File name: Pandora132s1_Berlin_20230509_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T194722.7Z 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_20230509_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: 20230509 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 20230509T041059.4Z 8529.174299 126 1 49.69 2 84.04 69.26 85.44 206.05 0.00 1 0.00 1 0 25 6.494e-01 4.622e-02 5.465e-01 4.153e-02 1.089125e+00 2.486227e-02 1.277316e-02 -6.000000e+00 3.820806e-01 230.32 -2.00 3.85 -2.00 322.44 0.00e+00 5.748380e-03 1.154188e-02 1.267135e-03 -6.000000e+00 1.756879e-02 275.35 -2.00 20.00 -2.00 321.99 0.00e+00 8.584 0.014 302.00 328.00 3 5.3247e-01 8.8322e-02 1.0684e-01 -6.0000e+00 9.6205e-01 2.0591e+00 1.0434e-01 6.4164e-02 -6.0000e+00 1.0502e+00 -2.3215e+00 7.0973e-02 3.1765e-02 -6.0000e+00 6.1485e-01 8.3848e-01 3.8645e-02 1.1707e-02 -6.0000e+00 2.5651e-01 1.6991e-05 -1.2186e-03 1.0774e-03 1.6370e-04 -6.0000e+00 1.8278e-02 -2.2872e-02 0.0000e+00 12 8 8 10 0 0 -11.86 16.13 0.67 -0.02287 -0.03203 47 10 4 8 0 1057.060 14.98 16.13 15.53 20.56 20.96 27.3 1000.68 68246 900000 9236 134799 9952 163874 900000 -59814 900000 -100258 900000 -62741 172958 -24323 74586 -27905 104579 900000 -19630 71410 -88856 198915 262949 -21123 51920 115299 36605 -29795 51037 -64640 900000 13931 47728 8712 54811 900000 -57153 211112 -38741 900000 46877 17724 102827 145793 19032 230778 70081 9309 900000 52512 106590 6127 33576 99450 101998 73806 35364 112307 77040 96139 26752 95690 35915 32486 119501 -5885 51527 6783 57606 43518 52646 20481 10040 74160 -2786 65967 -44322 21146 -36899 19537 24923 -11166 14586 -3133 9394 -9641 6420 858 5437 -1207 -8130 21263 -17200 -454 -14540 16243 4948 -4825 -4156 833 -3395 -4082 13968 -3117 3436 -6189 -4120 -3052 -4824 -6098 581 760 -4538 4217 -3734 2210 2356 -1451 1174 -1791 3425 3411 5033 -206 7459 -994 -1372 2465 -272 2851 -1459 1193 -2036 1697 -696 152 386 227 1414 -2540 266 -3088 2144 2759 900000 529 5450 402 6625 900000 -3737 900000 -8475 900000 -3920 6992 -1609 3015 -2564 4228 900000 -1731 2887 -13063 8042 10630 -1320 2099 4661 1480 -1533 2063 -4989 900000 717 1930 512 2216 900000 -5461 8535 -3987 900000 2412 1238 4157 5894 1308 9330 2833 715 900000 2972 4309 669 2986 4825 4948 4774 3288 4540 4049 3887 2163 4255 3340 3546 5797 -999 5000 1097 6288 6158 7236 3892 1989 6896 -484 5067 -9855 2650 -9846 3633 5239 -3882 4305 -1165 3228 -4170 2440 347 2044 -459 -3090 5759 -6954 -173 -7583 7552 3081 -3511 -3299 630 -2471 -2872 7341 -1928 2112 -4428 -3082 -2492 -4219 -6387 657 941 -6154 5223 -4885 2688 2936 -1978 1635 -2587 4481 4174 5789 -244 8775 -1237 -1720 3007 -408 4924 -2992 2618 -5014 4379 -1978 448 1148 678 4089 -7188 667 -7321 4681 SS 20230509T041701.3Z 8529.178487 129 1 49.42 2 83.17 70.42 85.84 207.27 0.00 1 0.00 1 0 25 3.969e-01 2.623e-02 4.492e-01 2.099e-02 1.037147e+00 1.245278e-02 1.225060e-02 -6.000000e+00 2.303995e-01 230.32 -2.00 3.85 -2.00 322.46 0.00e+00 -1.133633e-02 6.637258e-03 5.421483e-03 -6.000000e+00 9.844486e-03 275.35 -2.00 20.00 -2.00 322.03 0.00e+00 7.690 0.010 302.00 328.00 3 7.3729e-01 4.7328e-02 1.0138e-01 -6.0000e+00 5.7789e-01 1.3525e+00 6.0097e-02 6.7041e-02 -6.0000e+00 6.2914e-01 -1.7978e+00 5.0137e-02 3.4899e-02 -6.0000e+00 3.7198e-01 7.0822e-01 2.4346e-02 1.1279e-02 -6.0000e+00 1.5482e-01 4.4315e-05 -6.7208e-04 5.5586e-04 2.2553e-04 -6.0000e+00 1.0914e-02 -2.4638e-02 0.0000e+00 12 8 8 10 0 0 -2.61 16.13 0.56 -0.02464 -0.02969 82 17 4 8 0 602.620 15.03 16.13 15.81 20.67 21.06 27.2 1001.48 108202 -97804 74374 -107987 108556 9694 15795 -52207 16027 -9661 -139871 -10755 63200 900000 -28870 900000 -14127 51871 -28842 10241 900000 -78944 27785 -44947 81901 -22600 108475 -47688 8635 900000 -13657 900000 -44038 39999 -55422 43617 -52811 43985 50525 14052 53196 26031 134043 8333 71879 13307 5019 -2223 21066 42091 23857 114640 9272 73835 10686 30454 71323 18966 34392 6892 103076 3521 41827 -2947 52466 20283 20763 41068 14850 24320 9771 31490 17608 19464 3911 -3228 12472 -6476 15917 -6751 8483 -3139 1668 173 2614 7484 612 12733 -314 12869 -8027 -252 -6464 -11060 -435 -3391 483 -1826 1510 -3183 -4662 -2474 969 -3580 -4346 -172 -7931 -71 -2162 224 -1150 -1279 -613 -1572 -532 -3761 468 -2992 1638 -101 823 2368 3460 3746 174 5190 1241 1108 1464 1235 1062 -886 -436 -1088 2200 297 74 138 897 247 -471 -1659 -2718 2213 -4365 1521 -4217 2221 198 323 -1068 328 -198 -7803 -220 1293 900000 -913 900000 -447 1061 -1073 248 900000 -4110 568 -1922 1675 -841 2219 -1862 177 900000 -432 900000 -2457 1064 -3195 981 -3044 1260 1654 776 2176 1438 2742 511 2205 708 287 -141 1120 1980 1513 3283 835 3776 1093 2679 4231 1823 2603 634 3584 360 3337 -416 4507 2406 2506 4368 2339 3980 1999 5282 3242 3185 656 -515 1633 -1100 2540 -1643 2117 -1021 573 64 1005 2878 262 4871 -134 4554 -3284 -92 -2552 -5068 -212 -1854 301 -1348 1179 -2610 -3589 -1643 620 -2191 -2861 -115 -6120 -56 -1994 237 -1417 -1724 -850 -2189 -713 -5120 624 -4340 2378 -150 1166 3105 4298 4528 212 5839 1449 1430 2232 2215 2155 -2001 -1062 -2894 6082 874 221 412 2607 678 -1190 -3890 -6263 SS 20230509T042956.1Z 8529.187455 132 1 49.39 2 81.30 72.90 86.74 209.86 0.00 1 0.00 1 0 17 6.702e-01 1.450e-02 3.083e-01 6.613e-03 8.797208e-01 3.839711e-03 1.020368e-02 -6.000000e+00 3.915703e-01 230.32 -2.00 3.85 -2.00 322.19 0.00e+00 9.587515e-03 2.153385e-03 1.948527e-03 -6.000000e+00 1.696643e-02 275.35 -2.00 20.00 -2.00 321.75 0.00e+00 6.245 0.005 302.00 328.00 3 7.2236e-01 1.4338e-02 8.4588e-02 -6.0000e+00 9.8088e-01 4.6501e-01 2.1672e-02 6.4288e-02 -6.0000e+00 1.0675e+00 -6.4665e-01 2.3938e-02 3.0027e-02 -6.0000e+00 6.2971e-01 2.6696e-01 1.0912e-02 1.4572e-02 -6.0000e+00 2.6026e-01 2.1785e-04 -4.4939e-04 1.8369e-04 1.7893e-04 -6.0000e+00 1.8818e-02 -2.4311e-02 0.0000e+00 12 8 8 10 0 0 -11.92 16.14 0.30 -0.02431 -0.02769 202 43 4 8 0 244.450 15.00 16.14 15.99 20.67 20.96 27.3 1002.46 -189197 -94726 -222767 -204615 -54158 -301637 900000 -255016 -187154 -226495 -204102 -190545 -127072 900000 -145038 900000 -90835 -14666 -72444 14332 -45080 -95130 -74026 -80338 74619 -105112 900000 -98329 -55088 -81808 -27391 -25680 -32465 27685 -62222 46494 -66290 15744 -21087 7854 22653 5341 28587 -6532 37654 -8615 14010 -9277 19656 9507 9319 33332 2402 20742 4545 22344 16192 15519 16086 3763 26330 -625 16581 7669 16066 5240 12591 12542 4282 13274 5606 10922 4601 6483 -1863 1064 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