File name: Pandora159s1_Wakkerstroom_20210828_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T032603.6Z 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_20210828_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: 20210828 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 20210828T060923.6Z 7910.256523 218 1 49.94 2 67.07 64.98 70.62 298.55 0.00 1 0.00 1 0 17 7.252e-01 5.668e-02 3.223e-01 5.013e-02 3.110478e-01 2.495744e-02 3.097299e-03 -6.000000e+00 4.108380e-01 226.82 -2.00 3.06 -2.00 318.84 0.00e+00 9.778090e-03 5.451317e-03 9.179235e-04 -6.000000e+00 1.813790e-02 276.94 -2.00 20.00 -2.00 318.23 0.00e+00 2.547 0.000 302.00 328.00 3 7.6134e+00 6.8282e-02 2.6502e-02 -6.0000e+00 1.0200e+00 9.1462e-02 7.8107e-02 2.2020e-02 -6.0000e+00 1.1103e+00 -9.9071e-03 5.2484e-02 7.8925e-03 -6.0000e+00 6.5897e-01 2.3276e-03 2.7059e-02 9.5284e-03 -6.0000e+00 2.7909e-01 2.0360e-05 1.5650e-03 1.4652e-03 7.7952e-05 -6.0000e+00 1.9545e-02 4.6095e-04 12 8 8 10 0 0 99.00 18.82 2.57 0.00046 0.01222 26 6 4 8 0 1908.270 14.99 18.82 16.55 21.27 21.17 16.9 877.62 57378 -31071 562297 -34456 900000 -112925 -16893 137329 19375 486116 -60717 206364 -27987 -14548 -23921 44163 2298 87336 15866 -17212 21051 36162 -27659 32954 115930 10758 12527 -28152 958 -11475 71512 -7024 1535 80036 15152 18629 -17902 160190 -678 13303 15997 16398 -11157 -8603 -6962 12293 -15090 12091 3159 -18071 35887 10429 8985 -5935 -1663 1729 13470 -12769 -5245 3141 10110 12906 2049 8030 -2015 -1554 -6262 6811 901 -2432 -5600 881 -2457 5590 -4294 3349 -2179 -16689 4804 -2311 7750 -12790 6985 -8980 3286 -857 -2816 127 1819 1637 2017 2619 1446 6718 441 3601 674 3803 -1867 5591 -251 827 -176 3741 -95 -985 2255 -7738 339 -2666 4607 -1289 39 -131 -5286 985 5118 5865 -463 -3523 -3177 2943 3351 -445 -1386 2223 -1194 -232 227 -1534 5409 -2795 -4880 -2005 565 875 -26 1390 -472 2595 1828 -566 -1948 2805 -2534 27485 -2807 900000 -16365 -1023 6713 956 23762 -6313 10087 -2742 -1529 -3230 3541 290 5270 1953 -2995 2589 3789 -5263 3602 5972 1501 1711 -5449 139 -1943 6188 -1407 310 7861 2564 3007 -4418 8648 -193 3745 4730 5066 -4667 -3597 -2915 4355 -6949 4266 1209 -8601 10881 4328 3982 -3162 -868 881 6180 -7419 -2803 1564 4940 6712 1296 5123 -1415 -1011 -3978 3776 572 -1798 -4608 702 -2004 4027 -3149 2056 -1295 -11114 2808 -1645 5633 -12459 5952 -9347 3232 -938 -3313 150 2099 1814 2062 2429 1253 5475 410 3636 782 4757 -2602 7109 -313 939 -191 4072 -116 -1276 2957 -11704 503 -4363 7411 -2222 64 -201 -7840 1303 6558 7830 -703 -5813 -5312 4553 5000 -660 -1982 2930 -1549 -303 320 -2376 8238 -4718 -8582 -3591 1042 1684 -52 2786 -960 4997 3410 -1035 -3534 SS 20210828T061616.4Z 7910.261300 221 1 51.11 2 65.69 63.90 71.95 297.55 0.00 1 0.00 1 0 25 1.238e-02 6.534e-03 7.360e-03 1.109e-03 3.213869e-01 5.509741e-04 3.388720e-03 -6.000000e+00 7.000405e-03 226.82 -2.00 3.06 -2.00 318.83 0.00e+00 1.922464e-03 1.173084e-04 3.445467e-04 -6.000000e+00 3.041419e-04 276.94 -2.00 20.00 -2.00 318.20 0.00e+00 2.413 0.000 302.00 328.00 3 2.8052e+00 1.5017e-03 2.4555e-02 -6.0000e+00 1.7392e-02 -2.8914e-02 1.7174e-03 1.5118e-02 -6.0000e+00 1.8928e-02 2.9342e-03 1.1870e-03 7.2273e-03 -6.0000e+00 1.1245e-02 -5.2447e-03 6.2326e-04 2.7310e-03 -6.0000e+00 4.7607e-03 3.0012e-03 -3.7982e-04 3.2426e-05 2.6716e-05 -6.0000e+00 3.3078e-04 2.1701e-04 11 8 0 10 0 0 100.00 18.82 0.27 0.00022 -0.00264 367 79 2 8 0 134.120 14.99 18.82 16.47 21.27 21.17 17.0 879.24 -2625 -174 -4464 -3028 -6438 766 -3240 1589 -1686 -1031 -1409 -408 -664 -1003 -806 -2616 290 -1990 -413 -1488 -886 -15 1502 179 -856 408 -1199 -89 478 2432 1074 2401 219 -1598 -1426 684 -776 305 -306 -1623 -1531 -980 -1277 -1373 -111 -1369 -325 -390 1 516 1159 819 1637 765 260 1049 407 369 178 922 1204 1485 1353 702 -689 432 416 816 2024 267 -3 -452 -257 -284 -43 713 937 1088 1393 -285 -377 -1036 -2105 -806 -1116 -836 -733 -470 -237 -40 573 671 1281 2157 1506 730 867 192 -754 -565 -267 -410 658 638 -1087 -765 -760 -530 -79 -34 -262 -254 -158 219 418 1146 635 523 -140 -740 -823 -403 -245 -5 901 373 1344 1734 580 344 173 70 195 496 -210 -416 76 -60 -511 -117 -287 -235 90 -122 -9 -242 -152 -301 32 -149 79 -96 -61 -84 -25 -48 -86 -80 -295 34 -249 -54 -203 -122 -2 206 26 -135 66 -196 -14 69 346 168 413 42 -323 -271 125 -157 72 -88 -549 -568 -380 -514 -560 -45 -564 -131 -155 0 206 489 376 793 362 128 524 208 188 97 496 669 817 818 460 -459 265 260 500 1210 185 -2 -359 -203 -215 -30 485 577 645 874 -207 -285 -875 -1924 -764 -1133 -907 -840 -554 -278 -45 595 636 1110 1817 1367 745 989 246 -1037 -766 -337 -472 707 708 -1332 -989 -1028 -750 -117 -55 -448 -408 -267 343 602 1545 858 741 -215 -1210 -1370 -658 -388 -7 1288 511 1732 2247 821 530 282 118 336 889 -403 -777 144 -116 -1005 -224 -527 -447 166 SS 20210828T070104.1Z 7910.292409 246 1 51.19 2 57.06 56.03 80.84 291.62 0.00 1 0.00 1 0 25 1.038e-02 6.774e-03 2.262e-03 6.900e-04 2.458617e-01 3.429751e-04 2.626614e-03 -6.000000e+00 5.871829e-03 226.83 -2.00 3.06 -2.00 317.56 0.00e+00 8.777988e-04 5.137250e-05 1.335422e-04 -6.000000e+00 2.551068e-04 276.94 -2.00 20.00 -2.00 316.92 0.00e+00 1.833 0.000 302.00 328.00 3 2.7542e+00 9.0782e-04 1.8613e-02 -6.0000e+00 1.4588e-02 -1.5149e-02 1.0229e-03 1.1177e-02 -6.0000e+00 1.5877e-02 5.2147e-04 6.2240e-04 5.4843e-03 -6.0000e+00 9.4319e-03 -3.5623e-03 3.0928e-04 1.7242e-03 -6.0000e+00 3.9934e-03 5.6350e-03 -2.4434e-04 1.9902e-05 1.8708e-05 -6.0000e+00 2.7744e-04 -8.5062e-05 11 8 0 10 0 0 99.99 18.83 0.24 -0.00009 -0.00192 368 79 2 8 0 133.960 15.00 18.83 19.69 21.27 21.17 17.5 896.87 -1758 -2532 -3281 -4519 -1324 -1490 1470 -636 927 -1879 459 597 560 -221 -184 -1353 -679 -203 -150 841 -531 1208 1072 807 578 -134 -1025 -56 1292 2010 1938 1988 1458 -2010 -366 394 -22 171 -188 -1568 -1564 -953 -1364 -1068 -517 -1160 -892 -168 -649 951 1022 777 1047 681 667 1109 517 388 835 902 1547 1046 1069 349 -754 370 216 847 1911 257 -117 -115 -375 -183 -378 565 597 1060 1260 -148 -715 -1189 -1997 -1005 -983 -953 -506 -573 -275 -398 518 486 1112 1915 1380 757 669 217 -785 -597 -486 -234 713 628 -1049 -723 -415 -691 -73 -95 -176 -254 -43 121 442 1013 772 510 108 -741 -806 -300 -217 -28 844 470 1154 1799 595 429 199 83 164 430 -223 -379 -2 -79 -461 -314 -162 -342 39 -191 -301 -399 -519 -132 -143 144 -72 114 -247 58 77 81 -37 -35 -283 -147 -45 -35 199 -130 288 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