File name: Pandora159s1_Wakkerstroom_20240203_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240203T221922.2Z 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 v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20240203_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: 20240203 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 20240203T051258.2Z 8799.217341 228 1 49.87 2 69.43 98.67 18.61 292.85 0.00 1 0.00 1 0 17 1.154e-01 1.761e-02 1.170e-01 1.367e-02 3.352072e-01 6.852086e-03 3.459174e-03 -6.000000e+00 6.542040e-02 227.68 -2.00 3.06 -2.00 319.11 0.00e+00 4.477998e-03 1.630730e-03 5.613796e-04 -6.000000e+00 2.901883e-03 282.68 -2.00 20.00 -2.00 318.39 0.00e+00 2.819 0.000 302.00 328.00 3 5.9565e+00 1.9028e-02 2.7884e-02 -6.0000e+00 1.6254e-01 6.3744e-02 2.1978e-02 1.7506e-02 -6.0000e+00 1.7668e-01 1.1688e-03 1.5413e-02 7.6962e-03 -6.0000e+00 1.0524e-01 -2.2401e-03 8.0605e-03 4.9728e-03 -6.0000e+00 4.4652e-02 8.6491e-05 -2.7621e-04 4.0055e-04 4.0603e-05 -6.0000e+00 3.0855e-03 8.2729e-03 12 9 8 11 8 0 99.95 19.92 2.22 0.00827 0.00620 42 9 4 8 0 1187.110 14.99 19.92 21.13 22.09 21.98 27.7 865.17 74411 -23379 40958 -50935 -10672 -10470 4564 6547 -2001 30576 -14439 -25336 -14138 18671 -9431 24857 -25997 6408 -1705 14187 -10959 11299 237 14391 4857 4361 12894 3595 11870 -3537 32093 -908 12229 -2589 12363 12640 1549 14090 -14580 10361 -2633 2357 -7810 -5201 -8230 1319 -7773 -133 937 6494 846 1180 5082 429 2974 -1546 2627 -1373 5321 -1281 8115 1193 3426 -699 -1183 2160 -3122 4897 516 -1074 -2430 232 -2587 518 -366 4798 -1597 1442 1837 1604 346 -2314 -1127 -2960 -44 -1760 1185 -2410 1066 247 2278 -812 1648 2801 540 2034 -2120 1590 -2142 843 -99 -416 1031 1922 668 -133 -3826 -1816 947 -630 1007 -2339 1235 -893 2076 -6 370 63 751 -497 113 881 -182 193 -424 -234 908 2592 -627 349 1363 -710 224 1036 157 -480 -311 -1324 1166 -1285 1035 -1230 528 1469 -1301 1273 -3571 -462 -436 173 272 -99 1143 -825 -1717 -1003 1159 -897 1907 -3456 658 -199 1482 -1481 1225 29 1611 624 581 1572 459 1354 -479 3399 -146 1899 -475 1860 1868 278 2624 -4260 2738 -860 770 -2925 -1930 -3175 469 -3005 -47 329 2203 324 488 2140 199 1386 -770 1271 -685 2443 -628 3787 646 1989 -454 -773 1282 -1826 2627 312 -747 -1865 180 -2041 380 -251 2826 -913 776 1057 1054 260 -1973 -1013 -2842 -44 -1900 1309 -2836 1213 272 2281 -768 1409 2348 496 2060 -2499 2000 -2968 1113 -124 -477 1100 2104 803 -170 -5281 -2578 1388 -1006 1678 -4095 2023 -1400 2921 -8 503 90 1137 -806 185 1404 -284 289 -608 -320 1174 3344 -904 539 2201 -1199 385 1836 297 -962 -634 -2777 2391 -2635 1993 -2314 958 SS 20240203T052842.9Z 8799.228274 236 1 49.31 2 65.97 97.06 21.81 287.72 0.00 1 0.00 1 0 25 2.514e-02 7.110e-03 2.869e-02 5.457e-03 2.923657e-01 2.723506e-03 3.071573e-03 -6.000000e+00 1.425933e-02 227.68 -2.00 3.06 -2.00 318.56 0.00e+00 3.096639e-03 5.433562e-04 2.897102e-04 -6.000000e+00 6.325083e-04 282.68 -2.00 20.00 -2.00 317.81 0.00e+00 2.439 0.000 302.00 328.00 3 5.2007e+00 7.3990e-03 2.3982e-02 -6.0000e+00 3.5427e-02 5.0433e-02 8.4483e-03 1.4264e-02 -6.0000e+00 3.8510e-02 -1.6510e-03 5.5103e-03 6.6331e-03 -6.0000e+00 2.2940e-02 -5.4175e-03 2.8402e-03 3.3796e-03 -6.0000e+00 9.7325e-03 2.7039e-04 -1.6471e-04 1.5950e-04 3.0070e-05 -6.0000e+00 6.7254e-04 8.2872e-03 11 9 0 11 8 0 99.99 19.92 0.33 0.00829 0.00705 62 13 1 8 0 790.490 15.00 19.92 22.52 22.09 21.98 27.8 872.53 1622 6044 -8371 -3917 -9840 6099 938 10836 2153 -2412 -3831 -9714 3934 -10264 -5045 -1883 -1149 -1296 2543 2732 309 -3173 -1875 1229 -3349 -1138 -3524 -1696 -1995 2940 2165 5276 -1866 1349 -875 2606 -1396 2489 -457 -3443 -613 728 -1328 -350 1047 1316 217 -820 -345 1135 729 1616 675 -233 5 815 -514 1073 1248 1811 2284 1527 1596 -365 -1063 -176 -349 210 619 23 -57 936 -164 -84 176 306 832 2200 2301 -961 -1798 -685 -2481 -1254 -357 -689 -269 -847 25 -110 878 -140 778 783 1220 468 573 98 -56 -454 -269 -651 638 420 -1107 -617 -921 -833 128 284 -294 -1 118 266 327 1259 320 693 -329 -734 -674 -319 -115 -20 592 267 1099 1942 654 886 348 -87 282 -102 9 -348 -290 2 -344 -35 -85 -371 -84 99 388 -627 -264 -632 325 55 649 153 -185 -296 -833 340 -1189 -643 -257 -164 -193 383 427 50 -527 -314 209 -626 -214 -672 -302 -341 483 388 1007 -413 295 -184 522 -317 641 -144 -1282 -241 296 -568 -150 444 562 92 -347 -144 473 324 767 341 -124 3 452 -293 599 681 986 1286 935 1063 -265 -771 -117 -218 129 406 17 -46 777 -137 -67 131 204 504 1272 1416 -688 -1457 -605 -2365 -1237 -371 -767 -315 -1023 30 -127 934 -137 698 692 1148 489 666 126 -76 -610 -337 -754 695 476 -1370 -801 -1255 -1182 190 448 -492 -2 192 404 459 1658 426 963 -493 -1169 -1091 -508 -177 -29 836 361 1409 2496 912 1324 549 -141 464 -176 17 -661 -565 4 -686 -68 -159 -673 -148 SS 20240203T053859.5Z 8799.235411 240 1 1.17 2 63.71 95.99 23.95 285.00 0.00 1 0.00 1 0 25 1.421e-02 7.996e-03 8.999e-03 3.808e-03 2.674255e-01 1.911555e-03 2.861347e-03 -6.000000e+00 8.060484e-03 227.68 -2.00 3.06 -2.00 316.60 0.00e+00 1.773213e-03 2.333693e-04 1.803815e-04 -6.000000e+00 3.575527e-04 282.68 -2.00 20.00 -2.00 315.89 0.00e+00 2.245 0.000 302.00 328.00 3 2.5821e+00 4.9912e-03 2.1891e-02 -6.0000e+00 2.0026e-02 1.1468e-02 5.5975e-03 1.2363e-02 -6.0000e+00 2.1769e-02 -1.0466e-03 3.2647e-03 5.9514e-03 -6.0000e+00 1.2968e-02 -1.4483e-03 1.5553e-03 2.1979e-03 -6.0000e+00 5.5012e-03 4.6131e-03 -3.3909e-04 1.0640e-04 2.2700e-05 -6.0000e+00 3.8021e-04 8.9141e-03 12 9 1 12 9 1 -282.02 19.92 0.22 0.00891 0.00637 3 37 1 8 0 291.300 15.00 19.92 23.40 22.09 21.98 27.9 876.74 -3321 -2053 -2671 -6062 3454 -1681 4034 -4807 4176 -3468 676 860 840 -170 -1978 -2016 1008 -759 -485 1587 -2196 2151 93 1918 -356 702 -632 1467 1121 2489 2558 1549 2319 -2451 1195 690 2 -287 365 -1252 -828 -1781 -1352 -1083 -382 -331 -941 -636 -478 1415 -112 1178 812 1057 711 490 -42 41 662 1682 1161 1223 1361 53 -792 -146 -68 94 1585 336 -470 -419 -447 685 -480 417 -324 2029 201 202 -719 -1147 -2220 -1113 -949 -894 -919 -1032 25 -152 426 280 1177 1587 1616 303 788 456 -641 -159 -1016 273 1025 11 -1513 -166 -1012 -447 -39 304 -55 -666 277 397 610 976 1221 189 -93 -1197 -783 -280 -6 -121 498 354 1680 1269 675 413 432 -96 112 562 -265 -560 76 -94 -646 -617 -152 -109 109 -531 -350 -463 -1018 485 -238 577 -820 721 -657 122 161 175 -41 -537 -591 300 -236 -155 516 -744 701 31 661 -130 261 -235 513 378 830 899 587 928 -1025 464 266 1 -135 194 -743 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