File name: Pandora30s1_Juelich_20201229_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T160415.4Z 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_20201229_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: 20201229 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 20201229T104310.1Z 7668.446645 390 1 4.26 2 75.03 167.30 105.51 355.67 0.00 1 0.00 1 0 17 4.578e-01 2.723e-02 2.683e-01 1.384e-02 6.029966e-01 7.073630e-03 7.625482e-03 -6.000000e+00 2.563209e-01 221.16 -2.00 3.80 -2.00 319.95 0.00e+00 1.076493e-02 2.160689e-03 5.064117e-04 -6.000000e+00 1.131408e-02 268.07 -2.00 20.00 -2.00 319.55 0.00e+00 3.796 0.001 302.00 328.00 3 3.8446e+00 1.9775e-02 4.9935e-02 -6.0000e+00 6.3249e-01 2.2656e-01 2.3925e-02 3.4345e-02 -6.0000e+00 6.9100e-01 -2.0993e-01 2.2312e-02 2.0421e-02 -6.0000e+00 4.0844e-01 9.2713e-02 1.1761e-02 1.3198e-02 -6.0000e+00 1.7756e-01 1.2106e-04 -1.7091e-03 3.6712e-04 1.0816e-04 -6.0000e+00 1.2410e-02 -4.1883e-03 0.0000e+00 12 9 9 12 33 1 999.00 21.06 -0.13 -0.00419 -0.01703 1 6 1 5 0 2041.470 26.41 19.99 21.06 11.31 36.1 977.39 900000 -43169 -159600 900000 79994 -67217 -173733 -135585 900000 -104515 -116525 -77190 900000 167786 -44128 130026 -39080 153636 28751 5895 -6555 59234 166055 -25363 172767 25137 10234 67711 -44762 31987 46405 50143 21479 48882 -20102 28594 2296 35221 991 -11313 31151 -12165 17520 4932 2839 3318 15414 26175 -1086 20253 10675 17282 -1590 14363 7061 -361 5461 -3410 -5600 -578 10449 7562 -307 4090 -6593 1125 -1718 -4801 -2261 2029 1244 1341 288 -655 1110 -8103 -3882 2428 7328 -4369 1265 -1203 -1158 -440 -2175 -142 1390 1198 2773 -2412 2739 60 3166 -1371 -3244 -1397 -1069 827 -139 202 -9477 4551 3691 -627 -4161 -2173 -56 -2984 1373 252 100 -54 -347 168 873 540 -1022 603 1081 1369 1472 2447 -130 1347 775 1375 522 -424 -799 393 340 -26 1015 1260 -939 -103 -825 588 -679 1402 -1420 -1987 900000 -735 -8711 900000 1079 -1336 -9036 -5394 900000 -3453 -4400 -2246 900000 2263 -1934 1753 -2292 2072 1081 278 -358 1724 2239 -1676 2330 1124 511 1970 -3803 1430 2141 2569 1709 3197 -2388 2101 234 2992 136 -1962 4121 -2535 3004 949 571 685 2901 4790 -259 4121 2624 4417 -510 4402 2318 -130 1883 -1266 -2058 -200 3376 2793 -134 1921 -3460 551 -840 -2468 -1250 1183 797 885 187 -403 633 -4530 -1945 1168 3805 -2911 891 -943 -979 -388 -2005 -136 1376 1213 2735 -2388 2473 52 2629 -1197 -3148 -1491 -1268 1057 -185 262 -12432 5087 3871 -710 -5068 -2724 -70 -3991 1936 389 164 -89 -558 261 1304 782 -1536 939 1723 2223 2330 3780 -199 2009 1116 1940 729 -626 -1264 662 599 -48 1887 2480 -1952 -213 -1744 1235 -1413 2772 -2772 -3787 SS 20201229T104841.5Z 7668.450480 393 1 48.93 2 74.84 168.60 105.56 356.93 0.00 1 0.00 1 0 25 1.916e-01 5.539e-03 2.713e-02 9.190e-04 5.851540e-01 4.667458e-04 7.302734e-03 -6.000000e+00 1.068178e-01 221.16 -2.00 3.80 -2.00 320.26 0.00e+00 2.765398e-03 1.565296e-04 4.246467e-04 -6.000000e+00 4.532221e-03 268.07 -2.00 20.00 -2.00 319.87 0.00e+00 3.754 0.001 302.00 328.00 3 1.4758e+00 1.3409e-03 4.8868e-02 -6.0000e+00 2.6293e-01 2.3805e-02 1.6811e-03 3.2550e-02 -6.0000e+00 2.8691e-01 -6.5110e-03 1.7178e-03 1.7617e-02 -6.0000e+00 1.7029e-01 -2.1386e-03 8.9457e-04 6.6575e-03 -6.0000e+00 7.3256e-02 1.5152e-03 -4.4027e-04 2.4983e-05 6.5501e-05 -6.0000e+00 5.0469e-03 -3.6710e-03 0.0000e+00 10 0 0 10 0 0 99.98 21.06 0.20 -0.00367 -0.00698 874 206 1 5 0 55.340 26.41 20.00 21.06 11.46 36.3 977.49 -70966 -61475 -69312 -54262 -52491 -64645 -83617 -71595 -34956 -63598 -53984 -52417 -19496 -24289 -25994 -15090 -15511 -5143 -687 -10832 -4234 -4750 558 -11975 -4273 -6187 -10198 -7980 -13753 -3214 52 -326 -12 -610 -3869 -3030 -4551 -410 827 -831 1747 -1393 451 316 -685 1679 1275 1978 -329 -5251 2682 708 1272 2070 1268 888 404 262 -1501 762 1751 2392 2575 2564 657 577 -41 -719 1098 816 719 364 -9 169 -585 -82 -1220 -820 -16 -920 -428 -1153 -2248 -1347 -794 -273 403 418 989 788 1122 340 -137 213 -119 -158 504 715 189 -250 -586 -660 -78 -341 -1287 -1220 -764 -589 141 458 335 175 210 -114 -100 42 82 72 139 -192 105 411 551 269 329 -212 251 519 -42 19 -168 -233 -37 -129 -94 -154 457 247 63 24 -288 -492 -630 -600 -807 -545 -475 -631 -1049 -911 -354 -940 -759 -798 -266 -448 -620 -391 -459 -152 -21 -391 -148 -167 19 -512 -168 -264 -463 -345 -617 -151 3 -19 -1 -45 -283 -215 -359 -37 91 -112 258 -229 77 55 -123 300 234 371 -66 -1074 561 169 330 578 376 275 129 83 -472 231 546 821 1003 1116 302 256 -18 -325 544 431 415 218 -6 94 -295 -40 -565 -386 -8 -537 -288 -884 -1882 -1096 -686 -250 384 406 943 716 942 288 -113 182 -108 -165 599 894 251 -325 -699 -754 -83 -382 -1566 -1454 -957 -788 207 698 553 297 347 -179 -157 63 128 111 226 -321 171 638 881 414 486 -301 350 782 -68 35 -321 -435 -72 -269 -197 -334 999 545 136 53 -589 -957 SS 20201229T105325.1Z 7668.453762 395 1 48.13 2 74.70 169.72 105.59 358.00 0.00 1 0.00 1 0 17 6.665e-01 3.842e-02 1.476e-01 5.936e-03 5.697083e-01 3.049254e-03 7.178849e-03 -6.000000e+00 3.735024e-01 221.16 -2.00 3.80 -2.00 320.12 0.00e+00 1.155515e-02 9.445485e-04 1.072189e-03 -6.000000e+00 1.659454e-02 268.07 -2.00 20.00 -2.00 319.72 0.00e+00 3.721 0.001 302.00 328.00 3 4.9526e+00 8.6005e-03 4.7865e-02 -6.0000e+00 9.2128e-01 3.3352e-01 1.0287e-02 3.1997e-02 -6.0000e+00 1.0062e+00 -3.7507e-01 9.0360e-03 2.0154e-02 -6.0000e+00 5.9482e-01 1.7335e-01 4.7474e-03 1.3909e-02 -6.0000e+00 2.5895e-01 4.3824e-05 -3.6612e-04 1.6374e-04 1.3697e-04 -6.0000e+00 1.8071e-02 -5.5424e-03 0.0000e+00 12 9 8 11 32 0 99.99 21.06 -0.53 -0.00554 -0.00829 23 5 1 5 0 2092.220 26.41 20.00 21.06 11.73 36.2 977.58 900000 -45731 -96849 900000 308440 14773 -165607 -2607 900000 -103833 -57769 -64715 900000 34807 -23760 10492 -17018 73443 541370 -10929 75258 900000 150221 -43935 57912 56768 -35145 53724 -81173 177277 130686 27795 34943 12232 3396 25544 -7990 78819 48274 14592 75326 11875 23377 27288 -4713 31406 24724 44996 -6608 5462 44612 -13884 -158 26964 13067 8735 2327 707 -600 16009 25696 15380 1775 9052 -4924 2903 -1030 -15112 -3986 -1919 6622 3517 -4330 -4344 -7092 11414 -12975 6525 12773 -2545 8899 -1655 -7856 -3704 -491 -2569 4524 2307 2039 -5472 2771 2115 -1743 828 -1454 -3659 -1182 932 -126 -3558 3224 1309 -1451 -2354 -6647 -4589 -2072 1443 400 2710 234 411 -3204 -1097 2597 -995 -2001 -93 74 2550 3776 1993 1840 2937 3280 1174 -2582 1779 -1744 959 1754 -453 822 1278 -1302 -264 559 795 497 518 -3434 -2654 900000 -1559 -5628 900000 1783 272 -13817 -55 900000 -5524 -2022 -2600 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