File name: Pandora30s1_Juelich_20200811_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T154002.7Z 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_20200811_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: 20200811 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 20200811T053516.1Z 7528.232826 216 1 48.26 2 78.99 79.52 39.38 192.17 0.00 1 0.00 1 0 17 4.580e-01 4.425e-02 1.142e-01 6.359e-03 5.911199e-01 3.458842e-03 8.184450e-03 -6.000000e+00 2.689049e-01 232.56 -2.00 3.80 -2.00 320.85 0.00e+00 1.011938e-02 1.337443e-03 5.040286e-03 -6.000000e+00 1.219658e-02 283.45 -2.00 20.00 -2.00 320.24 0.00e+00 5.046 0.003 302.00 328.00 3 3.7803e+00 1.0869e-02 6.3177e-02 -6.0000e+00 6.7872e-01 4.4730e-01 1.3124e-02 3.9446e-02 -6.0000e+00 7.3465e-01 -7.2962e-01 1.0025e-02 2.1623e-02 -6.0000e+00 4.3379e-01 3.1983e-01 5.0168e-03 8.1637e-03 -6.0000e+00 1.8545e-01 4.2553e-05 -1.3833e-03 1.8327e-04 1.6022e-04 -6.0000e+00 1.2463e-02 -9.0170e-04 0.0000e+00 12 9 8 11 40 0 15.07 21.43 0.37 -0.00090 -0.01130 27 6 1 5 0 1786.950 26.62 20.00 21.43 31.04 33.0 1003.11 900000 -27058 -95200 900000 45328 12909 -147234 -56661 900000 -83871 -49094 -46638 900000 13069 -13695 41290 -22150 97351 900000 -143 67063 900000 124818 -49130 85088 134128 -19246 44570 -74535 127226 229064 41826 38606 12057 1657 68128 1673 86419 95844 33671 141475 38197 47265 52383 11639 49931 24369 87801 -2845 35965 99380 -8459 8058 42973 32563 17275 10968 19610 -24879 35305 40852 27167 5883 15455 999 5244 6923 -17445 2082 5396 13880 7805 -3650 -2896 -11359 18839 -13347 8222 19414 -17903 10266 -2667 -7939 -815 655 -2675 7661 4228 2671 -9623 6863 2576 -2042 1324 -2055 -4262 -2846 617 -2066 -5592 -1223 1459 1898 -2542 -9170 -4896 -2500 -3084 711 2745 -375 1011 -3366 -1350 1340 -2455 -1593 998 261 3697 4858 2476 3359 3552 4580 1964 -3406 2229 -2581 1432 2136 2561 434 1361 -1974 -398 950 -9 180 431 -3768 -2580 900000 -1089 -7552 900000 798 278 -13720 -2316 900000 -4726 -1900 -1834 900000 456 -734 1575 -1660 2475 900000 -10 2448 900000 2360 -5066 2440 2492 -1466 1801 -9116 2407 1813 2399 2592 1053 150 3153 151 4028 4811 3451 5672 4293 5034 5685 1816 5396 3433 7011 -546 4889 8195 -2038 1856 7411 6433 4038 2748 4414 -8034 6472 7362 6200 1789 4740 366 1761 2209 -7233 785 2253 5792 3565 -1825 -1347 -5216 6002 -5223 2780 6655 -10073 5059 -1610 -5457 -551 467 -2100 5704 3337 2126 -8278 4650 1695 -1352 888 -1617 -3811 -2902 691 -2432 -6680 -1345 1402 1792 -2509 -10471 -5656 -2992 -3826 938 3968 -585 1603 -5476 -2044 1941 -3601 -2388 1549 418 5888 7517 3936 5128 5212 6402 2699 -4874 3269 -4321 2557 4071 4891 890 2948 -4537 -932 2236 -23 423 959 -8207 -5471 SS 20200811T054103.4Z 7528.236845 219 1 48.85 2 78.09 80.62 39.57 194.33 0.00 1 0.00 1 0 17 3.880e-01 2.821e-02 1.141e-01 4.251e-03 5.698445e-01 2.297455e-03 7.905455e-03 -6.000000e+00 2.276783e-01 232.56 -2.00 3.80 -2.00 320.68 0.00e+00 9.909875e-03 8.749517e-04 4.542669e-03 -6.000000e+00 1.022460e-02 283.45 -2.00 20.00 -2.00 320.06 0.00e+00 4.695 0.002 302.00 328.00 3 3.5082e+00 7.1062e-03 5.9089e-02 -6.0000e+00 5.7483e-01 2.1725e-01 8.7853e-03 3.7693e-02 -6.0000e+00 6.2191e-01 -3.9323e-01 7.4361e-03 2.2703e-02 -6.0000e+00 3.6742e-01 1.7308e-01 3.7174e-03 9.3980e-03 -6.0000e+00 1.5570e-01 8.1956e-05 -1.5173e-03 1.2071e-04 1.4257e-04 -6.0000e+00 1.0473e-02 -1.2345e-03 0.0000e+00 12 9 8 11 32 0 -21.49 21.44 0.19 -0.00123 -0.01264 44 10 1 5 0 1110.020 26.73 20.00 21.44 31.12 32.8 1003.17 68769 -39592 -136711 900000 -50116 -53939 -172876 -84577 900000 -113553 -94866 -103171 900000 -19695 -20729 -3987 -32959 19595 900000 -9638 13248 232912 51953 -46478 5669 42005 -40328 21663 -64857 72892 80589 10802 29060 -3056 -2384 12671 -6954 51827 -2559 9788 50544 20191 13393 19698 4149 21586 17036 44680 -1138 3446 48391 -5687 1024 22537 15627 10573 392 7697 -14165 16526 20062 11520 6327 7378 2252 2925 4966 -11415 -778 4496 5337 4993 -3085 -102 -6341 8227 -10354 1364 8356 -10054 5919 -1877 -4382 -1071 103 -1386 3770 2037 1385 -3750 3298 1424 -1927 -355 -1452 -3102 -621 433 -160 -1787 -6747 1031 1100 -2711 -5408 -2970 -1912 -1593 29 1782 -29 645 -1376 -307 1952 -977 -866 450 518 1790 3176 1658 2022 2222 2358 1011 -1670 902 -1340 700 994 1224 -79 522 -733 -461 449 226 1 396 -1997 -1939 396 -760 -7107 900000 -1005 -1023 -10168 -2305 900000 -4604 -3185 -4003 900000 -528 -709 -138 -1710 654 900000 -481 534 1135 1447 -3374 252 1402 -2910 862 -5712 1812 2170 659 1698 -262 -193 845 -603 2904 -281 1113 4452 2434 1814 2582 647 2901 2442 5230 -206 626 6456 -1370 250 4737 3660 2665 106 1999 -4241 3799 4653 3228 2018 2593 863 1070 1721 -4750 -322 2031 2612 2422 -1591 -50 -3038 3054 -4326 516 3336 -5463 3183 -1231 -3185 -796 77 -1130 3075 1734 1180 -3218 2561 1047 -1403 -266 -1187 -2987 -646 505 -193 -2140 -8153 1080 1087 -2789 -6187 -3499 -2362 -2019 40 2678 -46 1053 -2247 -470 2859 -1434 -1306 683 839 2952 5083 2597 3177 3353 3417 1421 -2373 1350 -2228 1263 1849 2373 -157 1100 -1609 -1047 1030 525 3 891 -4331 -3996 SS 20200811T054626.3Z 7528.240582 222 1 48.57 2 77.25 81.63 39.77 196.33 0.00 1 0.00 1 0 17 4.899e-01 1.961e-02 1.338e-01 3.304e-03 5.410147e-01 1.755565e-03 6.920343e-03 -6.000000e+00 2.862309e-01 232.56 -2.00 3.80 -2.00 320.48 0.00e+00 4.875133e-03 6.416750e-04 2.191132e-03 -6.000000e+00 1.245832e-02 283.45 -2.00 20.00 -2.00 319.85 0.00e+00 4.409 0.002 302.00 328.00 3 3.4124e+00 5.3496e-03 5.4228e-02 -6.0000e+00 7.2128e-01 7.0903e-02 6.5949e-03 3.2533e-02 -6.0000e+00 7.7922e-01 -2.1834e-01 5.6841e-03 1.7531e-02 -6.0000e+00 4.6070e-01 9.9239e-02 2.8629e-03 6.2119e-03 -6.0000e+00 1.9544e-01 1.2764e-04 -9.0123e-04 9.3508e-05 8.0386e-05 -6.0000e+00 1.3036e-02 -7.7949e-04 0.0000e+00 12 8 8 10 0 0 25.47 21.45 0.18 -0.00078 -0.00755 59 14 1 5 0 823.110 26.73 20.00 21.45 31.20 32.8 1003.15 -50089 -95177 -131358 269888 -43867 -83308 -165005 -76213 900000 -114240 -83978 -82025 340525 -12797 -53129 -3595 -46943 22152 105053 -24639 1525 63827 30353 -40336 12455 17665 -27879 3755 -56181 40266 21630 17944 1684 495 -9613 -992 -7661 19693 17461 2219 30423 7724 12874 12713 1749 12037 3367 24104 -1720 8895 22566 -2840 -2233 13806 8594 2713 2299 3099 -9041 8077 13104 7098 3608 5291 -100 2507 934 -6263 -23 2172 4204 1183 -1556 -1469 -3678 2618 -6769 952 4164 -6940 2179 -1721 -3977 -777 -752 -745 2496 2025 1696 -2133 2374 760 -565 -879 -528 -1717 -395 533 -679 -1776 -2137 -72 74 -1149 -3922 -2699 -1189 -1716 872 1151 516 733 -850 -102 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