File name: Pandora159s1_Wakkerstroom_20210512_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T025736.8Z 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_20210512_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: 20210512 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 20210512T045645.4Z 7802.206081 21 1 49.72 2 85.51 66.85 90.37 69.32 0.00 1 0.00 1 0 65 1.986e+00 9.350e-02 5.310e-01 3.710e-02 9.967893e-01 2.410741e-02 1.202820e-02 -6.000000e+00 1.192970e+00 225.08 -2.00 3.06 -2.00 321.31 0.00e+00 4.310023e-02 1.455427e-02 1.809764e-02 -6.000000e+00 7.911701e-02 278.98 -2.00 20.00 -2.00 320.61 0.00e+00 10.665 0.007 302.00 328.00 3 -2.7210e-02 9.6056e-02 1.3358e-01 -6.0000e+00 3.0176e+00 3.1086e+00 1.0318e-01 1.1452e-01 -6.0000e+00 3.3284e+00 -3.7973e+00 5.3804e-02 4.7563e-02 -6.0000e+00 1.9019e+00 1.4896e+00 3.5502e-02 1.0283e-02 -6.0000e+00 8.1307e-01 1.9524e-05 -6.5433e-03 1.0552e-03 4.2926e-04 -6.0000e+00 6.0351e-02 4.2164e-03 12 8 8 10 0 0 57.52 18.48 1.15 0.00422 -0.04495 33 7 4 8 0 1506.420 14.99 18.48 6.69 20.96 20.96 16.1 833.02 712978 607581 900000 900000 900000 900000 580908 900000 900000 900000 900000 900000 400101 900000 601093 486696 418864 900000 900000 422745 367418 383752 -15567 900000 900000 420280 900000 296742 900000 900000 288635 900000 301370 310874 900000 900000 245085 900000 238764 236716 301753 146479 900000 361121 163325 900000 355472 136566 900000 196631 900000 433209 900000 83446 900000 105300 119551 258529 900000 148628 170661 36650 142740 141352 69763 123569 53437 900000 40367 106209 75321 43713 65000 70497 17919 65059 27099 3177 55461 4086 25840 11390 35932 32609 24890 -5776 -8084 3564 10438 23022 7534 10752 11218 12411 -10853 -15728 -2712 -2988 -9336 775 -1279 808 3505 -6235 -359 -13156 51844 -1984 -9269 -8304 -8003 -8918 -496 -2765 50 -1864 -2652 2204 -251 1924 -283 7703 -619 3595 6408 4943 5681 -1517 -453 -1107 3103 2554 3015 1989 933 -2867 1335 -384 -2422 1373 -671 -251 -2565 25627 36398 900000 900000 900000 900000 20880 900000 900000 900000 900000 900000 14381 900000 21605 17494 19162 900000 900000 15195 16808 13793 -17020 900000 900000 15106 900000 10666 900000 900000 10375 900000 10832 11174 900000 900000 8809 900000 8582 8508 10846 8615 900000 12980 7472 900000 12777 8032 900000 7068 900000 15571 900000 8998 900000 7914 7032 9292 900000 5342 6134 3952 6063 6928 7523 7672 6461 900000 5804 8676 8860 6999 7859 7141 2635 5102 2834 436 5255 801 4897 2866 7749 7565 6425 -2095 -3091 1234 3343 6244 2216 2846 2859 3285 -4220 -7863 -1453 -1924 -7322 572 -915 499 1821 -3362 -191 -8469 18465 -1323 -7541 -7896 -8891 -11190 -601 -3443 58 -2186 -3181 2665 -332 2584 -380 8986 -743 4017 6784 5185 5773 -1744 -609 -1798 5567 5099 6452 4628 2355 -7916 3591 -1055 -6751 3517 -1606 -543 -5254 SS 20210512T051121.1Z 7802.216217 24 1 51.06 2 82.55 65.03 87.46 67.62 0.00 1 0.00 1 0 25 5.807e-01 7.412e-03 2.438e-01 3.210e-03 7.585877e-01 1.751702e-03 7.284781e-03 -6.000000e+00 3.262612e-01 225.08 -2.00 3.06 -2.00 321.77 0.00e+00 4.231500e-03 9.609795e-04 3.249829e-03 -6.000000e+00 1.438836e-02 278.98 -2.00 20.00 -2.00 321.29 0.00e+00 7.163 0.002 302.00 328.00 3 1.6751e-01 6.4313e-03 7.1175e-02 -6.0000e+00 8.0677e-01 1.0888e-01 1.0002e-02 4.7543e-02 -6.0000e+00 8.7900e-01 -1.0877e-01 1.1275e-02 2.1132e-02 -6.0000e+00 5.2352e-01 3.2237e-02 5.1586e-03 8.0063e-03 -6.0000e+00 2.2274e-01 6.3364e-04 -9.8348e-04 8.9008e-05 7.9250e-05 -6.0000e+00 1.5519e-02 3.8979e-03 11 9 0 11 8 0 27.76 18.48 0.28 0.00390 -0.00349 253 54 2 8 0 194.860 14.99 18.48 8.42 20.96 20.96 16.1 841.37 -239449 -186953 -182357 -167393 -197399 -228176 -97271 -185181 -150749 -29560 -162262 -154515 -154022 -134902 -82365 -88950 -77354 -55330 -51545 53649 -36605 -33965 -58961 -58740 -75109 -24716 -47276 -49230 -46277 -24138 -14833 -18315 693 -11081 -870 -12384 -10862 -303 -7547 -11182 80 -11700 -12939 8543 2042 2469 7175 9816 5884 12047 5789 8968 4595 3861 3641 2401 2243 487 2949 -1063 7540 4927 4091 1053 2164 4463 2539 1857 3270 1637 -281 1744 -306 -276 -168 2599 -826 1321 1408 -1037 -753 -644 -1768 -1493 -1062 -783 -415 -109 307 -124 860 44 499 1041 656 507 507 457 -795 -87 -286 319 859 501 -2068 -1165 -2240 -717 -274 -212 -364 -139 605 291 576 1043 758 345 -362 -855 -936 -205 -59 59 486 657 1367 1642 289 106 11 289 -135 486 -435 -457 91 3 -495 -181 133 30 339 -1470 -828 -840 -659 -980 -1527 -305 -1030 -681 -93 -976 -1018 -1336 -1308 -627 -889 -801 -522 -516 207 -349 -320 -747 -821 -1339 -289 -704 -739 -692 -328 -228 -360 13 -256 -18 -284 -271 -8 -270 -494 4 -640 -761 422 110 137 397 561 372 787 454 770 456 424 426 299 288 63 366 -135 913 681 658 200 432 871 506 392 761 447 -86 543 -96 -81 -45 614 -191 311 379 -344 -293 -287 -873 -782 -591 -463 -257 -69 193 -76 484 24 260 569 412 370 432 447 -857 -93 -288 288 702 412 -1867 -1103 -2264 -765 -322 -281 -537 -218 955 450 845 1474 1084 520 -579 -1410 -1523 -318 -89 85 679 889 1781 2252 457 191 21 604 -300 1141 -1094 -1202 243 8 -1339 -469 326 68 751 SS 20210512T051731.9Z 7802.220508 27 1 51.16 2 81.31 64.24 86.24 66.89 0.00 1 0.00 1 0 25 3.714e-01 6.123e-03 1.255e-01 1.815e-03 6.793371e-01 9.694551e-04 6.632398e-03 -6.000000e+00 2.086423e-01 225.08 -2.00 3.06 -2.00 321.40 0.00e+00 3.238410e-03 4.827932e-04 2.295749e-03 -6.000000e+00 9.201178e-03 278.98 -2.00 20.00 -2.00 320.89 0.00e+00 6.263 0.001 302.00 328.00 3 9.0384e-02 3.3263e-03 6.1305e-02 -6.0000e+00 5.1593e-01 5.2323e-02 4.8186e-03 3.8034e-02 -6.0000e+00 5.6211e-01 -3.9098e-02 5.2820e-03 1.7314e-02 -6.0000e+00 3.3478e-01 4.8427e-03 2.4932e-03 6.9258e-03 -6.0000e+00 1.4245e-01 1.4819e-03 -8.2875e-04 5.0891e-05 6.4816e-05 -6.0000e+00 9.9239e-03 3.5744e-03 11 1 0 11 8 0 27.50 18.48 0.27 0.00357 -0.00265 404 87 2 8 0 121.800 15.00 18.48 9.20 20.96 20.96 16.3 846.93 -136832 -155909 -135229 -113442 -160618 -87185 -119134 -76970 -138245 -55285 -119151 -60649 -83513 -60517 -25169 -25446 1803 -32316 -23523 -35132 -7306 -41385 -9457 -31326 -9945 -15803 -8061 -28662 -9630 -9769 -10787 4501 -3467 2205 -10914 -2104 -15045 -3616 -6066 1195 -5317 -3636 951 -836 3016 -1566 5680 -411 5495 44 2387 392 4334 2306 1907 735 1245 428 737 1751 959 2813 1358 3008 -732 2962 1502 2073 1757 793 816 -724 111 -579 -499 -763 907 -183 957 -7 191 -860 -2287 -875 -1081 -531 -780 -670 -272 307 429 1024 835 1507 1005 394 898 388 -538 -318 39 38 1292 305 -1458 -1335 -733 -683 -163 1 -418 -162 -49 460 479 1279 634 447 -303 -924 -695 -191 -124 -174 512 5 1377 1332 140 9 239 92 228 255 -449 -381 43 -71 -588 -63 70 172 399 -604 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