File name: Pandora159s1_Wakkerstroom_20220122_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035322.6Z 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_20220122_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: 20220122 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 20220122T042628.3Z 8057.185050 177 1 41.89 2 77.80 106.03 57.06 302.46 0.00 1 0.00 1 0 25 4.980e-01 1.184e-02 2.443e-01 5.742e-03 5.249541e-01 2.977010e-03 5.308954e-03 -6.000000e+00 2.828122e-01 227.63 -2.00 3.06 -2.00 320.58 0.00e+00 3.961502e-03 1.157564e-03 3.346416e-04 -6.000000e+00 1.253473e-02 282.60 -2.00 20.00 -2.00 319.96 0.00e+00 4.597 0.001 302.00 328.00 3 3.5504e+00 9.2171e-03 4.4351e-02 -6.0000e+00 7.0260e-01 6.1622e-02 1.1646e-02 2.4486e-02 -6.0000e+00 7.6328e-01 -2.0340e-02 1.0832e-02 1.2901e-02 -6.0000e+00 4.5468e-01 4.1482e-04 5.4550e-03 5.7201e-03 -6.0000e+00 1.9331e-01 1.9082e-04 -8.1230e-04 1.6501e-04 5.6024e-05 -6.0000e+00 1.3314e-02 -4.6312e-03 12 9 9 12 1 1 99.92 19.20 0.28 -0.00463 -0.01074 24 6 2 8 0 1668.170 15.00 19.20 16.66 21.48 21.48 19.4 870.44 182745 -67277 13604 -89904 359478 -104484 -63356 38183 -27573 325483 -70645 17319 -21725 100261 234 129112 -26475 -6501 -33941 -5786 -22537 -15950 26194 1678 -71 -20256 11258 -20967 19600 -8386 23136 -17357 3461 -10515 -8 -7589 -2723 -382 1003 -3614 -8855 3937 -1282 4355 -6707 4953 -4285 -871 -2969 -667 3723 1601 4371 2110 2153 723 1912 618 3150 -610 3451 1459 -427 -727 2197 936 1891 1884 1351 65 -1820 -709 887 753 529 -483 1399 1824 3401 1898 2162 -1105 54 -2056 152 -1898 416 -925 -214 -420 400 744 682 3289 969 1776 -81 1130 -878 -348 -284 -526 693 -150 -642 -1044 -6894 -40 523 -65 91 -543 -17 -216 171 516 1090 915 -81 -409 -550 479 54 1104 941 930 1726 2001 -149 113 -126 493 187 201 -196 -591 282 -212 -909 -657 527 -150 304 1023 -879 88 -1508 2013 -1815 -795 214 -312 1823 -1334 157 -348 633 5 893 -892 -198 -1442 -198 -936 -623 707 61 -3 -1030 430 -1060 663 -392 921 -1192 221 -815 -1 -542 -203 -33 103 -460 -1323 557 -200 661 -1150 776 -744 -150 -536 -124 724 351 1015 537 575 203 544 177 863 -172 970 457 -153 -289 880 367 709 714 561 31 -979 -394 483 390 254 -211 556 716 1441 947 1242 -738 38 -1578 122 -1651 373 -863 -198 -378 334 576 500 2375 780 1608 -85 1312 -1118 -440 -338 -572 692 -153 -705 -1218 -8881 -51 714 -97 148 -922 -29 -347 258 738 1558 1364 -129 -683 -921 776 85 1667 1373 1306 2308 2732 -228 190 -228 929 364 410 -425 -1343 651 -497 -2153 -1513 1145 -313 615 SS 20220122T043210.5Z 8057.189010 179 1 49.53 2 76.58 105.45 58.10 301.38 0.00 1 0.00 1 0 25 9.936e-02 7.484e-03 6.005e-02 2.378e-03 4.934961e-01 1.222330e-03 5.040269e-03 -6.000000e+00 5.642762e-02 227.63 -2.00 3.06 -2.00 320.22 0.00e+00 1.513692e-03 4.259171e-04 7.488915e-04 -6.000000e+00 2.500996e-03 282.60 -2.00 20.00 -2.00 319.56 0.00e+00 4.207 0.000 302.00 328.00 3 2.6802e+00 3.6619e-03 4.1125e-02 -6.0000e+00 1.4018e-01 5.0139e-02 4.5190e-03 2.3623e-02 -6.0000e+00 1.5229e-01 -1.0654e-02 3.9963e-03 1.1345e-02 -6.0000e+00 9.0720e-02 -4.6467e-03 2.0384e-03 3.8165e-03 -6.0000e+00 3.8570e-02 6.4540e-04 -7.1439e-04 6.8535e-05 3.8492e-05 -6.0000e+00 2.6564e-03 -4.5233e-03 11 8 0 10 0 0 99.96 19.20 0.30 -0.00452 -0.00989 75 16 4 8 0 654.620 14.99 19.20 16.80 21.48 21.48 19.3 870.56 17040 -68777 1222 -46856 -13256 -998 -24150 -22690 -34770 -24117 -25436 -20695 -32279 8695 -16184 2131 -4591 -6743 4262 -9092 3063 -6028 -3023 -2999 -3179 -11527 4873 -4227 -640 -3476 5389 -4945 2695 -2952 -3518 616 -5696 1333 -794 -484 -3887 -911 -5175 -681 -943 -601 526 131 1185 1120 2414 471 1697 1203 2099 1440 1135 -277 1078 892 1532 1584 772 1682 -1158 1470 351 1310 1708 900 -268 -155 -610 257 -2 1040 1818 -395 2205 36 278 -1301 -1821 -1418 -869 -878 -827 -280 -320 288 505 976 882 2173 939 797 671 473 -572 -304 -540 -491 1221 934 -1222 -890 -2705 -906 17 -234 -202 -237 -200 262 421 1312 975 628 -178 -467 -895 -217 -180 -66 643 561 1153 1834 684 216 204 -6 116 249 -287 -650 85 -106 -508 -389 196 -99 281 126 -1262 13 -770 -143 -9 -305 -325 -638 -427 -472 -401 -850 189 -503 64 -163 -266 161 -415 127 -275 -139 -149 -172 -715 259 -237 -34 -195 314 -372 213 -261 -299 50 -535 139 -104 -75 -695 -169 -1045 -134 -188 -121 106 27 245 242 562 123 477 365 664 476 386 -95 357 292 514 580 319 759 -555 657 151 565 802 489 -162 -98 -384 152 -1 505 805 -176 1043 20 180 -964 -1473 -1206 -785 -848 -777 -269 -308 287 466 828 703 1714 819 792 701 559 -738 -389 -649 -532 1303 1015 -1353 -1040 -3379 -1176 24 -357 -335 -409 -340 421 629 1839 1369 924 -282 -778 -1506 -353 -282 -100 921 771 1628 2624 1008 354 361 -12 223 503 -621 -1380 183 -233 -1126 -835 426 -205 561 SS 20220122T043829.6Z 8057.193398 182 1 49.55 2 75.23 104.82 59.26 300.22 0.00 1 0.00 1 0 25 5.185e-02 6.622e-03 1.877e-02 1.112e-03 4.568827e-01 5.642939e-04 4.693277e-03 -6.000000e+00 2.944657e-02 227.63 -2.00 3.06 -2.00 319.77 0.00e+00 1.073051e-03 1.700326e-04 5.129944e-04 -6.000000e+00 1.305123e-03 282.60 -2.00 20.00 -2.00 319.09 0.00e+00 3.845 0.000 302.00 328.00 3 1.8175e+00 1.6233e-03 3.7583e-02 -6.0000e+00 7.3155e-02 4.3933e-02 1.9423e-03 2.1326e-02 -6.0000e+00 7.9473e-02 -1.0593e-02 1.6118e-03 1.0381e-02 -6.0000e+00 4.7342e-02 -3.6323e-03 8.4157e-04 3.2593e-03 -6.0000e+00 2.0128e-02 2.1265e-03 -6.6204e-04 3.1838e-05 3.4033e-05 -6.0000e+00 1.3862e-03 -4.6399e-03 11 8 0 10 0 0 99.88 19.20 0.23 -0.00464 -0.00961 181 39 4 8 0 272.180 15.00 19.20 16.90 21.48 21.48 19.3 871.37 -14752 -18494 -16106 -23441 -11864 -25693 -6428 -16704 -11221 -15686 -16389 -13932 -6579 -5954 -5673 -4331 -3939 -1438 -1547 -846 -3802 1245 -301 -2329 -2978 -3818 -2686 -2899 394 -2231 -748 136 1727 -4184 -745 -1760 -234 -1031 -687 -1529 -2510 -1428 -1618 -1246 -427 -715 -1479 25 -278 1594 1997 638 1442 348 944 968 580 12 807 842 2074 1791 1786 978 -182 668 984 878 1766 515 -137 -301 -639 102 -459 800 760 1369 1324 -81 -422 -983 -2034 -1255 -1085 -1109 -551 -698 44 -308 685 637 1143 1937 1382 736 649 277 -731 -405 -196 -101 881 948 -1096 -756 -1279 -652 -226 -179 -262 -408 30 123 416 1248 983 605 59 -845 -841 -193 -99 -126 602 402 1141 1758 459 339 45 10 -37 324 -305 -374 41 7 -480 -316 58 -161 198 -221 -328 -294 -441 -199 -482 -107 -355 -232 -363 -393 -353 -185 -204 -233 -202 -200 -77 -88 -50 -239 75 -19 -162 -225 -307 -215 -223 28 -169 -63 13 182 -493 -81 -190 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