44 -30714 -192757 -173103 -105568 -222854 -130235 -198990 -187907 -12563 145565 900000 -216401 -46654 -141573 900000 -30003 43205 62441 -39657 -115858 -55924 -11348 95364 -22834 34801 -40629 -44365 70666 -59323 56210 -19542 29736 24635 3169 -24166 301 62192 -9295 -14868 36510 -7743 24558 46389 1747 24096 4486 22850 12397 15040 22872 6922 28241 11369 17046 4494 8175 5129 13320 1535 -21 13580 5184 17064 15734 9939 6942 13307 2400 8149 5173 5420 4375 5635 -1081 3846 1076 -4813 5771 2400 2284 -1228 1280 -3345 -457 502 -499 -2468 -774 -2765 -327 -704 -2552 1502 -1658 2561 -1822 1287 -3224 -1298 -293 -197 -1708 1533 -186 -2347 -2362 2135 -2220 -979 157 -1520 -1053 -575 -181 359 1146 435 203 689 577 1094 896 79 145 1858 -309 1038 1256 647 -214 888 793 359 0 -802 -40 278 447 -1207 -37 -494 275 -393 -282 -3225 -2544 -970 -4598 -1197 -3229 -3009 -115 1338 900000 -6175 -429 -3348 900000 -375 397 574 -732 -4621 -1264 -164 877 -401 372 -925 -1051 650 -1587 548 -481 558 562 95 -902 9 1067 -370 -755 1338 -482 1204 1937 115 1294 298 1314 826 1034 1574 617 2312 1198 1843 580 1055 697 1655 206 -3 1632 747 2518 2678 1912 1365 2449 511 1823 1371 1572 1334 1672 -320 988 255 -1133 1265 619 706 -464 544 -1630 -231 266 -284 -1504 -476 -1736 -193 -391 -1361 749 -889 1501 -1309 1048 -3153 -1368 -309 -196 -1540 1216 -149 -2055 -2193 2000 -2328 -1124 202 -2226 -1651 -908 -278 526 1608 619 303 1081 939 1740 1366 117 209 2543 -418 1342 1698 1000 -380 1728 1653 791 0 -2021 -105 743 1209 -3301 -97 -1211 626 -862 SS 20211108T040543.9Z 7982.170647 56 1 17.72 2 77.59 102.46 110.92 135.55 0.00 1 0.00 1 0 25 1.847e-01 7.274e-03 1.266e-01 3.198e-03 5.826897e-01 1.656932e-03 5.785854e-03 -6.000000e+00 1.050342e-01 228.20 -2.00 3.06 -2.00 320.55 0.00e+00 2.016352e-03 6.409886e-04 6.639094e-04 -6.000000e+00 4.588809e-03 279.55 -2.00 20.00 -2.00 319.97 0.00e+00 4.525 0.001 302.00 328.00 3 2.3121e+00 5.0764e-03 4.5634e-02 -6.0000e+00 2.6156e-01 2.9030e-02 6.5038e-03 2.7620e-02 -6.0000e+00 2.8426e-01 -3.8579e-02 6.3202e-03 1.3714e-02 -6.0000e+00 1.6894e-01 7.7734e-03 3.1661e-03 4.7554e-03 -6.0000e+00 7.1482e-02 6.6664e-04 -8.0330e-04 8.9077e-05 4.5460e-05 -6.0000e+00 4.9392e-03 2.7896e-04 12 9 1 12 1 1 93.06 19.06 0.21 0.00028 -0.00576 34 21 4 8 0 501.230 14.99 19.06 19.06 21.38 21.38 18.1 887.97 -54162 -66544 -88485 -26607 -67744 -22233 -85306 36550 -85600 -34444 -52437 -25804 -18395 -28440 -31966 -19821 -20633 -5583 9245 -2535 8728 -5835 -1153 -10118 6565 -9739 -10464 -14848 -22868 -3215 -6478 6740 -3811 7665 -11552 3417 -5239 4873 3620 -1039 -2561 -3263 -2786 -4186 5078 -2456 1659 480 2047 1096 2821 762 2199 1820 -1 -265 400 143 -776 2349 -229 3410 612 437 615 2380 2094 1535 2056 584 553 -370 -35 -997 859 481 1491 685 975 -337 206 -1056 -2026 -1044 -1880 -1291 -332 -29 97 -416 990 1083 1265 1488 1553 221 799 -208 -977 -395 -171 -523 1418 620 -1744 -932 -1211 -746 -282 -66 -74 -188 -157 474 239 1274 1237 546 40 -854 -617 -227 -15 -548 661 269 729 1666 677 -212 -12 165 46 343 -479 -460 106 -93 -557 -119 -74 55 440 -384 -623 -1104 -173 -615 -126 -992 160 -1310 -342 -654 -278 -229 -500 -725 -472 -556 -142 220 -72 228 -177 -35 -367 220 -406 -445 -640 -1050 -129 -316 342 -247 472 -829 209 -386 390 331 -119 -334 -461 -411 -641 718 -382 252 76 330 190 532 164 509 458 0 -75 116 41 -220 637 -66 1041 217 173 254 936 802 605 891 296 285 -201 -19 -551 426 215 612 284 448 -185 121 -711 -1502 -810 -1572 -1145 -307 -27 92 -380 829 842 932 1116 1292 214 884 -246 -1259 -505 -204 -561 1477 659 -1903 -1068 -1462 -953 -390 -102 -116 -310 -257 738 375 1884 1834 853 62 -1403 -1007 -356 -24 -859 982 384 996 2329 1069 -354 -22 314 91 718 -1014 -1025 239 -214 -1288 -263 -154 116 890 SS 20211108T051441.6Z 7982.218537 87 1 49.16 2 62.46 95.38 99.78 125.51 0.00 1 0.00 1 0 17 5.640e-02 1.493e-02 7.769e-02 1.434e-02 3.052388e-01 7.197361e-03 3.162639e-03 -6.000000e+00 3.207978e-02 228.20 -2.00 3.06 -2.00 318.55 0.00e+00 1.422322e-04 1.399923e-03 1.116686e-04 -6.000000e+00 1.401422e-03 279.55 -2.00 20.00 -2.00 317.84 0.00e+00 2.152 0.000 302.00 328.00 3 6.4903e+00 1.9502e-02 2.2301e-02 -6.0000e+00 7.9887e-02 6.6008e-02 2.2225e-02 1.3710e-02 -6.0000e+00 8.6810e-02 -1.5177e-02 1.4588e-02 6.7819e-03 -6.0000e+00 5.1594e-02 -3.6112e-03 7.5148e-03 1.9237e-03 -6.0000e+00 2.1837e-02 9.1240e-05 -6.4448e-04 4.2056e-04 2.1172e-05 -6.0000e+00 1.5080e-03 -1.6761e-03 12 8 8 10 0 0 99.97 19.07 1.31 -0.00168 -0.00652 48 10 2 8 0 1023.840 15.01 19.07 20.48 21.38 21.38 18.0 894.53 23517 29202 2957 4766 -20229 5596 22369 -6525 -13700 6773 -12795 6221 -2685 5275 5647 -8271 -9012 -7691 -11509 5137 6928 11419 8742 -2615 9016 5528 3626 -1843 -1025 -8016 6594 3569 2790 2399 3828 616 -5937 4732 -8307 3536 -3305 -2337 -1181 -204 -825 4912 -1103 -4934 -2142 1034 6137 -197 6467 -175 40 -906 -2228 -2424 1989 1725 2062 2280 959 2374 -1759 2060 -1554 700 1694 -2138 -688 -32 -1201 1543 664 -2246 2696 -1244 1632 1086 224 -1119 -1975 -1336 -552 -1794 -1457 -730 -1071 25 1729 1868 2330 3198 -158 1106 1896 885 -1921 -583 -1671 -102 -249 251 -301 -2245 7040 -1758 -503 267 -550 193 909 -49 1804 486 1813 1504 -946 96 -1719 -76 -335 284 -1333 -307 -871 595 -810 82 -426 -603 620 -534 760 47 -508 496 -251 434 -163 -193 505 1175 1515 200 300 -1446 303 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