File name: Pandora30s1_Juelich_20201119_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T160114.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 30 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora30_OF_v4d20190910.txt Instrument calibration file used: Pandora30s1_CF_v3d20191023.txt Level 1 file used: Pandora30s1_Juelich_20201119_L1_smca1c3d20191023p1-8.txt Full location name: Juelich JULEY Short location name: Juelich Country of location: Germany Location latitude [deg]: 50.9080 Location longitude [deg]: 6.4130 Location altitude [m]: 94 Local noon date: 20201119 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 219 360 Nominal wavelengths inside fitting window [nm]: 305.0309 305.1726 305.3142 305.4558 305.5975 305.7391 305.8807 306.0223 306.1639 306.3054 306.4470 306.5885 306.7301 306.8716 307.0131 307.1546 307.2961 307.4376 307.5790 307.7205 307.8619 308.0034 308.1448 308.2862 308.4276 308.5690 308.7104 308.8518 308.9931 309.1345 309.2758 309.4171 309.5585 309.6998 309.8411 309.9823 310.1236 310.2649 310.4061 310.5474 310.6886 310.8298 310.9710 311.1122 311.2534 311.3945 311.5357 311.6769 311.8180 311.9591 312.1002 312.2413 312.3824 312.5235 312.6646 312.8057 312.9467 313.0877 313.2288 313.3698 313.5108 313.6518 313.7928 313.9337 314.0747 314.2156 314.3566 314.4975 314.6384 314.7793 314.9202 315.0611 315.2020 315.3428 315.4837 315.6245 315.7653 315.9062 316.0470 316.1877 316.3285 316.4693 316.6101 316.7508 316.8915 317.0323 317.1730 317.3137 317.4544 317.5950 317.7357 317.8764 318.0170 318.1576 318.2983 318.4389 318.5795 318.7201 318.8606 319.0012 319.1418 319.2823 319.4228 319.5634 319.7039 319.8444 319.9849 320.1253 320.2658 320.4062 320.5467 320.6871 320.8275 320.9679 321.1083 321.2487 321.3891 321.5295 321.6698 321.8101 321.9505 322.0908 322.2311 322.3714 322.5117 322.6519 322.7922 322.9324 323.0727 323.2129 323.3531 323.4933 323.6335 323.7737 323.9138 324.0540 324.1941 324.3343 324.4744 324.6145 324.7546 324.8947 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20201119T104702.4Z 7628.449333 181 1 12.72 2 70.90 171.82 97.87 120.24 0.00 1 0.00 1 0 25 1.163e-01 1.555e-02 4.473e-02 4.917e-03 3.942346e-01 2.433879e-03 5.043765e-03 -6.000000e+00 6.481751e-02 221.00 -2.00 3.80 -2.00 318.70 0.00e+00 -4.440443e-04 5.138218e-04 2.064282e-04 -6.000000e+00 2.792392e-03 271.74 -2.00 20.00 -2.00 318.20 0.00e+00 3.020 0.001 302.00 328.00 3 4.5092e+00 6.5396e-03 3.6441e-02 -6.0000e+00 1.5930e-01 3.0319e-02 7.4865e-03 2.1296e-02 -6.0000e+00 1.7374e-01 3.6318e-04 5.4951e-03 1.0850e-02 -6.0000e+00 1.0335e-01 -4.4820e-03 2.9510e-03 3.2470e-03 -6.0000e+00 4.4608e-02 1.8500e-04 4.5159e-04 1.3830e-04 3.3612e-05 -6.0000e+00 3.0638e-03 -3.6881e-03 0.0000e+00 12 9 9 12 41 1 99.96 20.93 -0.29 -0.00369 -0.00029 8 8 1 5 0 1394.260 26.32 20.00 20.93 17.07 35.2 1010.01 34981 -3667 -36768 43783 35155 -15358 -54994 -12346 47388 -17963 -28855 -11443 47133 -660 -11775 -2952 -12652 582 26396 -14092 4603 8841 14163 -10222 4862 9099 -5458 6985 -22201 19280 6639 5416 -514 -4343 -7642 1731 -4196 5052 7015 721 -2038 3582 1536 3670 -2863 2553 -2175 5918 -5401 -38 7052 -4195 -1917 2560 2308 1003 1623 1038 -5358 1748 5237 3285 898 3399 -1739 -1898 -1442 -4219 941 204 1544 -420 190 -551 -1926 2343 -3737 1188 2008 -2724 575 -1908 -2953 -1453 354 -237 910 527 888 -948 858 -279 -401 495 -337 97 90 1247 -605 -1678 6968 -560 697 -960 -2532 -1282 162 -971 810 1104 342 332 -358 -1265 -418 -796 -1038 206 -232 -161 1289 318 344 715 1322 -538 -976 767 -941 348 49 367 -293 284 77 -181 563 368 549 -20 -925 -960 839 -141 -1974 1131 890 -577 -3261 -548 1401 -1047 -1908 -664 1858 -48 -1073 -282 -1438 62 2284 -1912 533 977 1528 -1522 675 1278 -894 959 -3670 2219 952 888 -95 -877 -1508 319 -854 1113 1855 229 -740 1301 590 1395 -1112 987 -876 2190 -2247 -15 2888 -2011 -965 1314 1237 539 887 566 -3035 952 2854 1909 592 2269 -1227 -1255 -937 -2835 635 159 1238 -355 157 -436 -1472 1599 -2494 747 1376 -2169 484 -1762 -2942 -1502 372 -268 1029 611 1013 -1084 888 -277 -376 470 -356 111 112 1643 -820 -2222 8312 -653 802 -1149 -3213 -1685 221 -1367 1170 1726 553 539 -562 -1918 -602 -1111 -1486 309 -361 -260 2030 490 530 1049 1904 -749 -1332 1094 -1455 556 80 614 -513 508 143 -347 1091 703 1059 -37 -1698 -1694 SS 20201119T105145.8Z 7628.452614 184 1 49.67 2 70.80 173.00 97.25 121.08 0.00 1 0.00 1 0 25 2.557e-02 5.286e-03 2.967e-03 3.651e-04 3.987435e-01 1.812638e-04 5.159854e-03 -6.000000e+00 1.424999e-02 221.00 -2.00 3.80 -2.00 318.73 0.00e+00 1.013655e-03 3.837695e-05 2.012719e-04 -6.000000e+00 6.139515e-04 271.74 -2.00 20.00 -2.00 318.23 0.00e+00 3.006 0.001 302.00 328.00 3 8.3170e-01 4.8704e-04 3.6526e-02 -6.0000e+00 3.5021e-02 1.4219e-02 5.5777e-04 2.1644e-02 -6.0000e+00 3.8197e-02 1.5836e-03 4.1126e-04 1.1050e-02 -6.0000e+00 2.2721e-02 -5.7403e-03 2.2119e-04 3.4369e-03 -6.0000e+00 9.8060e-03 7.3988e-03 -3.5995e-04 1.0295e-05 3.6016e-05 -6.0000e+00 6.7370e-04 -2.8730e-03 0.0000e+00 10 0 0 10 0 0 99.98 20.97 0.22 -0.00287 -0.00558 1801 425 1 5 0 26.780 26.32 20.01 20.97 17.04 35.4 1010.02 -5004 -6940 -5673 -7964 -10117 -11447 -11482 -7287 -5347 -7039 -8819 -6502 -2706 -2212 -808 -508 -626 52 1177 872 1166 37 994 -105 195 4 -1503 -1321 -2394 -389 833 1191 1941 -673 -2693 -2726 -1894 -716 158 -260 -585 -661 -791 -485 -30 -36 -278 -241 -746 -895 923 763 1097 1032 667 990 501 273 -173 574 963 1655 1924 1859 394 -262 -436 -697 1017 535 572 373 102 507 -162 -288 -924 -1265 -577 -943 -937 -1215 -1877 -1402 -693 -308 314 403 826 633 647 113 -267 155 -126 -14 556 754 209 -205 -522 -877 -302 -360 -1037 -944 -652 -447 288 600 566 382 355 -94 -152 -45 -22 13 112 -230 34 298 509 329 339 -185 256 475 -13 30 -165 -221 -119 -39 -21 -117 475 238 12 -8 -352 -571 -165 -270 -232 -325 -380 -409 -432 -299 -245 -354 -460 -346 -161 -144 -62 -45 -60 5 126 98 135 4 118 -13 27 1 -224 -188 -327 -53 122 198 360 -135 -522 -514 -385 -170 42 -82 -205 -245 -305 -190 -12 -14 -110 -95 -297 -368 402 336 518 520 351 536 279 151 -94 306 530 989 1182 1240 269 -169 -287 -462 676 409 475 300 87 409 -121 -192 -615 -836 -386 -732 -773 -1118 -1858 -1455 -718 -339 361 474 957 699 660 113 -252 149 -134 -16 659 992 290 -276 -649 -1055 -347 -436 -1288 -1230 -890 -608 419 946 898 611 546 -143 -215 -64 -32 19 175 -376 54 465 768 476 497 -258 347 682 -20 49 -268 -370 -207 -68 -40 -225 924 470 24 -14 -629 -1033 SS 20201119T132136.4Z 7628.556672 270 1 48.85 2 75.46 209.53 81.23 149.82 0.00 1 0.00 1 0 17 3.376e-01 2.378e-02 1.341e-01 5.105e-03 5.314886e-01 2.610970e-03 6.625626e-03 -6.000000e+00 1.889896e-01 221.00 -2.00 3.80 -2.00 320.30 0.00e+00 4.878980e-03 8.767146e-04 3.687671e-04 -6.000000e+00 8.331845e-03 271.73 -2.00 20.00 -2.00 319.84 0.00e+00 3.901 0.001 302.00 328.00 3 4.2876e+00 7.5602e-03 4.8076e-02 -6.0000e+00 4.6563e-01 1.2690e-01 9.2460e-03 2.9744e-02 -6.0000e+00 5.0806e-01 -1.4407e-01 8.5198e-03 1.6078e-02 -6.0000e+00 3.0096e-01 6.5868e-02 4.4182e-03 7.4852e-03 -6.0000e+00 1.2972e-01 8.2029e-05 -6.5441e-04 1.4552e-04 7.2194e-05 -6.0000e+00 8.9757e-03 -6.9387e-03 0.0000e+00 12 8 8 10 0 0 99.99 21.52 -0.20 -0.00694 -0.01186 96 23 1 5 0 503.490 26.73 20.00 21.52 16.27 35.5 1011.04 87104 -40915 -131471 42129 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3408 -1287 1999 4775 -2286 -836 3386 2918 866 988 1043 -5556 3531 4025 2228 -23 1090 -334 -200 319 -4298 -301 488 2139 732 -481 -1471 -2404 3184 -4007 1659 3457 -4601 2583 -850 -3651 -1816 -142 -1387 2933 1192 1569 -2542 3133 1794 -638 1114 -1126 -285 -121 1861 -1002 -3107 -337 960 2220 -1197 -4975 -3819 -1219 -2489 820 2072 -61 -91 -2937 -1208 1410 -237 -1614 -58 -743 1131 4203 1693 2605 3303 2094 325 -2465 1885 -1635 789 147 2975 -269 1691 -2309 -706 1836 1837 514 423 -3955 -3450