File name: Pandora132s1_Berlin_20240514_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T215352.5Z 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_20240514_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: 20240514 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 20240514T040207.5Z 8900.168142 111 1 49.39 2 84.10 66.71 105.66 353.70 0.00 1 0.00 1 0 17 5.541e-01 3.713e-02 5.591e-01 4.084e-02 1.158461e+00 2.498597e-02 1.346878e-02 -6.000000e+00 3.305161e-01 231.00 -2.00 3.85 -2.00 322.54 0.00e+00 1.582176e-02 1.320195e-02 8.196704e-03 -6.000000e+00 1.616300e-02 276.12 -2.00 20.00 -2.00 322.12 0.00e+00 8.652 0.014 302.00 328.00 3 3.2855e-01 9.4837e-02 1.2974e-01 -6.0000e+00 8.3455e-01 2.1986e+00 1.1447e-01 1.1882e-01 -6.0000e+00 9.1345e-01 -2.5178e+00 8.2139e-02 3.8993e-02 -6.0000e+00 5.3352e-01 9.4461e-01 4.2594e-02 1.9935e-02 -6.0000e+00 2.2276e-01 1.6975e-05 -5.6703e-04 1.0307e-03 1.9345e-04 -6.0000e+00 1.5780e-02 -3.3010e-02 0.0000e+00 12 9 8 11 4 0 18.97 11.26 0.68 -0.03301 -0.03727 50 11 4 8 0 987.680 14.99 11.26 20.08 21.38 21.79 30.5 991.87 900000 900000 65204 900000 -20110 21739 -120801 -13435 900000 -33604 42640 900000 900000 -7815 -425 28004 900000 74468 51867 104646 -23210 900000 -1356 900000 25605 900000 -84417 206839 11880 110399 14478 25155 900000 79865 900000 -61252 142755 31647 53793 212984 9539 900000 -16538 2093 26042 -1495 145088 -33358 54853 -6667 82103 127074 900000 76468 70430 84828 58958 45443 -22958 99396 -17653 41137 194927 208833 65648 25963 53048 11227 70672 31307 7858 5578 24853 33730 -32244 19981 -33793 25857 -18487 -2822 6409 -5103 -851 5703 8688 -1917 9212 -2494 3875 5654 7889 -9297 23340 -4375 -1144 -7913 -4919 1431 -7598 6538 5025 -5174 404 -3641 5983 -1195 -2437 -7806 4504 -4456 -3611 120 -2451 -530 -2864 2515 -1013 1172 -865 -1519 1262 2624 612 2238 5863 -891 3517 -2890 6361 1680 -6 729 -2537 205 -1210 845 1875 1642 -803 143 -1441 -1611 -1088 900000 900000 2590 900000 -998 863 -11595 -534 900000 -1335 1694 900000 900000 -367 -23 1314 900000 2958 2060 4156 -1592 900000 -59 900000 1017 900000 -6096 8215 472 4385 575 999 900000 3172 900000 -5087 5670 1257 2136 8459 551 900000 -1254 141 1345 -101 5762 -3312 2396 -583 3261 5047 900000 3948 3916 4043 3512 2888 -2644 3948 -1823 2614 7742 8294 4693 2784 4424 1516 5894 4352 1467 1063 3652 4019 -6403 2063 -5771 2670 -3598 -583 1451 -1500 -264 1744 2691 -685 3037 -931 1323 1797 2287 -3065 5655 -1564 -477 -4337 -3165 925 -5953 4485 3552 -3514 230 -2112 3327 -755 -1665 -6232 3703 -4344 -4068 144 -3150 -670 -3630 2988 -1280 1528 -1206 -2138 1640 3126 778 2729 6729 -1065 4037 -3948 8705 2881 -11 1594 -6247 535 -3434 2448 5436 4767 -2335 385 -3574 -3630 -2345 SS 20240514T040809.8Z 8900.172336 114 1 49.70 2 83.25 67.87 105.76 355.10 0.00 1 0.00 1 0 25 6.769e-01 3.121e-02 4.625e-01 2.114e-02 1.086520e+00 1.296707e-02 1.235286e-02 -6.000000e+00 3.989501e-01 231.00 -2.00 3.85 -2.00 322.57 0.00e+00 -6.438274e-03 7.190244e-03 3.404692e-03 -6.000000e+00 1.806475e-02 276.12 -2.00 20.00 -2.00 322.15 0.00e+00 7.759 0.010 302.00 328.00 3 6.0157e-01 5.0665e-02 1.0345e-01 -6.0000e+00 1.0008e+00 1.5739e+00 6.4584e-02 7.0478e-02 -6.0000e+00 1.0904e+00 -2.0807e+00 5.3094e-02 3.6183e-02 -6.0000e+00 6.4010e-01 8.1703e-01 2.5942e-02 1.1077e-02 -6.0000e+00 2.6881e-01 4.2560e-05 -4.9664e-04 5.6293e-04 1.6110e-04 -6.0000e+00 1.9371e-02 -3.3384e-02 0.0000e+00 12 9 8 11 4 0 3.37 11.17 0.56 -0.03338 -0.03712 86 18 4 8 0 577.720 15.01 11.17 20.41 21.38 21.79 30.4 992.79 900000 49761 900000 -33396 900000 -93260 900000 79562 -72684 83056 13650 -179 -111499 900000 -29310 900000 -34686 135843 24219 12282 211599 -73979 900000 -38217 105121 -43147 113440 900000 -75364 149948 -48279 294361 -35372 143954 -41370 900000 53926 60318 118897 36835 900000 8501 142139 19135 200573 26592 9244 130151 -8906 282842 -17334 166248 27294 53423 2193 35166 66186 3545 108683 -2913 197068 8397 76339 10334 41429 49127 17630 56135 8339 64014 16546 52988 14433 25198 25813 -3945 25479 -15456 32924 -667 7126 -8303 9677 12603 1620 17295 -94 10915 -5495 5737 -2525 5350 -2783 -8749 1198 -11762 4494 -4812 1282 -4996 -162 -5356 -5019 2469 -6504 -618 -3257 573 -4042 1797 -3903 -2287 -1226 -4380 852 -2446 3370 -1667 1805 1306 129 2799 1032 5402 9 4699 -713 4392 350 354 935 -1428 1208 -839 1274 -962 1367 251 891 -242 -1773 623 -2990 900000 1024 900000 -999 900000 -3663 900000 1637 -2583 1709 281 -4 -7508 900000 -1206 900000 -1752 2795 680 368 4354 -4428 900000 -1716 2163 -2098 2334 900000 -3806 3085 -2348 6056 -1985 2962 -2244 900000 1220 1489 2446 1592 900000 542 2925 1024 4127 1204 494 2678 -623 5819 -1605 3421 1965 3188 230 2749 3813 365 3578 -270 4055 743 3927 1169 3665 4043 2031 4735 1287 6454 2894 6541 2494 3525 3133 -568 2621 -2576 3997 -139 1642 -2597 2807 3786 573 5480 -37 3863 -2239 1983 -888 1673 -962 -3564 525 -6446 2497 -3420 945 -3953 -113 -3466 -2910 1321 -4051 -385 -2224 415 -3539 1755 -4672 -2965 -1640 -6046 1090 -3185 4230 -2314 2539 1864 178 3529 1264 6184 11 5133 -821 5299 524 627 1873 -3216 2876 -2218 3545 -2862 4029 748 2586 -667 -4517 1412 -6790 SS 20240514T042058.5Z 8900.181232 117 1 50.15 2 81.42 70.31 105.91 358.05 0.00 1 0.00 1 0 17 7.215e-01 1.416e-02 3.228e-01 7.014e-03 9.371877e-01 4.095719e-03 1.075118e-02 -6.000000e+00 4.179453e-01 231.00 -2.00 3.85 -2.00 322.30 0.00e+00 9.488153e-03 2.373206e-03 3.435918e-03 -6.000000e+00 1.827769e-02 276.12 -2.00 20.00 -2.00 321.87 0.00e+00 6.321 0.006 302.00 328.00 3 6.2828e-01 1.5740e-02 9.1115e-02 -6.0000e+00 1.0484e+00 5.7832e-01 2.4114e-02 7.6931e-02 -6.0000e+00 1.1380e+00 -7.8600e-01 2.6546e-02 3.3150e-02 -6.0000e+00 6.7429e-01 3.1876e-01 1.1966e-02 1.5324e-02 -6.0000e+00 2.8364e-01 2.0457e-04 -2.8713e-04 1.9150e-04 1.8105e-04 -6.0000e+00 2.0006e-02 -3.3521e-02 0.0000e+00 12 9 8 11 4 0 10.83 11.22 0.32 -0.03352 -0.03568 204 43 4 8 0 242.240 15.00 11.22 20.68 21.38 21.79 30.4 993.98 -262912 900000 -236697 900000 -287237 -154367 -266112 -144269 -243159 -234464 -182753 -204544 -140915 -165649 106073 -129524 -66486 -127733 -92818 -38725 -90910 67011 -100008 40278 -82647 -53325 -85445 -38612 -83482 -75660 -38970 -15658 65869 -15654 -2698 -40027 -17180 20601 4406 22912 18280 49452 18912 17208 17028 45158 6817 22388 30513 3244 35304 12560 40182 11875 22791 12527 18733 17317 15560 17698 14564 22342 9836 18061 6576 5695 5258 1953 9797 8347 3640 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