File name: Pandora159s1_Wakkerstroom_20210526_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T030415.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes 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_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210526_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: 20210526 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 20210526T050445.4Z 7816.211637 187 1 48.70 2 85.57 63.40 99.14 242.85 0.00 1 0.00 1 0 17 5.752e-01 6.099e-02 5.670e-01 5.181e-02 9.558306e-01 3.162936e-02 1.002478e-02 -6.000000e+00 3.369308e-01 224.83 -2.00 3.06 -2.00 322.34 0.00e+00 2.679604e-02 1.587257e-02 3.847469e-03 -6.000000e+00 1.809095e-02 278.26 -2.00 20.00 -2.00 321.91 0.00e+00 10.776 0.008 302.00 328.00 3 5.9592e-01 1.1509e-01 1.0783e-01 -6.0000e+00 8.3790e-01 1.7695e+00 1.3592e-01 8.4183e-02 -6.0000e+00 9.2366e-01 -1.9527e+00 9.5083e-02 2.2310e-02 -6.0000e+00 5.4316e-01 7.3937e-01 5.0715e-02 2.2030e-02 -6.0000e+00 2.3044e-01 1.3451e-05 -4.8988e-03 1.4093e-03 2.5359e-04 -6.0000e+00 1.6870e-02 7.0723e-03 12 8 8 10 0 0 56.78 18.47 1.25 0.00707 -0.02974 22 5 4 8 0 2213.240 15.00 18.47 6.36 20.96 20.96 16.1 829.71 900000 900000 -34518 126354 -34562 900000 -65492 -46970 -58612 -92913 900000 900000 -40594 21867 900000 27840 900000 900000 900000 192266 -87518 19130 900000 900000 95947 900000 10110 900000 900000 -57397 900000 107873 -16648 84654 900000 -40258 900000 138484 900000 128591 900000 136410 167931 -46367 141305 33384 36387 59427 87017 37020 170876 900000 -14859 900000 60022 98442 94960 89134 23347 -25065 5737 15765 40763 66585 63939 49505 178727 -28086 60518 68450 64087 87126 20842 13634 -11720 -36145 -2528 71487 972 12174 117 11343 -10323 9437 13960 2749 -11200 13842 -4527 1672 12839 -6998 12978 -731 -6122 -10761 90 -5271 6710 705 6400 -11728 -17759 6021 -11486 3486 77708 -14548 -8403 3446 -3303 -3969 -2861 418 1757 -3670 11377 2780 1001 323 1894 2285 733 118 686 9530 4299 -7 -6720 2222 -1236 5055 -1307 3619 -19 -1124 1249 -77 -4460 -3692 5637 -1754 2725 900000 900000 -2460 6356 -1897 900000 -3294 -2363 -2948 -4674 900000 900000 -2042 1100 900000 1400 900000 900000 900000 9671 -12006 962 900000 900000 4826 900000 509 900000 900000 -3412 900000 5426 -1218 4258 900000 -3130 900000 6966 900000 6468 900000 6862 8447 -5513 7108 1832 1997 2989 4377 2370 8595 900000 -2038 900000 4117 4952 4777 4483 1922 -3209 551 1514 3542 5176 5555 4980 8990 -6293 6088 7199 7619 9203 3717 2369 -2305 -7934 -370 5753 169 2338 31 3060 -3824 3021 4469 1031 -5019 4937 -1925 642 4110 -2560 4178 -261 -2688 -6004 54 -3977 5063 580 4683 -9063 -12750 3276 -7878 2184 26970 -12573 -7723 3293 -3912 -5227 -3873 544 2185 -4683 12642 3546 1378 462 2599 2936 908 144 803 10930 5060 -9 -10018 3596 -2363 9962 -2947 8357 -50 -3083 3404 -216 -12911 -10129 12965 -3970 5558 SS 20210526T051914.1Z 7816.221691 190 1 49.58 2 82.72 61.58 101.83 240.98 0.00 1 0.00 1 0 25 5.454e-01 9.765e-03 3.240e-01 4.523e-03 7.494049e-01 2.523327e-03 7.166308e-03 -6.000000e+00 3.112650e-01 224.83 -2.00 3.06 -2.00 321.82 0.00e+00 8.509608e-03 1.373857e-03 3.565414e-03 -6.000000e+00 1.429980e-02 278.26 -2.00 20.00 -2.00 321.34 0.00e+00 7.309 0.002 302.00 328.00 3 6.0208e-01 9.2339e-03 7.3831e-02 -6.0000e+00 7.7130e-01 1.5712e-01 1.4025e-02 5.2504e-02 -6.0000e+00 8.4297e-01 -1.7247e-01 1.5858e-02 2.0000e-02 -6.0000e+00 4.9961e-01 5.8973e-02 7.3104e-03 1.1741e-02 -6.0000e+00 2.1071e-01 3.6425e-04 -1.2353e-03 1.2968e-04 9.2893e-05 -6.0000e+00 1.4859e-02 6.2003e-03 12 8 8 10 0 0 24.10 18.45 0.35 0.00620 -0.00308 159 34 4 8 0 309.810 14.99 18.45 7.76 20.87 20.96 16.0 837.52 -57228 -211943 -149782 -279629 -123463 -313837 900000 -176893 -166465 -56600 900000 -127505 -48842 52280 -52044 900000 -102496 900000 -31095 64307 -63267 900000 -14377 41088 9989 -37276 81039 -41735 30689 -44233 -11030 -48186 28196 -33713 -5504 -11566 -5224 6204 6673 19136 668 12613 -1464 4857 -7443 1530 3918 13427 4343 15771 12864 15638 8383 5557 5452 1900 5630 -5923 3173 1093 6577 842 4463 4334 3190 7132 454 6121 1406 2375 -1719 1869 -2805 2001 -170 1255 1932 -2599 610 1256 1798 -1665 751 -2431 373 -1253 150 -1021 1115 -660 1287 -162 -51 1898 -674 881 -388 492 -1104 139 -734 107 845 296 -1906 -1401 -1056 -1811 -276 -592 -632 -368 -154 38 555 1368 773 328 -454 -445 -395 907 -346 37 236 556 1343 1623 169 440 92 401 380 114 -190 -701 278 -136 -417 -257 228 -158 177 -252 -1443 -660 -4032 -544 -5783 900000 -992 -934 -249 900000 -664 -215 230 -313 900000 -1478 900000 -274 283 -836 900000 -133 235 84 -478 357 -568 230 -726 -163 -1293 418 -999 -119 -264 -123 157 206 621 29 536 -76 247 -441 86 226 748 284 1004 953 1278 816 608 633 238 697 -816 388 135 804 122 728 811 645 1377 94 1250 338 654 -543 592 -914 581 -46 298 432 -633 166 411 694 -765 340 -1206 192 -697 87 -612 652 -377 735 -88 -27 1038 -433 602 -315 458 -1143 143 -707 91 705 249 -1617 -1252 -994 -1852 -309 -757 -907 -562 -237 57 783 1843 1059 475 -702 -711 -618 1337 -495 51 315 714 1809 2112 256 764 178 828 829 267 -476 -1861 745 -371 -1136 -670 552 -359 388 SS 20210526T052529.7Z 7816.226038 193 1 50.13 2 81.51 60.77 102.97 240.14 0.00 1 0.00 1 0 25 4.108e-01 7.579e-03 1.772e-01 2.680e-03 6.714382e-01 1.437220e-03 6.523297e-03 -6.000000e+00 2.305249e-01 224.83 -2.00 3.06 -2.00 321.45 0.00e+00 3.853222e-03 7.183906e-04 2.033670e-03 -6.000000e+00 1.044366e-02 278.26 -2.00 20.00 -2.00 320.94 0.00e+00 6.391 0.002 302.00 328.00 3 6.5641e-01 4.9366e-03 6.1763e-02 -6.0000e+00 5.6980e-01 6.5034e-02 7.1277e-03 3.7205e-02 -6.0000e+00 6.2108e-01 -6.0329e-02 7.7893e-03 1.7090e-02 -6.0000e+00 3.7031e-01 1.1461e-02 3.6756e-03 7.1874e-03 -6.0000e+00 1.5896e-01 7.7236e-04 -9.4684e-04 7.5939e-05 6.6430e-05 -6.0000e+00 1.1141e-02 6.2391e-03 11 9 0 11 8 0 79.96 18.45 0.31 0.00624 -0.00088 230 49 2 8 0 214.210 15.00 18.45 8.37 20.96 20.96 16.1 840.77 -210362 900000 -125850 900000 -196260 -75350 -175162 -132931 -117970 -48520 -100211 -115997 31245 -113224 8802 -60997 205 -36822 53783 -18960 -6454 -25628 -31842 -10642 -34609 -25536 -36498 1196 -55371 32065 -26536 24800 -10520 -1032 -8398 -4444 -18323 -2432 10406 -3623 3140 -9114 4905 -1253 5906 -3357 6127 -3 2707 317 2733 4820 1949 4588 299 4510 -2053 2361 -955 2441 677 2216 3066 1277 1335 1414 3282 1607 4488 -485 2266 -78 1514 -170 -505 -643 -12 1727 73 1073 -604 -259 -2481 -586 -1003 -253 -1057 -440 -186 -300 1194 151 1835 469 1639 -488 1119 40 -388 -505 -85 37 879 487 -2018 -1004 -1128 -349 -572 -4 -970 -197 -261 445 363 1238 1111 402 123 -1075 -438 -102 140 -282 751 122 1456 1615 168 284 -46 294 29 354 -488 -260 -189 128 -674 -17 116 -10 294 -2039 900000 -687 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