File name: Pandora30s1_Juelich_20201018_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T155054.7Z 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_20201018_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: 20201018 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 20201018T070653.9Z 7596.296457 83 1 49.75 2 81.47 117.26 98.33 103.07 0.00 1 0.00 1 0 17 8.242e-01 7.501e-02 2.292e-01 1.072e-02 7.301556e-01 5.893641e-03 9.800396e-03 -6.000000e+00 4.712512e-01 224.10 -2.00 3.80 -2.00 320.82 0.00e+00 2.232270e-02 1.978068e-03 2.426684e-03 -6.000000e+00 2.460155e-02 276.02 -2.00 20.00 -2.00 320.31 0.00e+00 6.353 0.005 302.00 328.00 3 2.9986e+00 1.7185e-02 7.4458e-02 -6.0000e+00 1.1672e+00 1.3579e+00 2.0225e-02 4.4229e-02 -6.0000e+00 1.2731e+00 -1.4393e+00 1.3585e-02 2.4348e-02 -6.0000e+00 7.5394e-01 5.7152e-01 7.0595e-03 2.0426e-02 -6.0000e+00 3.3165e-01 1.6537e-05 -2.6503e-03 2.8908e-04 2.6309e-04 -6.0000e+00 2.4529e-02 -1.9559e-03 0.0000e+00 12 9 9 12 32 32 75.16 21.97 0.59 -0.00196 -0.02187 13 3 1 5 0 3826.270 27.05 20.00 21.97 15.82 34.5 1011.19 900000 100527 2871 900000 900000 252626 -83493 -25148 900000 -42738 900000 -53172 900000 82749 19474 215704 44212 340210 900000 317935 900000 900000 67945 -46952 900000 265763 -21384 900000 -82586 900000 900000 88422 71994 67988 20211 224995 47753 900000 900000 63463 52371 96227 198526 136129 16838 117523 62733 328496 -101 131127 76769 -13175 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-15943 10292 3289 501 5381 2551 -7184 -2130 1761 -2626 -11453 -14190 7775 10360 -6913 -4335 -2070 -7899 -13892 4930 1739 -1669 -4458 -874 -2887 10421 -5876 -8563 1473 -1047 8325 14946 3756 5992 6801 8057 4741 819 39 595 2969 8288 3120 2532 -1248 -7191 -295 1717 1204 2100 2654 -5582 -14503 SS 20201018T144548.2Z 7596.615141 372 1 48.45 2 75.41 232.91 71.18 206.56 0.00 1 0.00 1 0 25 1.107e-01 6.089e-03 2.501e-02 1.362e-03 4.723177e-01 6.933203e-04 5.979454e-03 -6.000000e+00 6.245062e-02 224.06 -2.00 3.80 -2.00 319.87 0.00e+00 1.605975e-03 2.111773e-04 3.904018e-04 -6.000000e+00 2.705473e-03 275.97 -2.00 20.00 -2.00 319.33 0.00e+00 3.888 0.001 302.00 328.00 3 2.2234e+00 1.9766e-03 4.6312e-02 -6.0000e+00 1.5429e-01 -3.6619e-03 2.3772e-03 2.6398e-02 -6.0000e+00 1.6780e-01 8.8706e-03 2.0939e-03 1.3671e-02 -6.0000e+00 9.9840e-02 -7.4245e-03 1.0972e-03 4.4625e-03 -6.0000e+00 4.2966e-02 7.3766e-04 -5.4373e-04 3.8686e-05 4.7684e-05 -6.0000e+00 2.9198e-03 -3.1434e-03 0.0000e+00 10 0 0 10 0 0 99.96 21.97 0.10 -0.00314 -0.00723 412 97 1 5 0 117.580 27.05 20.00 21.97 19.76 35.7 1010.51 -23548 -45916 -39600 -4021 -19786 -32373 -63317 -40541 -10939 -36053 -42062 -28674 -1115 -9245 -11390 -10073 -11675 -7088 9255 -6616 3996 815 3081 -10101 -1798 1317 -9678 650 -12652 1765 2405 1579 1868 -1196 -5367 -5338 -3414 1467 2355 117 2582 -242 -262 -177 -950 885 728 2047 -1429 280 3383 -574 450 2322 1900 1200 226 344 -2723 865 1536 2109 1889 2042 87 163 179 -1515 1053 707 754 294 -209 390 -808 713 -1632 -317 318 -1730 -68 -1296 -2069 -1217 -497 -600 621 439 861 110 1038 664 -265 507 -87 -159 513 793 63 -504 -630 -867 103 -546 -1369 -1231 -736 -455 235 668 419 318 90 8 -63 -11 -67 -7 72 -310 118 453 600 561 481 -157 -25 477 -192 16 -92 14 -117 -80 -92 -117 354 295 44 175 -434 -580 -305 -879 -771 -54 -285 -501 -1415 -825 -190 -878 -1122 -714 -25 -281 -435 -447 -584 -339 438 -358 218 46 175 -655 -117 88 -733 43 -917 123 174 134 180 -127 -569 -553 -379 185 361 22 528 -51 -57 -39 -216 201 167 468 -345 70 890 -174 146 796 687 453 88 134 -1066 324 593 891 897 993 44 84 89 -773 541 419 488 198 -140 245 -472 394 -856 -164 182 -1103 -49 -1059 -1719 -1059 -461 -594 640 463 897 110 952 565 -230 450 -81 -170 581 1003 85 -662 -762 -1010 113 -636 -1637 -1546 -969 -635 334 1040 700 540 149 13 -91 -16 -102 -10 116 -520 194 719 922 827 720 -225 -36 714 -304 27 -168 26 -220 -160 -185 -245 752 634 93 354 -883 -1130 SS 20201018T145018.5Z 7596.618270 374 1 49.07 2 75.98 233.89 71.51 207.62 0.00 1 0.00 1 0 25 1.015e-01 5.566e-03 1.132e-02 6.558e-04 4.873510e-01 3.320685e-04 6.183843e-03 -6.000000e+00 5.725438e-02 224.06 -2.00 3.80 -2.00 319.69 0.00e+00 1.357618e-03 9.705547e-05 3.977083e-04 -6.000000e+00 2.480395e-03 275.97 -2.00 20.00 -2.00 319.15 0.00e+00 4.036 0.001 302.00 328.00 3 9.0746e-01 9.4236e-04 4.7970e-02 -6.0000e+00 1.4145e-01 -5.0419e-03 1.1230e-03 2.7186e-02 -6.0000e+00 1.5384e-01 -2.7338e-03 9.7409e-04 1.3969e-02 -6.0000e+00 9.1533e-02 -3.3713e-03 5.1395e-04 4.4242e-03 -6.0000e+00 3.9391e-02 2.3722e-03 -4.8184e-04 1.8295e-05 4.6698e-05 -6.0000e+00 2.6770e-03 -3.0157e-03 0.0000e+00 10 0 0 10 0 0 99.55 21.97 0.19 -0.00302 -0.00664 672 159 1 5 0 72.150 27.05 20.01 21.97 20.02 36.0 1010.52 -34092 -32080 -34897 -18421 -32812 -37413 -49140 -35769 -22171 -29144 -33338 -27705 -7610 -15521 -9045 -7653 -8276 -3922 1118 -3756 -2157 -961 -2698 -4902 -1241 -1468 -4484 -2597 -7332 -3012 324 -273 1207 -1631 -3705 -4119 -4100 -691 162 247 373 -393 -158 -13 485 316 621 669 -716 353 1951 1073 1088 1551 1062 1121 515 105 -844 518 1105 1965 2279 2139 554 208 -192 -832 1109 730 535 498 -245 318 -524 -290 -1402 -1208 -447 -1319 -752 -1245 -1833 -1432 -640 -266 380 576 857 793 736 220 -251 81 -171 -67 493 602 136 -426 -526 -871 -298 -442 -1331 -1034 -763 -377 301 622 533 378 395 -45 -97 0 -4 -13 51 -282 20 292 535 296 432 -134 249 576 -3 100 -156 -209 -168 -42 -77 -126 431 278 37 85 -414 -517 -504 -550 -667 -296 -554 -629 -987 -721 -448 -690 -851 -716 -193 -530 -356 -351 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