File name: Pandora30s1_Juelich_20201118_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T160329.9Z 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_20201118_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: 20201118 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 20201118T074226.1Z 7627.321135 72 1 48.21 2 84.84 129.72 116.05 99.00 0.00 1 0.00 1 0 25 7.828e-01 9.777e-02 2.210e-01 1.263e-02 8.131303e-01 7.013149e-03 1.457918e-02 -6.000000e+00 4.417173e-01 221.02 -2.00 3.80 -2.00 321.46 0.00e+00 4.207810e-02 2.196269e-03 8.455945e-03 -6.000000e+00 2.054775e-02 271.86 -2.00 20.00 -2.00 320.98 0.00e+00 9.613 0.019 302.00 328.00 3 -5.3998e-01 2.0130e-02 1.0513e-01 -6.0000e+00 1.0887e+00 1.9204e+00 2.3711e-02 4.5893e-02 -6.0000e+00 1.1900e+00 -1.8416e+00 1.6410e-02 3.7656e-02 -6.0000e+00 7.0423e-01 7.0168e-01 9.0564e-03 3.4454e-02 -6.0000e+00 3.0494e-01 2.0959e-05 -1.1401e-02 3.1694e-04 4.6238e-04 -6.0000e+00 2.1573e-02 -1.8181e-03 0.0000e+00 12 8 8 10 0 0 -45.09 21.39 0.37 -0.00182 -0.08749 56 13 1 5 0 860.660 26.62 20.00 21.39 16.97 35.7 1012.89 170764 92202 49609 900000 900000 111934 -50484 -5423 900000 -61194 -93768 -69919 900000 32989 922 56773 42643 122312 900000 15508 210377 900000 419892 -28056 207635 99387 -73648 83053 -111797 900000 169595 81385 63425 52897 39082 58970 33771 193942 330295 31964 900000 44991 69542 133204 -1798 121279 66728 230180 2384 6251 900000 -14620 27356 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11360 8404 2502 4447 -3016 -1880 -978 5876 4121 3274 -69993 15823 16687 -1662 -13493 -6362 -3219 -9848 -96 2747 -1982 3590 -4753 5849 11054 1844 -5731 3548 1435 12188 19068 9041 7347 9399 9048 5893 -14203 -4138 -18732 -1896 234 10510 2092 2884 -6585 -2974 1566 1622 6455 8122 -8157 -11514 SS 20201118T074750.5Z 7627.324890 75 1 49.04 2 84.19 130.82 115.25 99.94 0.00 1 0.00 1 0 17 4.897e-01 4.306e-02 1.520e-01 7.526e-03 6.896602e-01 4.028911e-03 8.295476e-03 -6.000000e+00 2.751669e-01 221.02 -2.00 3.80 -2.00 321.63 0.00e+00 -9.467959e-03 1.720008e-03 1.108225e-03 -6.000000e+00 1.212833e-02 271.86 -2.00 20.00 -2.00 321.17 0.00e+00 8.775 0.015 302.00 328.00 3 2.4868e-01 1.3316e-02 9.5343e-02 -6.0000e+00 6.7898e-01 8.4632e-01 1.5996e-02 4.2752e-02 -6.0000e+00 7.4209e-01 -1.2217e+00 1.2649e-02 2.0332e-02 -6.0000e+00 4.3915e-01 5.0335e-01 6.4681e-03 9.5999e-03 -6.0000e+00 1.8822e-01 4.6146e-05 2.4217e-04 2.2355e-04 1.2434e-04 -6.0000e+00 1.3019e-02 -2.5819e-03 0.0000e+00 12 8 8 10 0 0 2.24 21.40 0.32 -0.00258 -0.00076 93 22 1 5 0 521.600 26.73 20.00 21.40 17.20 35.6 1012.81 113648 3099 -43830 141275 102511 -22637 -117671 -56639 900000 -43634 -55047 -41805 900000 54791 -23342 22881 -8606 41215 900000 -39397 44141 72229 124784 -31396 97703 159429 -2671 87511 -75266 123294 93504 43447 46858 10432 7410 17126 5613 108373 124941 45434 211082 54527 68584 74225 7361 65088 30906 100156 -2566 63221 105107 -5975 4917 48478 45696 33057 27319 40074 -22082 52425 49571 40056 12480 23381 2213 5839 8930 -21095 12749 9691 22333 11982 4668 -2374 -8746 27210 -20296 15330 20030 -18334 12738 -213 -7990 -2612 5354 127 10319 3575 3929 -9514 5170 1590 -4465 2069 -3216 -3522 -2885 -1437 -6476 -9512 29893 -2086 1710 -2538 -7763 -5263 -2305 -3756 638 2013 -1488 -1076 -4287 -2311 649 -1754 -2670 -696 -367 2588 5004 2402 3562 4054 3578 2356 -2678 2808 -779 936 676 1999 816 649 -648 46 1635 807 222 -526 -3146 -2797 1548 126 -2765 1332 1181 -818 -10644 -3129 900000 -2475 -3472 -2351 900000 1579 -1552 1127 -604 1792 900000 -3544 1781 2081 2157 -2845 2662 2608 -197 2338 -8501 2156 2253 1957 2258 743 501 996 391 3424 4088 3618 3811 4542 4958 4899 906 4365 2850 4972 -337 4537 5871 -1039 829 5689 5817 4987 4465 5626 -5064 5795 5661 5456 2517 4679 562 1377 2012 -6261 3253 2729 6446 3679 1497 -758 -2668 5531 -6263 3429 4890 -7288 4335 -94 -4157 -1370 2780 74 5676 2140 2307 -6075 2662 805 -2378 1113 -2099 -2690 -2536 -1328 -6703 -9928 20638 -1780 1335 -2182 -7157 -5011 -2277 -4099 750 2657 -2248 -1691 -6923 -3520 915 -2489 -3960 -1076 -600 4194 7716 3658 5230 5755 4951 3179 -3814 4203 -1394 1740 1370 4231 1861 1594 -1629 119 4237 2127 574 -1368 -7844 -6599 SS 20201118T075849.4Z 7627.332517 78 1 48.89 2 82.90 133.08 113.64 101.85 0.00 1 0.00 1 0 17 4.620e-01 1.542e-02 1.625e-01 3.189e-03 6.365362e-01 1.690505e-03 7.779213e-03 -6.000000e+00 2.574670e-01 221.02 -2.00 3.80 -2.00 321.36 0.00e+00 8.250497e-03 7.626606e-04 1.007693e-03 -6.000000e+00 1.127733e-02 271.86 -2.00 20.00 -2.00 320.93 0.00e+00 7.452 0.009 302.00 328.00 3 1.8503e-01 5.4812e-03 8.1500e-02 -6.0000e+00 6.3276e-01 2.5344e-01 7.4181e-03 3.7660e-02 -6.0000e+00 6.9012e-01 -3.5448e-01 7.8763e-03 2.2046e-02 -6.0000e+00 4.1058e-01 1.5142e-01 3.8458e-03 1.1381e-02 -6.0000e+00 1.7735e-01 1.7589e-04 -1.3558e-03 9.2420e-05 1.2446e-04 -6.0000e+00 1.2191e-02 -2.4666e-03 0.0000e+00 12 8 8 10 0 0 59.34 21.40 0.21 -0.00247 -0.01265 206 49 1 5 0 235.000 26.73 20.00 21.40 17.71 35.6 1012.79 -93260 -134001 -180584 27537 -20418 -149928 -205032 -155745 106640 -151878 -148366 -139440 900000 -30523 -83964 -32731 -64620 6020 149143 -45563 -6354 -7061 21321 -68602 15892 24530 -57019 -4242 -85171 22374 -7139 5106 2686 7466 -13613 -5233 -5835 14745 20294 1264 38567 11972 16404 16866 -2759 16128 6565 22241 541 5604 27417 -810 4421 17001 12316 5422 9211 4362 -6260 11088 13992 9855 5651 7741 3087 3869 3059 -3632 1647 1861 6036 2244 1215 -721 -3301 3912 -6687 1514 4026 -5032 2541 -931 -3364 -1563 -44 -403 2183 820 1852 -1403 1814 392 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