File name: Pandora132s1_Berlin_20231018_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T204909.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20231018_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20231018 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20231018T062404.5Z 8691.266718 69 1 49.54 2 84.06 114.13 120.69 92.52 0.00 1 0.00 1 0 25 6.818e-01 4.860e-02 4.547e-01 3.516e-02 8.923153e-01 2.045842e-02 1.091069e-02 -6.000000e+00 3.936287e-01 223.99 -2.00 3.85 -2.00 322.24 0.00e+00 -1.841071e-02 9.453076e-03 3.122166e-03 -6.000000e+00 1.981685e-02 275.09 -2.00 20.00 -2.00 321.77 0.00e+00 8.618 0.014 302.00 328.00 3 9.6042e-01 7.2824e-02 1.0551e-01 -6.0000e+00 9.8102e-01 1.3269e+00 8.8244e-02 7.6538e-02 -6.0000e+00 1.0825e+00 -1.8714e+00 6.0986e-02 2.5873e-02 -6.0000e+00 6.3374e-01 7.6190e-01 3.1564e-02 1.8109e-02 -6.0000e+00 2.6644e-01 1.9536e-05 -5.2969e-04 1.0181e-03 2.1189e-04 -6.0000e+00 2.0070e-02 -3.0653e-03 0.0000e+00 12 9 9 12 4 4 16.46 5.52 0.82 -0.00307 -0.00705 46 10 4 8 0 1076.680 15.00 5.52 11.95 22.80 23.11 27.7 932.34 -3154 900000 -43161 900000 -23540 -7711 38361 30821 900000 -52769 900000 -53804 900000 -41630 75811 171367 32710 900000 -17371 900000 -38864 900000 21222 900000 117992 47800 231713 -4775 900000 52394 900000 45574 900000 49150 900000 215260 -43229 900000 -39891 900000 10091 900000 60749 71281 70544 34477 325838 -17045 329972 48179 900000 39294 134848 50455 83759 188294 25527 108290 -42726 122150 24434 112621 16985 53554 75096 -15112 83041 -4843 46140 -5541 38553 28652 27422 21466 3258 76570 -20522 53369 -15896 34559 -8368 11822 621 3419 19771 -4832 28615 262 5308 -11498 5490 2701 -12955 3371 -18058 16274 -9503 -1541 -2912 -705 -7543 -828 -377 -17232 6511 -14449 4687 -4586 609 -1236 -1378 2078 -1187 3879 -2254 2027 -2659 1741 -1736 -1759 2096 -889 4343 1095 9258 -2226 4557 1348 1206 -1262 1412 1971 -888 3108 -2666 3249 -1703 -600 -1172 -301 2306 -3664 405 -207 900000 -3564 900000 -1072 -311 1311 1053 900000 -4590 900000 -4847 900000 -3879 2590 5855 1626 900000 -1349 900000 -3260 900000 989 900000 4032 2079 7917 -267 900000 1790 900000 1699 900000 1832 900000 7355 -3894 900000 -5080 900000 972 900000 3736 3653 3375 2238 11134 -1805 11275 2963 900000 3222 4608 4310 5438 6434 3140 5550 -8229 4591 2421 5003 2205 5307 6158 -2995 6242 -943 6149 -1401 6718 5580 5153 3887 623 6279 -4278 5653 -3911 6140 -2688 3555 229 1308 6823 -2246 9875 121 2267 -5500 2082 1015 -5799 1417 -9985 8285 -6642 -1134 -2334 -546 -5740 -577 -245 -12418 4383 -11580 3651 -3917 565 -1355 -1708 2665 -1604 4891 -2920 2474 -3494 2309 -2507 -2568 2846 -1182 5302 1350 11262 -2676 5652 1738 1825 -2254 2723 4078 -2032 7385 -7189 8588 -4803 -1677 -3217 -771 5287 -8286 870 SS 20231018T063005.2Z 8691.270894 72 1 49.24 2 83.23 115.37 119.83 93.65 0.00 1 0.00 1 0 25 5.399e-01 2.914e-02 4.237e-01 1.797e-02 8.465774e-01 1.013818e-02 9.884037e-03 -6.000000e+00 3.054773e-01 223.99 -2.00 3.85 -2.00 322.22 0.00e+00 8.039299e-03 5.535170e-03 1.850060e-03 -6.000000e+00 1.341832e-02 275.09 -2.00 20.00 -2.00 321.76 0.00e+00 7.748 0.010 302.00 328.00 3 7.7774e-01 3.7574e-02 9.2415e-02 -6.0000e+00 7.5503e-01 9.8195e-01 4.8123e-02 5.6083e-02 -6.0000e+00 8.2721e-01 -1.3463e+00 4.1708e-02 2.5871e-02 -6.0000e+00 4.8995e-01 5.5072e-01 2.0014e-02 1.0704e-02 -6.0000e+00 2.0556e-01 5.2675e-05 -1.3315e-03 5.0795e-04 1.3602e-04 -6.0000e+00 1.4770e-02 -3.4114e-03 0.0000e+00 12 9 9 12 4 4 -10.25 5.46 0.57 -0.00341 -0.01342 83 18 4 8 0 593.060 15.00 5.46 12.42 22.80 23.11 27.6 933.48 -96159 67220 -69551 72483 -100550 -24258 -81667 -86149 6022 -116625 -36223 -106793 -8126 -126999 105741 -49389 -6444 132083 -52309 153467 37530 900000 69734 900000 60122 6881 -4725 -55177 58907 -95482 900000 -20897 900000 62437 87695 -15255 16908 336202 -19183 115899 16156 98336 59590 67788 36174 30516 57216 11723 55149 22315 129181 17470 77524 36873 25541 58838 39122 49531 -1633 41179 8355 45886 10438 28262 37910 2211 25604 15888 33436 10093 22484 1192 11230 10715 -287 19702 -7368 25038 -16177 17275 -3294 -764 1238 -2288 9523 -2881 5211 -6454 3817 6 7378 2940 -2404 -5788 -9948 257 -6047 2569 -2924 -1312 -3326 -6467 -4082 -5540 2329 -5609 1022 -4190 -322 -1762 -322 332 -1218 -1135 -2593 1734 -823 2109 -2216 1909 1382 564 4708 -141 4888 -491 3107 918 973 1494 -211 2309 -1024 820 -1282 430 -107 1023 580 -218 -42 -2204 -1837 -3674 1177 -2104 1269 -3041 -425 -1820 -2057 105 -3713 -634 -3570 -142 -8491 1852 -2123 -195 2313 -2665 2687 717 900000 1221 900000 1053 164 -120 -2196 1031 -6384 900000 -1061 900000 1531 1536 -721 622 5887 -1377 2435 990 2755 2504 2611 1900 1710 2505 842 2704 1641 3619 1652 4344 3293 2639 4430 3562 3903 -203 3245 951 4017 1499 3811 4846 399 3676 2671 5328 2297 4843 321 2615 2289 -61 3070 -1458 3858 -4447 4114 -1136 -293 507 -1030 4035 -1326 2537 -3257 1878 3 3126 1241 -1073 -2929 -5590 156 -4591 2057 -2671 -1167 -2775 -4931 -2813 -3960 1650 -4562 831 -3936 -332 -2124 -430 469 -1769 -1606 -3583 2255 -1129 2971 -3436 2881 2031 794 6131 -188 6014 -617 3768 1253 1551 2728 -433 4976 -2440 2064 -3516 1205 -307 2910 1625 -584 -103 -5157 -4225 SS 20231018T064249.3Z 8691.279737 75 1 49.93 2 81.50 118.01 118.00 96.02 0.00 1 0.00 1 0 17 6.032e-01 1.215e-02 2.727e-01 5.874e-03 7.319549e-01 3.211966e-03 8.737379e-03 -6.000000e+00 3.393046e-01 223.99 -2.00 3.85 -2.00 321.92 0.00e+00 7.723502e-03 1.727020e-03 1.651121e-03 -6.000000e+00 1.478455e-02 275.09 -2.00 20.00 -2.00 321.45 0.00e+00 6.375 0.006 302.00 328.00 3 6.7878e-01 1.1496e-02 7.5796e-02 -6.0000e+00 8.3754e-01 2.1244e-01 1.6655e-02 4.4393e-02 -6.0000e+00 9.1530e-01 -3.4767e-01 1.8161e-02 2.4748e-02 -6.0000e+00 5.4427e-01 1.5131e-01 8.4517e-03 1.1808e-02 -6.0000e+00 2.2887e-01 2.6396e-04 -1.5986e-04 1.7083e-04 1.5862e-04 -6.0000e+00 1.6490e-02 -3.7190e-03 0.0000e+00 12 9 9 12 4 4 22.40 5.42 0.32 -0.00372 -0.00492 220 47 4 8 0 224.880 14.99 5.42 13.14 22.80 23.11 27.7 937.12 -208030 -165387 -223474 -213998 -65928 -239898 -129965 -244778 -158431 -140444 -187485 -154574 -115438 -40449 -89427 111923 -95065 -30742 -74840 -44863 -37009 -65449 -44980 -68725 60866 -39695 -18329 -66505 6921 -45517 -33261 -13421 -36308 13061 -39228 20710 -10998 17498 -4418 12153 9543 -108 11165 -1185 23278 -5686 19876 8162 -2128 16405 7841 14178 6804 13843 7762 11297 530 5695 5057 505 7664 5461 10059 4613 13141 3242 4452 2184 3946 7811 2093 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