File name: Pandora159s1_Wakkerstroom_20200625_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T155040.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v6d20191220.txt Level 1 file used: Pandora159s1_Wakkerstroom_20200625_L1_smca1c6d20191220p1-8.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: 20200625 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: Update session 4 based on session2 for SO2 First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0490 305.1898 305.3306 305.4713 305.6121 305.7529 305.8936 306.0343 306.1750 306.3157 306.4564 306.5971 306.7378 306.8785 307.0191 307.1597 307.3004 307.4410 307.5816 307.7222 307.8628 308.0033 308.1439 308.2845 308.4250 308.5655 308.7060 308.8465 308.9870 309.1275 309.2680 309.4084 309.5489 309.6893 309.8297 309.9701 310.1105 310.2509 310.3913 310.5317 310.6720 310.8124 310.9527 311.0930 311.2333 311.3736 311.5139 311.6542 311.7944 311.9347 312.0749 312.2152 312.3554 312.4956 312.6358 312.7760 312.9161 313.0563 313.1964 313.3366 313.4767 313.6168 313.7569 313.8970 314.0371 314.1771 314.3172 314.4572 314.5973 314.7373 314.8773 315.0173 315.1573 315.2973 315.4372 315.5772 315.7171 315.8570 315.9969 316.1369 316.2767 316.4166 316.5565 316.6964 316.8362 316.9760 317.1159 317.2557 317.3955 317.5352 317.6750 317.8148 317.9545 318.0943 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0721 319.2118 319.3514 319.4910 319.6307 319.7703 319.9098 320.0494 320.1890 320.3285 320.4681 320.6076 320.7471 320.8866 321.0261 321.1656 321.3051 321.4445 321.5840 321.7234 321.8628 322.0023 322.1417 322.2810 322.4204 322.5598 322.6991 322.8385 322.9778 323.1171 323.2564 323.3957 323.5350 323.6743 323.8135 323.9528 324.0920 324.2312 324.3704 324.5096 324.6488 324.7880 324.9272 --------------------------------------------------------------------------------------- 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: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: 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 78: 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 79: 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 80: 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 81: 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 82: 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 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 --------------------------------------------------------------------------------------- SU 20200625T051730.8Z 7481.220495 6 1 49.57 2 85.36 60.65 128.34 87.88 0.00 1 0.00 1 0 25 7.207e-01 7.307e-02 5.677e-01 6.657e-02 9.559066e-01 3.948558e-02 1.038647e-02 -6.000000e+00 4.228101e-01 224.93 -2.00 3.06 -2.00 322.07 0.00e+00 1.849348e-02 1.468578e-02 6.266583e-04 -6.000000e+00 1.993861e-02 277.11 -2.00 20.00 -2.00 321.58 0.00e+00 10.419 0.007 302.00 328.00 3 1.1151e+00 1.2799e-01 9.7266e-02 -6.0000e+00 1.0484e+00 1.9530e+00 1.5056e-01 6.0227e-02 -6.0000e+00 1.1501e+00 -1.9864e+00 9.4912e-02 2.1714e-02 -6.0000e+00 6.7659e-01 6.8077e-01 5.3209e-02 1.8992e-02 -6.0000e+00 2.8395e-01 9.9327e-06 -4.9594e-03 1.7453e-03 2.7469e-04 -6.0000e+00 1.9682e-02 -5.6693e-04 0.0000e+00 12 8 8 10 0 0 42.97 14.00 0.40 -0.00057 -0.03783 14 3 4 8 0 3499.070 14.75 14.00 -4.42 17.49 17.39 11.8 797.66 -2728 -31529 900000 135363 -63115 43039 900000 58295 415613 212213 -127698 30123 -73629 -85597 184125 89110 131239 900000 900000 114582 -9245 174638 900000 66866 79198 900000 900000 10058 94183 -140585 -46287 -44217 58821 900000 -72699 -46912 40577 92480 63460 59065 900000 900000 -41048 86764 900000 54788 129401 60444 33025 -18402 900000 -1143 900000 67802 169166 82866 179025 54952 9744 172423 10493 1696 -22211 128473 10528 17734 43431 13846 39735 15777 35739 112603 48135 3523 27336 -32273 32013 -32501 -747 -8016 -18694 10548 243 37154 8411 17272 4514 16398 23313 32208 -10857 19720 -1018 -2808 -11674 -9581 13349 31 6540 -2008 -4130 -12283 -1894 -23591 -13314 9721 -16342 1200 -5895 5605 3232 285 -3952 -137 -2807 1371 4916 2140 191 337 2482 -4214 -951 7034 6765 4528 15043 -6131 -1473 2684 35 1336 -1265 2361 -2623 238 -2477 3527 85 -403 -409 473 -2118 -202 -3476 900000 8765 -6986 2787 900000 3775 26911 13741 -13410 1950 -5888 -10177 11922 5770 8498 900000 900000 7419 -864 11308 900000 4330 5128 900000 900000 651 6098 -27154 -4377 -5054 3809 900000 -12332 -5547 2627 5988 4109 3824 900000 900000 -6541 5618 900000 3548 8379 3914 2764 -2651 900000 -165 900000 5687 10954 6129 11592 4949 1262 11164 1249 234 -4365 8319 1909 3035 5726 2469 5922 3313 6798 10599 8143 837 4584 -8368 4108 -7782 -149 -2076 -6408 3167 89 10224 3177 6270 1924 6380 8453 10344 -4936 6258 -380 -1109 -5693 -5466 7269 23 5094 -1776 -3582 -10339 -1260 -18142 -9635 6001 -13649 911 -5329 5251 3589 365 -5525 -186 -3796 1717 5954 2785 268 490 3505 -6015 -1245 8283 7802 5199 15147 -7819 -2066 4307 67 2751 -2880 5584 -7003 658 -7218 9833 244 -1132 -1071 1132 -4851 SU 20200625T053146.0Z 7481.230393 9 1 49.92 2 82.62 58.85 125.31 86.46 0.00 1 0.00 1 0 25 5.199e-01 7.627e-03 3.435e-01 5.342e-03 7.687639e-01 3.005864e-03 7.440414e-03 -6.000000e+00 2.931083e-01 224.93 -2.00 3.06 -2.00 321.87 0.00e+00 5.009575e-03 1.625334e-03 4.484886e-03 -6.000000e+00 1.371916e-02 277.11 -2.00 20.00 -2.00 321.42 0.00e+00 7.224 0.002 302.00 328.00 3 9.2793e-01 1.0997e-02 7.4542e-02 -6.0000e+00 7.2495e-01 1.0905e-01 1.7195e-02 5.4802e-02 -6.0000e+00 7.8948e-01 -1.2490e-01 1.9834e-02 2.2779e-02 -6.0000e+00 4.7053e-01 4.0101e-02 9.1161e-03 8.8747e-03 -6.0000e+00 2.0536e-01 2.7871e-04 -8.9687e-04 1.5239e-04 8.6564e-05 -6.0000e+00 1.4146e-02 1.2923e-04 0.0000e+00 11 8 0 10 0 0 2.95 16.16 0.31 0.00013 -0.00661 126 27 4 8 0 392.980 15.00 16.16 -2.10 19.12 19.12 11.1 808.48 900000 900000 -163287 900000 -84561 -156168 -226218 -204686 -226237 -128055 -230571 900000 -139356 -59699 -63207 -100078 -113606 -48134 -59930 6797 -86348 -43512 -8611 -12609 -39557 -71979 53493 -42659 27735 -45752 -10208 -13929 20318 -25979 -35066 5633 16816 -12485 -17360 21761 -10230 4352 -7314 11696 7910 4634 13593 -458 -2764 -2512 13824 -3188 5328 9558 2416 596 5422 -2670 5996 946 -1386 341 6446 30 1888 4814 1965 2353 2033 1461 1210 473 894 1468 -1018 -351 2054 -635 -645 593 -373 -1139 -3149 -927 467 147 -883 196 102 292 766 496 612 2558 209 150 727 -48 -1075 -131 655 145 1064 188 -1804 -1327 -1476 -1491 -525 -161 -313 -626 290 262 112 1417 671 364 -29 -552 -1143 -166 -445 -26 705 274 1124 2026 827 -30 593 188 79 145 -224 -466 -108 156 -516 -69 141 -68 253 900000 900000 -850 900000 -440 -813 -1392 -1162 -1820 -667 -2292 900000 -857 -311 -329 -947 -1452 -364 -567 39 -1185 -391 -63 -105 -431 -1158 278 -525 188 -650 -138 -224 279 -627 -913 96 279 -331 -600 618 -460 185 -374 515 371 232 650 -27 -177 -175 922 -288 494 936 273 72 649 -348 695 113 -174 46 958 6 370 920 385 479 461 355 329 137 255 393 -278 -85 453 -147 -169 186 -129 -461 -1448 -445 236 80 -508 115 60 166 406 247 295 1365 119 100 567 -44 -1103 -136 636 127 824 144 -1508 -1174 -1378 -1495 -576 -200 -441 -958 449 398 162 1942 926 527 -45 -889 -1830 -252 -646 -36 946 357 1400 2590 1220 -52 1131 389 174 339 -565 -1247 -293 429 -1434 -185 351 -158 558 SU 20200625T053742.9Z 7481.234524 12 1 49.77 2 81.50 58.07 124.05 85.87 0.00 1 0.00 1 0 25 4.056e-01 6.387e-03 2.330e-01 2.962e-03 6.941939e-01 1.616213e-03 6.798925e-03 -6.000000e+00 2.285635e-01 224.93 -2.00 3.06 -2.00 321.52 0.00e+00 3.907815e-03 7.986597e-04 2.842411e-03 -6.000000e+00 9.977845e-03 277.11 -2.00 20.00 -2.00 321.04 0.00e+00 6.384 0.002 302.00 328.00 3 7.7818e-01 5.5669e-03 6.3560e-02 -6.0000e+00 5.6541e-01 5.8410e-02 8.1369e-03 4.1662e-02 -6.0000e+00 6.1545e-01 -5.0832e-02 9.1023e-03 1.8506e-02 -6.0000e+00 3.6623e-01 7.3724e-03 4.2967e-03 7.6647e-03 -6.0000e+00 1.5628e-01 6.6413e-04 -9.0430e-04 8.4428e-05 7.1352e-05 -6.0000e+00 1.0826e-02 9.4258e-04 0.0000e+00 10 0 0 10 0 0 25.52 16.66 0.27 0.00094 -0.00585 208 45 4 8 0 236.940 15.00 16.66 -1.17 19.54 19.54 11.2 814.65 -129603 -40513 -90773 -70371 -215880 -154215 -151774 -132603 65681 -173337 -102747 -116439 -68588 -39742 -57111 -68485 -38295 -23424 -18878 -9385 -31445 -12447 -30386 -14912 -13665 -12629 -26648 -27762 -19618 -16275 -12324 -7735 15496 -14723 -3103 -6715 -13152 523 -1528 -3320 -1928 -4427 -1348 -996 3807 -2152 -166 5761 1335 4400 1702 5828 2298 3881 1871 1201 47 -105 432 892 2588 3457 3431 2436 1191 1140 1848 -390 2690 3 406 3 -175 1698 -1684 1404 -1632 -447 1389 395 -720 -408 -1601 -1122 -399 -1687 -677 -692 -64 -331 648 1059 979 1040 1637 550 427 582 -361 -427 -381 160 977 1102 -1262 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