File name: Pandora30s1_Juelich_20201027_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T155252.5Z 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_20201027_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: 20201027 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 20201027T072733.5Z 7605.310805 151 1 49.02 2 81.12 123.55 137.40 336.72 0.00 1 0.00 1 0 25 6.159e-01 1.181e-02 8.790e-02 1.862e-03 7.515316e-01 9.963955e-04 9.085038e-03 -6.000000e+00 3.459670e-01 223.11 -2.00 3.80 -2.00 321.38 0.00e+00 5.300789e-03 4.741654e-04 1.130059e-03 -6.000000e+00 1.497118e-02 274.78 -2.00 20.00 -2.00 320.94 0.00e+00 6.130 0.005 302.00 328.00 3 4.2963e-01 3.3050e-03 7.3970e-02 -6.0000e+00 8.5325e-01 1.5362e-01 4.7805e-03 4.4469e-02 -6.0000e+00 9.2885e-01 -2.3703e-01 5.3093e-03 2.5729e-02 -6.0000e+00 5.5266e-01 9.9257e-02 2.5283e-03 1.0525e-02 -6.0000e+00 2.3804e-01 4.0608e-04 -9.6623e-04 4.9515e-05 1.1764e-04 -6.0000e+00 1.6235e-02 -2.0869e-03 0.0000e+00 12 8 8 10 0 0 98.43 21.43 0.21 -0.00209 -0.00935 316 75 1 5 0 153.630 26.73 20.00 21.43 17.32 34.9 994.96 -137282 -240019 -218781 -135906 -144449 -205833 -264735 -179772 -141722 -189364 -219606 -159409 -69652 -112861 -112014 -61156 -73942 -42856 68071 -69686 -21349 -36907 -7544 -72650 -24435 -19635 -63579 -7666 -84209 -1355 -8782 -21486 -4393 -12354 -17074 -14148 -5449 -1887 13648 1293 25483 6209 10853 11594 -1367 17028 3212 16258 1023 8592 18652 1256 5627 9120 8625 5713 6586 4327 -6197 6467 9241 8857 5187 7393 2617 4122 3000 -952 2101 2317 4181 2063 2213 912 -560 1726 -3959 -438 885 -2268 116 -493 -2513 -1395 -7 -1034 1149 439 1399 -120 1668 372 -974 -640 -1563 -1179 -309 291 -111 -826 -949 -1026 -110 -1574 -2268 -1981 -1240 -1033 10 939 363 464 -20 -212 -81 -178 -339 9 237 43 720 812 1071 654 1037 16 -118 605 -9 539 131 185 -204 40 -250 -221 419 222 60 36 -627 -816 -598 -3288 -2708 -814 -866 -2168 -4807 -1730 -1055 -2476 -3734 -1852 -430 -1455 -1891 -777 -1249 -599 346 -1493 -291 -583 -92 -1847 -417 -339 -1743 -118 -2798 -22 -187 -648 -133 -444 -623 -491 -189 -75 577 68 1195 383 679 744 -102 1093 246 1154 90 767 1703 155 737 1264 1280 913 1073 715 -1100 994 1438 1554 1098 1752 634 1061 783 -250 604 771 1497 781 816 317 -178 482 -1118 -126 293 -939 56 -272 -1548 -832 -4 -698 796 313 976 -81 1119 239 -626 -408 -1169 -1037 -315 314 -129 -948 -1000 -1031 -102 -1531 -2394 -2041 -1349 -1220 13 1304 562 752 -32 -331 -120 -258 -506 15 393 72 1161 1246 1586 1007 1538 22 -170 961 -16 1048 261 392 -460 91 -607 -555 1061 567 151 84 -1462 -1797 SS 20201027T073252.5Z 7605.314497 154 1 49.07 2 80.42 124.66 137.69 338.53 0.00 1 0.00 1 0 25 5.483e-01 9.449e-03 5.646e-02 1.368e-03 7.108318e-01 7.237010e-04 8.701425e-03 -6.000000e+00 3.079840e-01 223.10 -2.00 3.80 -2.00 321.13 0.00e+00 4.086904e-03 3.246516e-04 9.462729e-04 -6.000000e+00 1.332722e-02 274.78 -2.00 20.00 -2.00 320.69 0.00e+00 5.732 0.004 302.00 328.00 3 3.1774e-01 2.3263e-03 6.9256e-02 -6.0000e+00 7.5958e-01 7.9503e-02 3.2728e-03 4.1476e-02 -6.0000e+00 8.2686e-01 -1.2752e-01 3.6047e-03 2.3469e-02 -6.0000e+00 4.9198e-01 5.2486e-02 1.7451e-03 9.1285e-03 -6.0000e+00 2.1191e-01 6.8900e-04 -8.3099e-04 3.6510e-05 1.0130e-04 -6.0000e+00 1.4452e-02 -2.3086e-03 0.0000e+00 12 8 8 10 0 0 58.69 21.42 0.23 -0.00231 -0.00855 438 103 1 5 0 110.740 26.73 20.00 21.42 17.76 34.9 994.93 -161475 -198076 -208659 -130057 -133694 -177662 -221931 -191006 -115384 -165728 -179628 -146365 -81934 -85751 -92344 -62552 -63214 -49602 6495 -55071 -28834 -21466 -8619 -52977 -23266 -19414 -48812 -25808 -61456 -9752 -18572 -7798 -8897 -10641 -21587 -13807 -11744 -2563 8809 2928 13579 793 4705 6475 -1950 7123 3174 10341 991 6385 9785 830 2271 6559 5593 3887 3797 2690 -2569 4250 4604 4804 3939 5291 3280 2644 933 -862 1851 1752 2443 1657 950 638 -143 916 -3318 -1083 261 -1848 413 -479 -2400 -1549 -699 -606 765 590 1109 196 977 -244 -942 -482 -1173 -797 -114 528 16 -481 -837 -1027 -324 -1167 -1794 -1735 -903 -671 189 669 447 373 119 -29 -113 26 -250 83 -28 -68 529 524 908 639 600 -99 280 669 -99 286 110 179 -198 -88 -157 -200 312 189 96 -13 -444 -691 -990 -2166 -2838 -815 -802 -1587 -3285 -2369 -769 -2011 -2659 -1757 -666 -972 -1465 -918 -1087 -840 69 -1160 -484 -335 -123 -1293 -462 -396 -1373 -568 -1926 -199 -505 -236 -324 -431 -947 -550 -503 -120 457 195 841 61 367 513 -172 591 284 905 101 672 1122 118 353 1069 981 727 732 521 -509 774 870 1015 972 1467 900 783 280 -254 599 657 998 707 399 251 -51 292 -1051 -351 97 -844 217 -290 -1495 -1016 -486 -448 585 461 854 145 669 -159 -609 -332 -939 -747 -115 603 20 -581 -930 -1015 -319 -1205 -1866 -1900 -1042 -837 262 977 721 627 199 -46 -172 38 -383 133 -47 -117 881 832 1390 947 860 -147 412 1010 -173 526 220 380 -419 -201 -381 -471 746 455 226 -30 -977 -1443 SS 20201027T074221.5Z 7605.321082 159 1 49.03 2 79.21 126.66 138.15 341.81 0.00 1 0.00 1 0 25 3.678e-01 7.227e-03 3.455e-02 9.251e-04 6.424475e-01 4.816293e-04 7.939889e-03 -6.000000e+00 2.066345e-01 223.10 -2.00 3.80 -2.00 320.71 0.00e+00 3.510984e-03 1.926474e-04 6.346898e-04 -6.000000e+00 8.941244e-03 274.78 -2.00 20.00 -2.00 320.24 0.00e+00 5.144 0.003 302.00 328.00 3 2.6231e-01 1.4747e-03 6.2001e-02 -6.0000e+00 5.0962e-01 2.5235e-02 1.9578e-03 3.6662e-02 -6.0000e+00 5.5476e-01 -4.3861e-02 2.0701e-03 2.0188e-02 -6.0000e+00 3.3008e-01 1.5091e-02 1.0322e-03 7.8030e-03 -6.0000e+00 1.4218e-01 1.3499e-03 -6.4722e-04 2.4877e-05 7.9434e-05 -6.0000e+00 9.6954e-03 -2.6626e-03 0.0000e+00 11 8 0 10 0 0 16.27 21.41 0.22 -0.00266 -0.00753 634 150 1 5 0 76.480 26.62 20.00 21.41 18.82 35.1 994.98 -104405 -142782 -118281 -95539 -102284 -129354 -169771 -120381 -99172 -101158 -116801 -86254 -58247 -46534 -52252 -38301 -29930 -29857 8413 -25804 -8250 -15479 -9110 -26448 -17950 -8210 -26898 -14815 -33833 -9597 -9628 -4631 -628 -4667 -5578 -10446 -5010 -2142 3111 -471 3060 1135 870 3121 -168 3220 2179 4927 1409 -10493 5749 856 2783 2961 3239 1762 1374 826 -2085 1593 1608 3833 2646 3849 1918 1135 1271 -950 1645 773 1649 789 491 473 -465 343 -2203 -1209 -357 -1347 -720 -1161 -2005 -1566 -732 -680 626 538 1223 492 994 317 -795 -90 -674 -128 273 748 273 -277 -549 -1059 -461 -896 -1370 -1293 -765 -452 260 721 473 492 211 -7 -165 -107 -94 -167 58 -339 172 354 775 522 505 -123 85 543 -37 96 16 -54 -131 -59 -86 -263 457 185 33 59 -339 -545 -612 -1507 -1088 -707 -747 -1190 -2496 -1238 -948 -1086 -1549 -941 -609 -571 -877 -687 -570 -636 134 -619 -173 -349 -200 -759 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