File name: Pandora159s1_Wakkerstroom_20220102_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035232.3Z 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_20220102_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: 20220102 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 20220102T033628.0Z 8037.150324 32 1 49.75 2 85.23 113.38 77.07 112.51 0.00 1 0.00 1 0 25 7.246e-01 5.528e-02 5.263e-01 4.737e-02 9.679798e-01 2.826078e-02 1.025622e-02 -6.000000e+00 4.377078e-01 227.73 -2.00 3.06 -2.00 322.22 0.00e+00 -4.202307e-03 1.290060e-02 1.253422e-02 -6.000000e+00 2.055283e-02 281.97 -2.00 20.00 -2.00 321.74 0.00e+00 10.199 0.006 302.00 328.00 3 1.1427e+00 1.0162e-01 1.1662e-01 -6.0000e+00 1.0869e+00 1.7118e+00 1.1956e-01 9.5279e-02 -6.0000e+00 1.1851e+00 -2.0300e+00 7.4707e-02 3.0262e-02 -6.0000e+00 6.9444e-01 7.7706e-01 4.0537e-02 8.2174e-03 -6.0000e+00 2.9245e-01 1.3739e-05 -2.4490e-03 1.2881e-03 1.8286e-04 -6.0000e+00 2.1110e-02 -2.0428e-03 12 9 8 11 8 0 14.24 19.11 0.89 -0.00204 -0.02045 19 4 4 8 0 2617.410 15.00 19.11 21.04 21.38 21.38 19.4 894.74 50109 89048 118839 -74664 900000 900000 900000 900000 900000 1611 66996 117587 -99728 900000 -48478 -14815 900000 490879 12200 28372 3706 51852 253680 25813 900000 85700 60096 14081 28247 -11600 172317 -61959 122946 128651 104699 900000 711 900000 24155 66532 900000 900000 166074 174286 39132 15737 900000 900000 900000 60326 -62455 48831 75934 40056 159693 73142 900000 14195 1714 -14003 148909 20409 37248 50668 27520 82608 -16532 39190 23044 71092 -28397 42674 18285 -231 27481 11543 88787 16907 1256 -5291 30767 13470 461 -2168 638 -15958 15209 31780 12831 -5498 1261 8354 -19108 12639 -5071 3457 -4594 -4395 -1345 6512 -445 -3801 2061 -1600 -1212 4255 -11507 -14009 4902 63 -3456 -3818 1230 -2652 -601 1327 -453 -786 -1474 931 -3341 10422 -1073 -1279 -987 9499 6337 2894 1208 997 2956 434 3296 -3718 -397 -74 3346 239 -351 -1348 -2275 1012 -2020 2322 4100 5472 -9401 900000 900000 900000 900000 900000 74 3085 5414 -13402 900000 -5368 -1299 900000 22601 852 1603 246 2387 11680 1274 900000 3946 2767 653 1301 -641 7934 -7428 5661 5923 4821 900000 45 900000 1601 3351 900000 900000 7646 8024 2569 1245 900000 900000 900000 3363 -12536 3701 4733 3788 7353 5361 900000 1785 225 -1973 6856 2141 3733 5065 3647 6374 -3331 4799 3656 8071 -9170 7076 3726 -51 4143 1780 6003 2378 236 -1274 6196 3717 160 -821 248 -7631 5569 10094 4850 -2365 475 2789 -8245 4283 -2366 1757 -2979 -3324 -1100 5011 -345 -2710 1238 -976 -786 2773 -9286 -12501 4116 65 -4202 -5138 1637 -3659 -792 1664 -584 -1068 -2129 1350 -4919 12681 -1396 -1624 -1222 10294 6945 3466 1727 1673 5525 906 7180 -9379 -1045 -205 9110 677 -990 -3652 -5753 2279 -4440 SS 20220102T035047.4Z 8037.160271 35 1 49.47 2 82.29 111.86 74.24 111.25 0.00 1 0.00 1 0 25 4.996e-01 8.816e-03 3.024e-01 4.229e-03 7.550372e-01 2.333540e-03 7.224638e-03 -6.000000e+00 2.838352e-01 227.73 -2.00 3.06 -2.00 321.70 0.00e+00 7.487934e-03 1.290766e-03 2.685235e-03 -6.000000e+00 1.290051e-02 281.97 -2.00 20.00 -2.00 321.19 0.00e+00 6.951 0.002 302.00 328.00 3 8.5575e-01 8.6259e-03 7.0103e-02 -6.0000e+00 7.0542e-01 1.5362e-01 1.3245e-02 4.8381e-02 -6.0000e+00 7.6640e-01 -1.3666e-01 1.4618e-02 2.0177e-02 -6.0000e+00 4.5695e-01 4.0400e-02 6.6829e-03 1.2286e-02 -6.0000e+00 1.9585e-01 3.6069e-04 -1.3227e-03 1.1685e-04 9.8555e-05 -6.0000e+00 1.3550e-02 -3.8046e-03 11 8 0 10 0 0 20.67 19.10 0.32 -0.00380 -0.01374 147 32 4 8 0 336.490 14.99 19.10 21.80 21.38 21.38 19.4 899.33 -131099 900000 -83091 900000 -218894 -126464 -181428 -152433 -230655 -187644 -157107 -140376 -123616 -72679 -44583 -105032 27151 -43142 60682 -38853 6757 -49850 11045 -34192 -61129 26688 -55624 13191 10862 32495 -40750 -3733 -8037 15880 -18691 -18193 844 290 9338 -9554 -3460 -9880 77 612 9173 -2484 -40 1501 -206 2280 6589 9116 6119 -228 5834 2292 -1898 461 -3255 5506 823 3429 1960 4311 3641 1593 3044 2402 3282 2603 4124 986 587 -643 271 -1089 -1 -68 -1056 -1314 751 1081 -887 -1174 -761 -1088 -1307 -1321 -1218 -205 823 -685 -580 1098 534 -332 289 42 -158 -138 -418 -211 1000 -316 -1863 -1265 6633 -1291 -587 20 -856 -393 -247 386 189 1256 791 527 163 -863 -802 -325 13 -361 636 64 1253 1018 -271 -283 -89 13 171 339 -177 -173 -7 129 -470 30 160 -36 66 -541 900000 -343 900000 -1624 -521 -972 -691 -2334 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-6.0000e+00 5.1671e-01 9.6791e-02 6.1144e-03 3.8686e-02 -6.0000e+00 5.6139e-01 -7.3844e-02 6.4677e-03 1.6926e-02 -6.0000e+00 3.3426e-01 1.5429e-02 3.0574e-03 9.4140e-03 -6.0000e+00 1.4198e-01 8.8983e-04 -9.8902e-04 6.4857e-05 7.3715e-05 -6.0000e+00 9.7848e-03 -3.8942e-03 11 8 0 10 0 0 9.98 19.10 0.28 -0.00389 -0.01133 244 52 2 8 0 201.820 15.00 19.10 22.29 21.48 21.38 19.5 901.73 -173344 -109571 -135432 -112496 -146539 -135525 -99312 -6460 -109182 -4806 -137153 -46948 -96501 -78435 -30934 -54170 5230 -30597 12598 -29167 5801 -25268 7038 -29578 -11848 -18657 -25549 -11307 -32319 -2635 -23506 6351 -10548 -85 -8537 4675 -9525 -466 -8900 -1274 186 -654 6 -2457 3125 -2068 4712 1957 2868 923 5671 836 4235 1841 859 2788 -878 1351 -1086 1069 344 2547 2285 1358 743 2661 1443 1178 2515 617 1321 460 456 -1003 -957 45 1315 -655 1631 -799 -869 -801 -2036 -611 -1287 -601 -539 -371 -183 302 756 915 1167 1237 1112 437 917 353 -165 -552 -64 46 763 310 -1669 -1385 -287 -1155 -538 120 -581 -246 -17 175 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