File name: Pandora132s1_Berlin_20240411_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T213950.2Z 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_20240411_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: 20240411 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 20240411T050441.5Z 8867.211591 57 1 49.01 2 83.74 84.19 91.15 51.05 0.00 1 0.00 1 0 25 6.396e-01 4.324e-02 4.824e-01 3.497e-02 1.060700e+00 2.094852e-02 1.221191e-02 -6.000000e+00 3.773235e-01 227.36 -2.00 3.85 -2.00 322.40 0.00e+00 2.828698e-03 9.640392e-03 5.843234e-03 -6.000000e+00 1.832128e-02 271.89 -2.00 20.00 -2.00 321.95 0.00e+00 8.265 0.012 302.00 328.00 3 7.8949e-01 7.3056e-02 1.0871e-01 -6.0000e+00 9.4126e-01 1.8494e+00 8.8258e-02 7.8042e-02 -6.0000e+00 1.0295e+00 -2.2143e+00 6.4900e-02 3.4785e-02 -6.0000e+00 6.0554e-01 8.4060e-01 3.4327e-02 1.0777e-02 -6.0000e+00 2.5217e-01 2.0043e-05 -1.1928e-03 9.1915e-04 1.4528e-04 -6.0000e+00 1.8426e-02 -1.9832e-02 0.0000e+00 12 8 8 10 0 0 5.33 18.56 0.49 -0.01983 -0.02880 46 10 4 8 0 1064.820 14.97 18.56 13.74 22.50 22.90 29.6 962.21 233595 143474 900000 900000 -68374 900000 -37470 900000 -95481 900000 -98779 38469 253363 -58886 71419 -11671 900000 -38555 900000 229034 218368 46538 24524 17552 43028 900000 -49996 900000 13329 252244 -5566 32098 67794 -17057 77446 13789 50772 4642 129409 30991 106354 900000 48874 57930 -43853 900000 -43522 47319 -2502 74368 46476 865 74428 19986 227809 30901 61562 -3768 46621 44390 54937 64154 14489 85140 18944 90696 6025 63671 7975 23813 36251 3308 11719 17355 14056 8548 -20879 1372 10380 -4564 -19229 17829 -10682 29057 -5437 18982 12500 -9128 853 2301 -2637 -1228 19723 -11361 7606 -4294 1881 -7165 -1259 354 -1761 3886 -14660 4318 -3498 6243 -3977 -4946 1651 -6582 5593 -6605 2245 -3434 -1226 195 -1897 -11 -1930 3651 -2323 4740 2606 5773 797 3661 2474 3545 2679 -1546 -563 -2086 1477 -1325 1182 1251 176 4721 -2328 -1368 -821 235 -3089 7950 4883 900000 900000 -5288 900000 -1739 900000 -7680 900000 -7640 1309 8622 -5101 2431 -830 900000 -3817 900000 7794 7431 1584 910 706 1464 900000 -3403 900000 454 8584 -276 1291 2307 -1214 2636 657 1728 284 4404 1898 3619 900000 2661 2760 -5020 900000 -5332 2416 -221 3290 3005 97 4306 2108 7753 3050 4400 -487 3332 3021 3365 3930 1676 5505 2514 5864 923 5850 1438 4133 5922 754 2313 2894 2105 1193 -3766 215 1766 -1103 -6413 4733 -4144 8010 -2220 6331 4594 -4194 346 869 -978 -430 5705 -4988 3287 -2528 1129 -5475 -993 275 -1286 2579 -9570 2557 -2381 4079 -3073 -3871 1399 -7148 6195 -9031 2910 -4685 -1593 247 -2506 -15 -2813 5060 -3263 5807 3120 6537 925 4009 3023 4332 3945 -2802 -1144 -4712 3487 -3490 3254 3585 518 13232 -6842 -3736 -2031 525 -6939 SS 20240411T051042.7Z 8867.215772 60 1 49.21 2 82.83 85.37 90.44 52.19 0.00 1 0.00 1 0 17 4.740e-01 2.213e-02 4.660e-01 1.735e-02 9.476081e-01 9.995749e-03 1.077056e-02 -6.000000e+00 2.704458e-01 227.37 -2.00 3.85 -2.00 322.36 0.00e+00 5.791673e-03 5.420826e-03 2.818967e-03 -6.000000e+00 1.164733e-02 271.89 -2.00 20.00 -2.00 321.94 0.00e+00 7.382 0.009 302.00 328.00 3 9.4368e-01 3.6980e-02 9.4923e-02 -6.0000e+00 6.7340e-01 9.9551e-01 5.0031e-02 6.5144e-02 -6.0000e+00 7.3399e-01 -1.3556e+00 4.8258e-02 3.0758e-02 -6.0000e+00 4.3471e-01 5.4915e-01 2.2733e-02 1.1466e-02 -6.0000e+00 1.8197e-01 5.4528e-05 -6.2086e-04 4.7120e-04 1.4710e-04 -6.0000e+00 1.3148e-02 -2.0169e-02 0.0000e+00 12 8 8 10 0 0 -2.93 18.58 0.52 -0.02017 -0.02483 83 18 4 8 0 592.760 15.00 18.58 14.08 22.61 22.90 29.4 963.41 -106327 -69013 -45349 900000 -143125 -201946 -136732 -103579 -129707 -42341 -178661 -94370 -102396 26803 -79504 -74545 -59930 10674 -20529 -62423 57591 -68881 -106209 4041 57487 -28212 -17298 5699 30873 -39703 29207 118128 96965 9869 8396 42069 58551 -13410 17295 -4616 30513 71400 17436 24314 65958 10004 9264 44197 20932 17703 26388 55744 23997 59106 94241 69091 52460 -2395 35233 6232 39127 3207 24511 23494 28093 25373 29842 17262 18656 13446 13363 25299 13045 12358 4816 17165 -1708 122 -1265 -4827 8302 4610 3938 760 346 4333 3893 5401 -2553 -1221 -3038 3159 1858 -3860 -4081 -3216 -2277 -2474 -1622 -1622 -3368 -652 -3629 -922 -6386 -5079 -2125 -2363 -1313 -1273 -2094 240 -535 -2081 -1182 -696 -918 512 508 -41 1297 2406 3406 3583 1368 1090 752 2951 1237 879 527 447 -160 249 -69 61 -128 847 231 -106 -395 -795 -2507 -1962 -1168 -767 900000 -3082 -7144 -2523 -1752 -2394 -716 -5496 -1597 -2205 453 -2201 -2293 -1751 181 -442 -2016 974 -2119 -4737 68 973 -607 -351 96 522 -1075 494 1998 1640 284 227 783 991 -544 614 -234 1187 1933 826 1069 1897 508 486 1720 1098 1048 1607 2829 1827 3400 3986 3857 3461 -263 2503 569 2648 347 2488 2743 3327 3091 3534 2482 2998 2593 2781 4751 2648 2300 855 2410 -280 21 -265 -1282 2303 1529 1446 306 148 1877 1765 2449 -1231 -554 -1316 1229 739 -1789 -2237 -1909 -1590 -2005 -1422 -1419 -2766 -459 -2400 -598 -4675 -3890 -1687 -2064 -1300 -1469 -2769 334 -770 -2995 -1631 -939 -1271 736 768 -63 1898 3282 4416 4518 1715 1327 917 3881 1950 1619 1090 1004 -388 650 -192 179 -379 2492 672 -292 -999 -1862 -5838 SS 20240411T052316.4Z 8867.224496 63 1 49.85 2 80.91 87.85 88.93 54.54 0.00 1 0.00 1 0 17 6.706e-01 1.184e-02 2.740e-01 5.752e-03 8.262082e-01 3.240877e-03 9.607765e-03 -6.000000e+00 3.855049e-01 227.37 -2.00 3.85 -2.00 322.01 0.00e+00 9.030533e-03 1.681994e-03 1.520808e-03 -6.000000e+00 1.624234e-02 271.90 -2.00 20.00 -2.00 321.58 0.00e+00 6.009 0.005 302.00 328.00 3 8.2649e-01 1.1387e-02 7.8750e-02 -6.0000e+00 9.6049e-01 3.3680e-01 1.7160e-02 5.6514e-02 -6.0000e+00 1.0474e+00 -4.4965e-01 1.9500e-02 2.7916e-02 -6.0000e+00 6.1766e-01 1.8872e-01 9.0350e-03 1.4084e-02 -6.0000e+00 2.5677e-01 2.6353e-04 -3.5706e-04 1.6150e-04 1.6750e-04 -6.0000e+00 1.8590e-02 -1.9969e-02 0.0000e+00 12 8 8 10 0 0 0.52 18.62 0.31 -0.01997 -0.02265 212 45 4 8 0 232.910 15.01 18.62 14.46 22.61 22.90 29.5 965.76 -270017 -122733 -199320 -197569 -206825 -268838 900000 -267910 -187546 -201098 -199601 -104993 -102777 -111697 -142344 -88973 -132470 -20475 -75114 -81058 -55269 -60744 15782 -85000 -28566 -64534 -20502 -95414 -39043 -51657 -69123 39708 -27581 8775 -20507 -20774 -25098 14382 10605 -1409 -5170 -2608 34265 2280 20902 2128 8958 5067 9672 6907 6766 18266 6490 18817 6593 14430 8038 6186 5755 3709 8440 7538 11079 10095 8122 5143 4427 7581 4086 7087 5147 3566 3070 2858 1620 3114 -3042 -3213 1238 2234 1192 -602 -673 -2006 297 -256 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