File name: Pandora159s1_Wakkerstroom_20210316_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T024456.5Z 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_20210316_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: 20210316 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 20210316T042735.0Z 7745.185822 21 1 48.05 2 84.91 89.24 116.28 95.54 0.00 1 0.00 1 0 41 1.002e+00 2.006e-01 6.254e-01 1.653e-01 8.861395e-01 1.104497e-01 9.656750e-03 -6.000000e+00 6.571820e-01 227.33 -2.00 3.06 -2.00 321.08 0.00e+00 1.768463e-02 2.725285e-02 4.252798e-04 -6.000000e+00 3.702412e-02 282.07 -2.00 20.00 -2.00 320.36 0.00e+00 9.734 0.006 302.00 328.00 3 2.6734e+00 3.1820e-01 8.8411e-02 -6.0000e+00 1.6183e+00 2.0022e+00 3.6870e-01 4.0430e-02 -6.0000e+00 1.7866e+00 -1.9819e+00 2.0696e-01 2.0002e-02 -6.0000e+00 1.0668e+00 7.4552e-01 1.1105e-01 5.8648e-03 -6.0000e+00 4.4976e-01 2.8460e-06 -1.5154e-02 4.7465e-03 9.4778e-05 -6.0000e+00 3.1514e-02 4.0034e-03 12 9 8 11 8 0 15.37 19.31 4.70 0.00400 -0.10987 12 3 4 8 0 4000.000 14.99 19.31 14.12 21.58 21.58 15.8 874.63 20481 900000 71643 126512 900000 900000 -101681 900000 -70575 -7311 900000 115273 900000 900000 172112 -46842 900000 900000 900000 900000 163726 -46813 900000 900000 900000 900000 900000 900000 64445 900000 900000 900000 900000 900000 -60199 -25943 900000 -12885 900000 -49316 900000 -59203 -7612 900000 900000 900000 900000 -97728 900000 556314 111690 900000 115352 900000 210852 119665 59357 -22557 900000 900000 -6495 900000 900000 -30501 900000 91336 51876 138722 305745 -26916 900000 49961 27037 17416 -48827 -47094 470811 -5660 76245 900000 49705 -33828 50587 32716 123378 16472 -35279 16227 -30264 6883 114547 24438 72483 105061 -3331 7869 78285 -16374 45 -14342 243 4296 -6965 10785 34790 11189 900000 42602 -12215 -407 -258 -9448 -5014 -9253 -4571 16867 3356 -3387 13603 17370 8474 -14347 37282 -1332 18308 -10425 10336 962 15757 327 -9991 -7973 -1107 5093 -2222 9559 -909 -2618 -6396 19768 -1455 -8616 3927 3269 900000 11435 20192 900000 900000 -28942 900000 -12217 -1167 900000 18398 900000 900000 27470 -11228 900000 900000 900000 900000 26132 -10789 900000 900000 900000 900000 900000 900000 10286 900000 900000 900000 900000 900000 -14723 -4141 900000 -2057 900000 -11188 900000 -16509 -1295 900000 900000 900000 900000 -38995 900000 88791 17826 900000 18411 900000 33653 19099 9474 -5718 900000 900000 -1185 900000 900000 -9200 900000 14578 8280 22141 48798 -9928 900000 10143 6835 4525 -21630 -17986 75144 -1231 12169 900000 9610 -17183 12716 10506 19692 6757 -24882 7156 -21084 3260 18282 8546 14949 16768 -1561 3865 23035 -14171 38 -15024 217 3371 -5352 6340 16430 7114 900000 22245 -11792 -396 -290 -12980 -7007 -13599 -6249 17929 3987 -4401 15851 20499 10989 -22298 33181 -1652 18266 -13278 10387 1047 16269 459 -17846 -15414 -2153 9897 -4950 20262 -2205 -6512 -16568 38852 -3296 -19279 7157 SS 20210316T044144.9Z 7745.195658 24 1 49.76 2 81.77 87.60 113.27 93.80 0.00 1 0.00 1 0 17 5.315e-01 1.619e-02 3.936e-01 1.023e-02 7.168798e-01 5.769717e-03 7.033604e-03 -6.000000e+00 3.039303e-01 227.33 -2.00 3.06 -2.00 321.80 0.00e+00 5.866658e-03 3.199006e-03 6.224145e-03 -6.000000e+00 1.562490e-02 282.07 -2.00 20.00 -2.00 321.28 0.00e+00 6.567 0.002 302.00 328.00 3 2.5532e+00 2.1703e-02 7.5251e-02 -6.0000e+00 7.5675e-01 1.5810e-01 3.2106e-02 6.7358e-02 -6.0000e+00 8.2516e-01 -2.5866e-01 3.3811e-02 2.2098e-02 -6.0000e+00 4.8752e-01 8.9965e-02 1.5481e-02 9.8726e-03 -6.0000e+00 2.1059e-01 9.6767e-05 -1.5187e-03 3.0106e-04 7.1264e-05 -6.0000e+00 1.4777e-02 4.1796e-03 12 8 8 10 0 0 37.50 19.30 0.48 0.00418 -0.00723 50 11 4 8 0 994.720 14.99 19.30 15.21 21.58 21.58 15.8 880.65 900000 -168993 900000 -82004 900000 -179294 -204509 900000 -232309 -223830 900000 900000 900000 113977 3770 78765 14369 51573 86799 900000 55732 -4610 -54063 -42581 152073 -113924 -67407 108936 28036 77740 -47684 -58896 176987 4454 1694 10083 -15525 -29309 6715 83259 1541 -8363 6377 33701 19015 35282 8778 30243 -1332 6299 2539 6505 30713 -1793 14026 6500 13201 3946 1080 -6169 6127 901 1586 10188 -3890 5733 72 10458 5727 876 3678 4482 1284 1291 3503 -6548 11386 -8149 -2154 -3577 -1101 -3688 1744 -96 -1674 -1638 -1192 -2119 -1342 1437 444 -1736 128 4309 -499 -857 347 -896 -1430 1265 1314 -1350 -263 334 -892 -1648 11716 -2237 -268 -1351 -278 -1867 -103 -542 839 1335 721 501 -1074 -279 -1467 1263 -762 -102 -470 1048 1512 2011 -197 279 -316 350 277 242 334 -723 801 -57 -273 -642 505 -67 -555 900000 -1683 900000 -816 900000 -1785 -2257 900000 -4217 -3994 900000 900000 900000 1135 38 784 143 513 864 900000 555 -48 -953 -723 1514 -4319 -1665 1085 279 774 -1301 -2190 1762 112 42 231 -495 -1272 252 1772 80 -516 362 1524 1009 1654 546 1604 -102 484 225 626 2562 -224 1585 826 1609 524 143 -865 794 136 272 1824 -846 1127 15 2023 1297 239 1076 1355 394 372 904 -1674 2323 -2064 -586 -1177 -414 -1636 806 -48 -901 -940 -717 -1323 -829 837 244 -922 65 2174 -300 -602 279 -840 -1468 1271 1243 -1179 -209 264 -763 -1506 9975 -2337 -303 -1741 -394 -2864 -157 -810 1173 1785 986 716 -1656 -444 -2330 1883 -1115 -144 -646 1370 1917 2642 -302 482 -603 712 590 550 809 -1866 2081 -151 -728 -1650 1210 -151 -1223 SS 20210316T044811.0Z 7745.200127 27 1 50.03 2 80.34 86.85 111.91 93.03 0.00 1 0.00 1 0 25 4.081e-01 9.117e-03 2.234e-01 4.516e-03 6.255439e-01 2.418162e-03 6.151012e-03 -6.000000e+00 2.325070e-01 227.33 -2.00 3.06 -2.00 321.40 0.00e+00 6.670156e-03 1.219928e-03 1.535586e-03 -6.000000e+00 1.036786e-02 282.07 -2.00 20.00 -2.00 320.85 0.00e+00 5.695 0.001 302.00 328.00 3 2.1560e+00 8.4492e-03 5.6330e-02 -6.0000e+00 5.7682e-01 1.6208e-02 1.1810e-02 3.5911e-02 -6.0000e+00 6.2721e-01 -9.8134e-02 1.2126e-02 1.5748e-02 -6.0000e+00 3.7271e-01 3.0646e-02 5.7221e-03 9.4815e-03 -6.0000e+00 1.5792e-01 3.1715e-04 -8.3067e-04 1.3042e-04 7.8832e-05 -6.0000e+00 1.0916e-02 3.4933e-03 11 9 0 11 8 0 22.84 19.30 0.43 0.00349 -0.00275 104 22 4 8 0 476.410 14.99 19.30 15.89 21.58 21.58 16.0 885.12 -207527 -29840 -183065 -49843 -127246 900000 -128130 -130719 -105252 -122125 -125105 -33464 -72810 -95311 132001 -57063 30386 -53517 -19541 -59390 30758 -53433 -22136 -29656 -10277 -23692 -8270 -11956 -38274 -3590 -23215 10856 -15672 4343 -665 18535 -1887 -3714 4784 -2014 -7175 -3782 3941 -567 11430 948 14094 4341 10004 1811 5899 5170 -1074 1923 556 7561 -1721 2514 -663 1666 -610 6210 2625 2409 1636 2555 2969 1479 2878 2236 4890 185 1844 512 588 -1320 1688 -754 -690 -295 -1146 -1359 -1823 -787 -1406 -173 -1047 -803 -312 -12 -280 135 1345 1429 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