File name: Pandora21s1_Bremen_20221106_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T125711.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20221106_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20221106 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20221106T085303.0Z 8345.370173 286 1 50.75 2 74.99 146.35 121.73 347.68 0.00 1 0.00 1 0 25 3.749e-01 9.586e-03 2.085e-01 7.658e-03 4.736868e-01 4.037185e-03 6.155004e-03 -6.000000e+00 2.190729e-01 221.72 -2.00 3.88 -2.00 320.12 0.00e+00 -9.419272e-05 1.180338e-03 3.176266e-04 -6.000000e+00 9.171949e-03 272.15 -2.00 20.00 -2.00 319.83 0.00e+00 3.788 0.001 302.00 328.00 3 4.6263e+00 1.1297e-02 4.5866e-02 -6.0000e+00 5.4069e-01 9.3684e-02 1.3516e-02 2.6830e-02 -6.0000e+00 5.8967e-01 1.3320e-03 1.2941e-02 1.4300e-02 -6.0000e+00 3.4820e-01 -1.3812e-02 6.9039e-03 4.5709e-03 -6.0000e+00 1.4849e-01 6.8391e-05 -6.2747e-04 2.4542e-04 5.9137e-05 -6.0000e+00 1.1396e-02 -2.4142e-02 1.1177e-04 12 8 8 10 0 0 99.98 22.08 0.38 -0.02414 -0.02886 31 6 1 5 0 1636.825 25.17 20.00 22.08 17.10 30.2 1015.43 900000 345384 5085 900000 -56454 96474 23371 187524 -7803 72075 -624 10271 6873 -19386 83656 -24711 42367 -33770 18462 2118 -3 5652 -15552 32795 -24560 16039 -15334 8016 -14200 -640 -6317 -1848 12501 -18946 15477 -5638 1382 -8481 15796 1726 -2212 408 -3777 1568 436 9527 983 1651 1189 -2768 -3618 1007 1816 488 4397 -3065 4785 -2914 2477 -1239 -310 1566 24 1043 -1094 2217 -4701 3839 -145 1148 917 1106 449 -602 3031 -2148 418 381 -1919 -730 412 -195 -927 82 -1942 -607 -1734 707 96 404 -814 1044 1506 -110 2117 -38 1156 -733 887 -717 736 -750 653 776 -1865 -1090 -846 -77 -307 664 379 17 -388 114 -370 377 833 -250 -68 -784 -769 -466 455 -22 -99 586 566 1892 186 312 -199 669 -603 133 134 -228 306 269 -153 -429 409 -720 24 900000 2579 67 900000 -1196 720 254 1400 -139 694 -12 191 151 -632 1317 -1139 1196 -2003 733 102 0 276 -947 1389 -1871 897 -1160 482 -1015 -41 -463 -147 973 -2101 1246 -545 133 -1028 1826 268 -403 78 -789 320 91 1837 207 348 257 -644 -907 264 512 150 1373 -1071 1596 -1055 840 -429 -108 572 10 460 -517 1001 -2187 1635 -68 592 523 668 276 -362 1652 -1124 196 172 -928 -392 250 -134 -701 66 -1675 -550 -1676 692 95 391 -756 887 1198 -87 1726 -35 1185 -855 1106 -929 910 -869 693 807 -2078 -1280 -1041 -99 -420 973 600 28 -656 187 -574 551 1184 -366 -104 -1270 -1275 -763 718 -34 -147 829 772 2531 267 489 -339 1190 -1126 256 272 -489 675 605 -349 -965 880 -1499 48 SS 20221106T090858.5Z 8345.381233 292 1 50.05 2 73.74 150.10 122.06 352.15 0.00 1 0.00 1 0 25 2.151e-01 9.950e-03 1.728e-01 7.342e-03 4.421221e-01 3.821105e-03 5.754062e-03 -6.000000e+00 1.255752e-01 221.72 -2.00 3.88 -2.00 319.93 0.00e+00 -6.162023e-05 1.053410e-03 2.697016e-04 -6.000000e+00 5.154413e-03 272.15 -2.00 20.00 -2.00 319.62 0.00e+00 3.513 0.001 302.00 328.00 3 4.6461e+00 1.0603e-02 4.2564e-02 -6.0000e+00 3.0995e-01 7.0385e-02 1.2480e-02 2.4872e-02 -6.0000e+00 3.3794e-01 4.1672e-03 1.1231e-02 1.3139e-02 -6.0000e+00 1.9955e-01 -9.0145e-03 6.0209e-03 4.1564e-03 -6.0000e+00 8.4091e-02 9.1339e-05 -7.5763e-04 2.3719e-04 5.3545e-05 -6.0000e+00 6.4445e-03 -2.3071e-02 -1.3320e-05 12 8 8 10 0 0 99.98 22.08 0.53 -0.02307 -0.02876 66 13 1 5 0 758.092 25.17 20.00 22.08 17.66 30.0 1018.06 1308 -22385 64024 -23273 67938 -54537 129017 -40239 146508 -59894 20210 13989 -28005 27080 -10307 23297 -26971 19417 -1422 11357 4812 21252 7547 -11976 2282 -11688 25449 -15642 12520 -13748 11132 -5480 2857 2209 1882 7851 -9062 11970 -6588 5796 -2981 -219 995 -5766 888 -3017 1018 -3645 4775 -2166 4766 -285 3566 2240 431 2678 -1368 3331 -2948 3342 -1786 4148 384 -1393 -529 -437 2781 -3003 3672 -1861 1607 -245 1342 684 1469 2135 211 1313 -2690 2501 -1783 -517 -1010 -1924 -1274 -933 29 -398 -39 -1315 1446 -510 2022 471 572 1052 1239 836 -920 529 -828 350 -855 530 -653 -1469 -226 -1134 639 -169 1134 -1408 -379 -326 614 531 2 789 -528 282 -1263 1023 -229 704 258 318 -200 815 998 61 754 -782 553 -297 -145 226 54 170 -116 -239 -315 254 -481 21 -497 712 -541 679 -1524 924 -1164 1049 -2448 436 340 -1103 783 -478 918 -1786 920 -85 637 294 1142 470 -942 170 -1036 1655 -1428 866 -1210 849 -541 289 238 202 791 -1128 1414 -1095 1008 -630 -49 227 -1436 210 -745 243 -913 1122 -561 1231 -84 1094 744 153 968 -528 1238 -1147 1210 -691 1616 170 -681 -268 -217 1286 -1453 1761 -1048 964 -158 863 430 859 1135 105 622 -1380 1366 -1156 -371 -795 -1623 -1133 -880 28 -409 -40 -1342 1362 -455 1653 381 486 983 1297 980 -1185 688 -1051 407 -936 563 -735 -1772 -283 -1505 885 -254 1812 -2411 -645 -535 944 773 2 1144 -813 454 -2113 1663 -366 1083 383 453 -276 1104 1425 96 1264 -1399 1011 -569 -292 477 118 378 -261 -532 -676 520 -958 SS 20221106T091935.8Z 8345.388609 295 1 6.19 2 72.98 152.65 122.19 355.14 0.00 1 0.00 1 0 25 1.440e-01 1.537e-02 1.121e-01 1.094e-02 4.246007e-01 5.593268e-03 5.628397e-03 -6.000000e+00 8.416352e-02 221.72 -2.00 3.88 -2.00 318.91 0.00e+00 1.576368e-03 1.182071e-03 1.831938e-04 -6.000000e+00 3.453323e-03 272.15 -2.00 20.00 -2.00 318.63 0.00e+00 3.365 0.001 302.00 328.00 3 4.4592e+00 1.5000e-02 4.0725e-02 -6.0000e+00 2.0774e-01 9.6530e-02 1.7073e-02 2.3639e-02 -6.0000e+00 2.2642e-01 -5.3376e-02 1.2925e-02 1.2123e-02 -6.0000e+00 1.3370e-01 1.7009e-02 6.9513e-03 3.6726e-03 -6.0000e+00 5.6392e-02 1.2946e-04 -1.2072e-04 3.3447e-04 4.4727e-05 -6.0000e+00 4.3145e-03 -2.6248e-02 1.2347e-04 12 9 9 12 1 1 999.00 22.08 0.27 -0.02625 -0.02716 1 3 1 5 0 3004.547 25.17 20.00 22.08 17.85 30.1 1018.78 21784 -91374 -69421 -41359 -20659 48837 33965 -18038 12488 -33543 33176 -31054 48623 -13699 16197 22922 -8238 5119 -8719 8702 -6899 12665 4385 5828 -15204 3425 -125 11726 -4833 -914 3781 6887 7467 553 -2025 -10317 162 9359 13960 -7179 -1475 -5464 479 1245 242 1957 -1765 -1800 3282 8846 3831 4831 -819 1705 7155 -962 1460 656 910 1720 -176 2436 -1477 240 1540 6264 -49 2715 85 288 -312 -1254 -1475 1068 1665 -2079 79 -2192 -2111 -536 214 -21 -3018 -1770 -4812 -323 -2462 1807 300 576 783 -1612 1765 2333 796 1205 -592 654 -663 -1625 -335 -2392 130 1586 -934 -454 -508 -926 653 443 -378 -776 42 329 836 1106 423 108 1276 -105 -371 -474 148 -321 -219 1157 975 2692 -592 572 453 1065 32 -340 944 -329 316 -685 -369 290 -536 -851 -735 498 -6649 -4361 -1969 -762 923 761 -713 414 -1809 1009 -1808 1558 -921 975 1480 -776 456 -934 827 -779 1202 459 634 -2138 425 -16 1332 -620 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