File name: Pandora159s1_Wakkerstroom_20210807_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031920.8Z 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_20210807_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: 20210807 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 20210807T051527.8Z 7889.219072 21 1 48.89 2 82.66 67.28 76.13 52.16 0.00 1 0.00 1 0 25 4.968e-01 8.637e-03 3.571e-01 6.632e-03 7.669408e-01 3.741408e-03 7.291558e-03 -6.000000e+00 2.843704e-01 226.12 -2.00 3.06 -2.00 321.86 0.00e+00 3.000408e-03 2.054467e-03 2.622190e-03 -6.000000e+00 1.379648e-02 276.66 -2.00 20.00 -2.00 321.40 0.00e+00 7.259 0.002 302.00 328.00 3 1.3467e+00 1.3712e-02 7.0980e-02 -6.0000e+00 7.1050e-01 9.3262e-02 2.1832e-02 4.4073e-02 -6.0000e+00 7.7752e-01 -1.3568e-01 2.5272e-02 2.1632e-02 -6.0000e+00 4.5836e-01 4.2291e-02 1.1500e-02 7.2054e-03 -6.0000e+00 1.9511e-01 1.8357e-04 -1.1328e-03 1.9135e-04 8.6598e-05 -6.0000e+00 1.3824e-02 5.3164e-03 12 9 1 12 1 1 98.16 18.22 0.42 0.00532 -0.00320 80 18 4 8 0 601.500 15.00 18.22 2.66 20.77 20.77 15.8 808.01 900000 -236257 -66432 900000 900000 -282666 4581 -49659 900000 900000 -59151 -70490 900000 900000 -156615 173499 -120561 900000 900000 -13161 -126430 13253 -77044 -18368 17599 -59216 146675 -62724 8026 -36339 180165 -31582 -23771 -120 -27260 -12694 -40362 8480 -3061 2498 -17593 33356 -674 16605 -7721 13429 804 11400 14791 7747 19509 -1778 8314 -5305 3877 867 13037 -255 214 -2651 1587 -381 4515 2834 1749 5225 -1360 5490 2801 6710 1370 1330 -553 1074 -674 -1183 -3325 95 1261 1400 412 -160 -1033 -2179 -807 -366 1011 -2531 1210 -399 737 834 878 699 -56 332 -293 1065 -352 756 -468 -40 -25 433 -2754 -1427 -1895 -930 -140 393 -545 -798 195 -252 1072 1458 711 223 -128 -878 -475 251 222 -48 708 471 1522 1604 -223 -185 240 1 69 285 -74 -403 182 -312 -414 -505 117 -21 651 900000 -1525 -429 900000 900000 -2655 30 -321 900000 900000 -382 -455 900000 900000 -2022 1120 -1557 900000 900000 -85 -2375 86 -1045 -154 114 -879 947 -972 62 -493 1163 -632 -522 -2 -651 -262 -1113 192 -88 82 -805 999 -30 643 -390 568 40 542 729 450 1145 -147 693 -557 398 97 1332 -30 24 -300 179 -49 641 469 313 899 -251 996 589 1575 375 379 -158 283 -164 -259 -705 20 306 410 145 -65 -469 -1065 -416 -200 573 -1527 700 -225 384 410 421 355 -33 228 -237 982 -361 770 -450 -34 -19 335 -2365 -1281 -1806 -947 -157 501 -789 -1239 303 -384 1531 1999 993 328 -200 -1432 -756 378 321 -68 956 615 1909 2127 -347 -330 473 2 156 628 -175 -1008 462 -807 -1069 -1250 269 -50 1461 SS 20210807T052151.1Z 7889.223508 24 1 49.86 2 81.36 66.47 75.05 51.22 0.00 1 0.00 1 0 25 4.635e-01 7.233e-03 2.196e-01 3.065e-03 6.791995e-01 1.664750e-03 6.607018e-03 -6.000000e+00 2.613748e-01 226.12 -2.00 3.06 -2.00 321.52 0.00e+00 5.069963e-03 8.194590e-04 2.801883e-03 -6.000000e+00 1.137490e-02 276.66 -2.00 20.00 -2.00 321.03 0.00e+00 6.294 0.001 302.00 328.00 3 9.1011e-01 5.7069e-03 6.2820e-02 -6.0000e+00 6.4835e-01 5.7641e-02 8.2260e-03 4.1423e-02 -6.0000e+00 7.0620e-01 -7.3821e-02 9.1356e-03 1.7609e-02 -6.0000e+00 4.1969e-01 2.0182e-02 4.3252e-03 7.8983e-03 -6.0000e+00 1.7777e-01 6.3741e-04 -1.0997e-03 8.8220e-05 6.9049e-05 -6.0000e+00 1.2390e-02 5.0925e-03 11 8 0 10 0 0 96.46 18.22 0.30 0.00509 -0.00317 205 44 4 8 0 240.800 14.99 18.22 3.37 20.77 20.77 16.0 813.38 -207873 156294 -184905 -67443 -181223 -109512 -183856 -132863 -125169 -98193 23566 -162200 -59148 -92378 5017 -88393 3756 -46199 76894 -32811 -21694 119 -7414 -11688 -5534 15192 -35781 13438 -47645 34525 -38993 14713 -7552 -5974 12397 4639 -2828 -6460 2992 -3836 570 -8434 5902 -2530 3508 -6076 6262 -202 5806 5195 3251 5521 892 4994 -2690 3559 -396 2569 659 1849 2582 450 2177 2157 2421 1562 3660 1666 3327 -617 1791 -233 800 -294 -324 -210 -108 1222 -115 1242 -1326 -809 -2599 -48 -1502 -802 -113 -540 -107 -372 187 -121 1106 887 1624 39 895 -127 -199 -400 64 119 1020 418 -1651 -956 -1176 -629 -671 5 -852 -203 158 204 768 1147 599 304 -62 -1078 -594 -36 71 -223 639 224 1480 1459 459 227 71 342 16 314 -402 -438 -7 29 -428 -139 103 -199 487 -1808 467 -1658 -202 -1428 -458 -1599 -874 -861 -558 70 -1983 -371 -979 28 -1417 30 -628 368 -455 -305 1 -95 -171 -83 195 -710 177 -1062 413 -1081 321 -220 -183 307 124 -90 -256 133 -219 35 -616 396 -191 255 -504 475 -17 491 479 343 642 120 703 -434 564 -67 421 107 293 424 84 460 517 613 392 889 429 942 -210 656 -91 304 -106 -107 -62 -30 343 -37 474 -611 -424 -1395 -27 -904 -511 -75 -372 -73 -245 125 -76 659 551 1132 30 782 -129 -220 -443 65 110 925 384 -1531 -932 -1212 -692 -814 7 -1297 -325 253 316 1115 1591 842 451 -98 -1785 -966 -57 106 -323 883 299 1886 1949 704 397 137 700 35 718 -992 -1138 -18 77 -1150 -358 248 -451 1059 SS 20210807T053602.5Z 7889.233363 29 1 51.29 2 78.49 64.61 72.69 49.07 0.00 1 0.00 1 0 25 1.072e-01 5.897e-03 4.635e-02 1.155e-03 5.413060e-01 5.975803e-04 5.437561e-03 -6.000000e+00 6.047327e-02 226.12 -2.00 3.06 -2.00 320.67 0.00e+00 1.951802e-03 2.316290e-04 1.236735e-03 -6.000000e+00 2.631706e-03 276.66 -2.00 20.00 -2.00 320.14 0.00e+00 4.853 0.001 302.00 328.00 3 7.0115e-01 1.8326e-03 4.6953e-02 -6.0000e+00 1.5001e-01 2.4672e-03 2.3588e-03 2.6915e-02 -6.0000e+00 1.6339e-01 -1.0468e-03 2.3608e-03 1.2834e-02 -6.0000e+00 9.7101e-02 -1.0047e-02 1.1838e-03 4.4058e-03 -6.0000e+00 4.1132e-02 2.7788e-03 -8.1983e-04 3.3272e-05 4.6036e-05 -6.0000e+00 2.8664e-03 4.5851e-03 10 0 0 10 0 0 65.91 18.21 0.28 0.00459 -0.00158 453 97 2 8 0 108.640 15.00 18.21 5.38 20.77 20.77 16.2 823.97 -32776 -32677 -4369 -34088 -21313 -50424 -4255 -47648 -29257 -55057 -32287 -31113 -17469 -12186 -9302 -4465 -8402 -3926 -5544 -662 -5136 242 -7609 -6071 -7543 -6835 -5141 -5639 -1832 -3313 2187 446 4503 -3697 -1293 -4359 -1706 -3123 -1066 -2926 -2667 -1587 -1798 91 -1750 -390 324 75 -253 2072 525 856 1036 734 710 584 -403 -748 977 354 1631 1595 1684 754 83 1183 921 1658 1873 642 228 -2 -954 174 -827 351 308 1054 868 -324 -212 -930 -1722 -895 -944 -909 -348 -492 -114 -2 828 751 1195 1991 1142 624 777 270 -807 -181 -227 38 896 557 -1367 -979 -642 -699 -61 -120 -391 -430 -71 211 581 1192 852 471 -125 -905 -813 -247 -199 -22 502 299 1235 1574 318 109 -10 83 181 386 -324 -480 62 -93 -499 -133 155 -20 324 -210 -243 -26 -265 -134 -420 -24 -488 -283 -744 -364 -389 -236 -198 -165 -89 -194 -95 -147 -18 -148 7 -237 -203 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