File name: Pandora21s1_Bremen_20220112_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T095000.3Z 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_20220112_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: 20220112 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 20220112T111030.1Z 8047.465627 276 1 4.69 2 74.85 174.57 94.23 54.42 0.00 1 0.00 1 0 17 2.276e-01 1.219e-02 2.471e-01 1.225e-02 5.054254e-01 6.295368e-03 6.619077e-03 -6.000000e+00 1.324470e-01 221.26 -2.00 3.88 -2.00 319.56 0.00e+00 -1.222583e-03 1.634742e-03 2.860079e-04 -6.000000e+00 5.450038e-03 265.93 -2.00 20.00 -2.00 319.28 0.00e+00 3.755 0.001 302.00 328.00 3 3.9999e+00 1.7238e-02 4.6465e-02 -6.0000e+00 3.2659e-01 4.5819e-02 2.0168e-02 2.8283e-02 -6.0000e+00 3.5634e-01 -1.0737e-02 1.8084e-02 1.4804e-02 -6.0000e+00 2.1047e-01 -2.5413e-03 9.7724e-03 4.5980e-03 -6.0000e+00 8.8652e-02 1.3264e-04 -7.0993e-04 3.7092e-04 5.7139e-05 -6.0000e+00 6.8181e-03 -1.3744e-02 2.3718e-05 12 9 9 12 1 1 999.00 22.08 0.40 -0.01374 -0.01908 1 4 1 5 0 2253.478 25.17 20.00 22.08 11.93 27.3 1041.94 101040 33252 3856 87234 -99786 -47742 -56161 106330 -24703 116072 -39897 -33116 -31026 -21538 41982 -13540 -40286 -10936 20876 4047 -20174 -15304 8704 15265 14745 -10721 6309 5219 -5286 14449 2565 10961 -2739 -9189 -1627 10902 6189 7358 -4488 -5683 -455 -1773 -150 5875 -1614 7361 -5726 534 -1631 -2265 -5622 1059 1527 4179 1431 -3830 108 -370 5839 -708 730 2494 2921 5455 253 2237 -1124 3616 1577 1267 -1334 828 -1382 1368 1029 -504 -1295 2045 -875 -1915 0 -2526 -2564 -462 -496 -1208 579 -1099 -989 -66 -11 2289 572 -18 -258 2191 32 -1049 -156 378 767 86 177 -144 171 -2348 -1384 583 784 8 -511 173 -314 844 -877 -269 -641 1323 -1071 -701 1050 -908 -526 -670 2040 469 1260 475 -566 1549 416 496 -533 635 100 1003 -918 416 -66 -151 -58 -1622 83 1207 397 52 1042 -3254 -953 -1297 1270 -549 1387 -1176 -1001 -1070 -817 1060 -653 -2747 -616 936 222 -1431 -1056 502 897 947 -924 473 387 -421 981 214 961 -305 -1154 -189 1127 717 979 -797 -1201 -103 -436 -38 1438 -426 1808 -1594 142 -453 -659 -1806 349 542 1552 573 -1668 47 -162 2388 -302 313 1119 1424 2818 142 1222 -615 1907 896 795 -927 592 -1011 951 678 -311 -751 1130 -520 -1274 0 -2080 -2270 -423 -476 -1224 603 -1188 -1073 -70 -11 2161 524 -17 -248 2247 36 -1312 -205 504 992 105 204 -165 203 -2963 -1800 779 1096 12 -809 283 -516 1350 -1366 -402 -949 1966 -1674 -1129 1694 -1470 -831 -1036 3017 682 1777 673 -846 2437 697 864 -959 1169 191 1979 -1873 852 -135 -308 -115 -3150 156 SS 20220112T111421.1Z 8047.468300 278 1 2.49 2 74.80 175.49 93.77 55.18 0.00 1 0.00 1 0 25 2.377e-01 1.384e-02 2.149e-01 1.178e-02 5.030694e-01 6.092501e-03 6.550049e-03 -6.000000e+00 1.384499e-01 221.26 -2.00 3.88 -2.00 319.43 0.00e+00 -1.024244e-04 1.537528e-03 2.778521e-04 -6.000000e+00 5.944193e-03 265.93 -2.00 20.00 -2.00 319.15 0.00e+00 3.743 0.001 302.00 328.00 3 3.4001e+00 1.6603e-02 4.6209e-02 -6.0000e+00 3.4190e-01 2.2291e-02 1.9391e-02 2.8011e-02 -6.0000e+00 3.7316e-01 9.4161e-03 1.7253e-02 1.4665e-02 -6.0000e+00 2.2014e-01 -1.4442e-02 9.3466e-03 4.5563e-03 -6.0000e+00 9.3154e-02 2.4683e-04 -3.0823e-05 3.5749e-04 5.5581e-05 -6.0000e+00 7.1332e-03 -1.2963e-02 7.8308e-05 12 9 9 12 1 1 999.00 22.08 0.30 -0.01296 -0.01319 1 8 1 5 0 1156.574 25.17 20.00 22.08 12.02 27.2 1042.09 182882 -93603 900000 -20811 104572 -39015 20468 -30503 -48852 900000 -43419 23101 31712 2477 71456 18535 26668 -7851 15800 -31337 14925 -13719 29258 -10006 -18602 -6629 -10771 -21734 5309 30000 4629 34052 -14424 24819 8099 7485 -8187 -10156 4062 -10134 4357 -2820 -792 -2384 4191 -2344 459 -1933 3955 3395 -13 -1149 -3831 1656 984 4303 4323 2 2151 1526 1571 -1322 3659 1919 1853 2 -941 -426 1009 3323 -1973 952 312 1166 -3639 -344 733 -1498 782 -2329 3644 -2263 -2974 -515 -1722 54 341 -881 753 -670 -1690 3102 1741 2917 -2024 3153 -107 674 -1299 -822 671 -264 -584 76 -355 -1097 798 -1673 -926 382 -316 242 -1955 822 392 1697 -785 884 -1295 -219 -903 815 -107 -460 1935 -130 1072 1199 347 284 672 -837 1425 487 185 227 54 -3 -1220 -179 -484 -321 -16 2100 -3017 900000 -366 1200 -756 248 -661 -1403 900000 -1363 437 649 79 1469 705 1043 -454 788 -2513 814 -986 1485 -780 -1697 -574 -986 -2157 404 1880 403 2587 -1899 2435 918 852 -1153 -1685 707 -2340 989 -731 -210 -657 1103 -660 127 -555 1105 994 -4 -407 -1494 658 412 1820 1876 1 943 666 698 -639 1847 1059 1063 1 -532 -241 597 2116 -1411 696 230 830 -2545 -218 433 -883 476 -1604 2673 -1898 -2681 -478 -1685 55 357 -954 810 -714 -1743 2942 1600 2644 -1990 3244 -123 833 -1718 -1097 864 -323 -681 87 -423 -1371 1021 -2256 -1302 563 -492 388 -3197 1294 597 2476 -1151 1304 -2003 -347 -1454 1286 -167 -703 2838 -188 1505 1685 513 447 1111 -1448 2497 884 348 442 107 -6 -2478 -358 -944 -608 -29 SS 20220112T111921.3Z 8047.471774 281 1 50.13 2 74.74 176.70 93.15 56.16 0.00 1 0.00 1 0 28 2.578e-01 6.143e-03 1.369e-01 3.049e-03 5.090573e-01 1.597076e-03 6.572930e-03 -6.000000e+00 1.499930e-01 221.26 -2.00 3.88 -2.00 320.37 0.00e+00 6.656696e-04 5.059063e-04 3.806917e-04 -6.000000e+00 6.173151e-03 265.93 -2.00 20.00 -2.00 320.07 0.00e+00 3.731 0.001 302.00 328.00 3 3.1742e+00 4.5249e-03 4.6558e-02 -6.0000e+00 3.6985e-01 2.0686e-02 5.5478e-03 2.8876e-02 -6.0000e+00 4.0357e-01 1.9052e-02 5.6409e-03 1.5562e-02 -6.0000e+00 2.3836e-01 -1.6472e-02 2.9782e-03 5.0230e-03 -6.0000e+00 1.0038e-01 3.0802e-04 -9.2099e-04 9.6886e-05 6.6088e-05 -6.0000e+00 7.7232e-03 -1.2251e-02 2.5030e-05 10 0 0 10 0 0 99.95 22.08 0.19 -0.01225 -0.01917 159 31 1 5 0 315.237 25.17 20.00 22.08 12.24 27.5 1045.10 -72493 47367 -39620 242366 1667 80291 46607 -4051 86324 -35455 40812 -21265 21774 -24041 16546 -3362 2449 5448 -10658 2445 -23039 7670 -19748 7561 -13091 1600 4257 5325 5743 -2373 5229 -7055 5544 -3258 4993 1763 1646 -110 -84 2152 -3217 2302 -5413 1168 -1424 2730 -1128 1132 1461 -1401 2866 -1841 1259 -737 2714 -880 1015 -708 1190 1146 757 1410 -421 2230 -1314 603 -361 845 1452 -33 285 -841 413 -1052 1253 58 1953 248 1810 203 -918 -1027 -2675 -618 -1147 -533 -1015 730 -470 476 991 247 1519 400 1359 95 1310 513 237 -243 -528 -106 374 376 -1261 -602 -1149 -37 -77 217 -182 -177 90 -316 469 509 774 146 17 -746 -948 -44 -378 -190 -157 404 584 1399 120 556 320 261 139 -2 82 -419 228 -145 -359 -144 76 -93 116 -1135 308 -569 721 16 389 321 -48 528 -648 418 -396 329 -634 368 -101 77 181 -433 93 -1129 293 -991 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