File name: Pandora30s1_Juelich_20200722_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T153510.3Z 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_20200722_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: 20200722 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 20200722T043650.0Z 7508.192246 84 1 50.10 2 84.00 65.12 96.83 49.82 0.00 1 0.00 1 0 17 7.728e-01 1.643e-01 1.860e-01 2.544e-02 8.097055e-01 1.481966e-02 1.018410e-02 -6.000000e+00 4.819730e-01 233.50 -2.00 3.80 -2.00 320.01 0.00e+00 -2.819879e-02 2.678098e-03 4.684008e-03 -6.000000e+00 2.227326e-02 283.35 -2.00 20.00 -2.00 319.06 0.00e+00 8.529 0.013 302.00 328.00 3 1.6113e+00 4.0174e-02 1.0368e-01 -6.0000e+00 1.2091e+00 2.2333e+00 4.6644e-02 8.0917e-02 -6.0000e+00 1.3087e+00 -1.6406e+00 2.6440e-02 2.2242e-02 -6.0000e+00 7.8077e-01 3.7670e-01 1.3182e-02 2.7562e-02 -6.0000e+00 3.3442e-01 6.0942e-06 6.1493e-03 7.3213e-04 4.1818e-04 -6.0000e+00 2.3160e-02 7.8525e-04 0.0000e+00 12 9 9 12 32 32 18.12 21.41 1.11 0.00079 0.04699 13 3 1 5 0 3805.450 26.62 19.99 21.41 18.49 34.4 1013.04 900000 62842 -46224 900000 105941 65240 900000 913 900000 7291 25949 -3556 900000 107536 3114 75103 10042 117929 900000 900000 74141 900000 900000 -31809 258919 900000 235091 254853 133465 900000 54119 98149 -10532 6206 23710 98632 11709 900000 900000 85689 900000 211518 132268 166442 900000 157050 77409 900000 35797 113867 900000 -40978 3234 900000 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900000 15468 16476 12568 -16108 19945 23556 12422 28841 27171 22960 -40293 24003 18545 13324 18964 20291 -536 8373 13969 7473 -35451 29001 19973 24237 -7380 -43518 -23598 -1367 1520 16117 22710 -4430 -5109 6111 -12077 13305 -11482 -25376 -1885 -16669 14724 22423 -2488 11576 14834 24250 5961 7317 7712 -29872 2258 2605 7324 -5853 12570 3472 -6711 -1766 3343 2583 4891 2821 -16626 SS 20200722T044655.0Z 7508.199248 87 1 47.97 2 82.55 67.00 95.67 51.81 0.00 1 0.00 1 0 17 6.567e-01 5.714e-02 2.030e-01 9.554e-03 8.208934e-01 5.541309e-03 1.009263e-02 -6.000000e+00 3.895386e-01 233.50 -2.00 3.80 -2.00 321.69 0.00e+00 -1.351856e-02 2.343465e-03 1.378820e-03 -6.000000e+00 1.840083e-02 283.35 -2.00 20.00 -2.00 321.14 0.00e+00 7.135 0.008 302.00 328.00 3 1.9737e+00 1.8753e-02 8.5513e-02 -6.0000e+00 9.8322e-01 1.1892e+00 2.2678e-02 4.8666e-02 -6.0000e+00 1.0636e+00 -1.6436e+00 1.5687e-02 2.4672e-02 -6.0000e+00 6.2760e-01 6.5654e-01 7.9025e-03 1.2593e-02 -6.0000e+00 2.6944e-01 2.7006e-05 -1.0276e-03 2.6955e-04 1.9174e-04 -6.0000e+00 1.7936e-02 -8.1757e-04 0.0000e+00 12 9 8 11 8 0 -4.96 21.41 0.48 -0.00082 -0.00854 41 10 1 5 0 1169.830 26.62 20.00 21.41 19.16 34.5 1013.01 900000 57740 5801 900000 143334 70046 -103302 55865 900000 18575 -14113 6343 900000 70508 55235 43384 57891 55535 900000 -1906 92198 900000 900000 -8106 163355 900000 -3924 218653 -87696 900000 900000 63374 67608 385 42587 47392 35464 162436 267863 86751 900000 134830 94079 155600 9904 158976 80885 280005 6339 71837 900000 -28174 16612 100369 97917 57603 30145 69626 -29554 130845 139334 90826 16677 32562 3757 6977 27293 -28645 14116 13165 47152 22404 5743 5163 -20978 60019 -28210 36280 39213 -24606 32368 1602 -8143 2470 16912 -425 20391 14862 12126 -14168 13536 15304 -1124 10293 -1110 -4435 -3739 -1373 -3152 -12338 7310 931 8303 -7687 -10948 -8542 -3018 -5022 279 4925 -3670 199 -7521 -798 3400 -2527 -4482 -1160 -1000 2970 6265 1750 4444 5040 5616 5067 -5240 4892 -4093 1965 2067 2230 657 1480 -1137 -412 2053 637 116 818 -5217 -2471 900000 2656 426 900000 1963 1747 -13486 1831 900000 967 -1003 368 900000 2724 2756 2631 3115 3069 900000 -170 3202 900000 900000 -785 3289 900000 -388 2145 -14344 900000 900000 2852 3208 37 2416 2520 2116 3355 2489 5509 900000 5987 6169 5222 1264 4596 4928 2602 781 5118 900000 -6270 2551 7566 7988 6959 4895 7801 -7835 6823 6546 7409 3026 5590 889 1546 4886 -8945 3404 3677 10171 6345 1854 1541 -7213 8553 -8651 6387 7269 -9787 8992 659 -4041 1171 7403 -234 9513 7424 6102 -8789 6243 6587 -539 4773 -668 -3237 -3155 -1233 -3091 -13034 6124 740 5737 -6494 -9845 -7920 -2822 -5220 312 6024 -5222 287 -11835 -1139 4672 -3617 -6447 -1709 -1557 4503 9309 2595 6225 6813 7322 6402 -7356 6910 -7032 3609 4160 4576 1465 3531 -2858 -1063 5248 1658 294 2017 -12628 -5463 SS 20200722T045808.4Z 7508.207042 90 1 48.87 2 80.91 69.08 94.33 54.00 0.00 1 0.00 1 0 17 4.909e-01 2.484e-02 1.549e-01 4.078e-03 7.278611e-01 2.274807e-03 9.267263e-03 -6.000000e+00 2.890799e-01 233.50 -2.00 3.80 -2.00 321.44 0.00e+00 8.433067e-03 1.100476e-03 3.952641e-03 -6.000000e+00 1.274814e-02 283.35 -2.00 20.00 -2.00 320.90 0.00e+00 6.000 0.005 302.00 328.00 3 1.8437e+00 7.8555e-03 7.4775e-02 -6.0000e+00 7.3147e-01 4.2628e-01 1.0466e-02 4.6391e-02 -6.0000e+00 7.9085e-01 -6.8228e-01 9.5928e-03 2.6706e-02 -6.0000e+00 4.6648e-01 2.9065e-01 4.5460e-03 1.0305e-02 -6.0000e+00 1.9675e-01 1.0587e-04 -1.4779e-03 1.1206e-04 1.5474e-04 -6.0000e+00 1.3095e-02 -1.5123e-03 0.0000e+00 12 8 8 10 0 0 -4.32 21.42 0.16 -0.00151 -0.01262 99 23 1 5 0 488.610 26.62 19.99 21.42 20.06 34.5 1012.99 132596 -118455 -153998 3953 -40155 -91438 -204730 -110856 900000 -148943 -175845 -136070 900000 -34614 -96987 -25691 -56269 -3147 900000 -57171 15400 140485 104914 -71343 9960 42669 -71278 33206 -99794 116668 25431 25812 -38 -1842 1508 3665 15401 48450 65018 23119 103830 25780 23430 44299 8136 40715 24889 80457 7498 41933 48317 -3406 11663 31518 29792 17094 14164 11544 -8681 23876 25408 21840 7275 16311 2850 10861 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