File name: Pandora132s1_Berlin_20221012_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T182458.4Z 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_20221012_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: 20221012 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 20221012T060950.1Z 8320.256830 195 1 50.04 2 84.51 109.74 71.75 274.16 0.00 1 0.00 1 0 23 5.675e-01 4.174e-02 5.517e-01 4.612e-02 9.626712e-01 2.588586e-02 1.132974e-02 -6.000000e+00 3.284546e-01 224.80 -2.00 3.85 -2.00 322.27 0.00e+00 -9.323486e-06 1.274862e-02 3.492468e-03 -6.000000e+00 1.518616e-02 275.94 -2.00 20.00 -2.00 321.82 0.00e+00 9.155 0.017 302.00 328.00 3 4.8270e-01 9.3143e-02 1.0748e-01 -6.0000e+00 8.1457e-01 1.6397e+00 1.1053e-01 5.7840e-02 -6.0000e+00 8.9109e-01 -1.9351e+00 7.7520e-02 2.8316e-02 -6.0000e+00 5.2666e-01 7.2854e-01 4.0812e-02 8.4952e-03 -6.0000e+00 2.2094e-01 1.4677e-05 -8.5177e-04 1.2262e-03 1.2589e-04 -6.0000e+00 1.6039e-02 -1.2632e-02 0.0000e+00 12 8 8 10 0 0 -24.91 16.00 0.55 -0.01263 -0.01903 42 9 4 8 0 1191.070 15.01 16.00 13.68 20.46 20.87 26.0 981.28 6775 28218 31846 -49284 -88447 900000 48947 -29361 900000 900000 47963 -67378 7334 -74612 900000 98991 103351 900000 -7084 148252 -21777 130432 -82817 -14024 3952 10026 -16712 -56216 106266 -89774 46823 8634 -47509 334 184623 178852 92650 900000 145245 296012 8058 900000 123918 119814 11440 900000 131352 55269 10773 29936 86952 49491 56846 69163 103661 56279 -11226 49918 21675 76130 54763 5505 -25301 34114 50861 -355 38701 -24077 11721 16640 12286 10862 38176 17147 1417 5406 -962 -20085 -26145 -16563 3426 5124 2250 717 4800 -11275 7344 2850 1388 2432 360 -3934 -3708 -190 7166 17678 -1754 -1575 2292 -6497 -3167 -7390 -5685 306 -4804 -2041 -9333 -1259 2123 760 -2046 813 -702 693 -3078 -1127 607 680 1744 630 6856 1336 2401 -545 1247 -5395 4303 300 3399 782 -873 2901 -1636 1438 -314 -1734 -1314 -291 333 1821 3775 -2904 -2183 304 1267 1430 -3018 -6500 900000 2198 -1319 900000 900000 2154 -3851 329 -6702 900000 4446 4642 900000 -434 6658 -1334 5858 -8453 -744 177 450 -819 -3672 4773 -8430 2103 423 -4461 19 8292 8033 4161 900000 6523 13294 688 900000 5565 5381 873 900000 5899 2730 871 2151 3905 3556 4085 4659 5121 4550 -1765 4035 2142 4103 3689 668 -4772 3984 5254 -61 4519 -5623 2158 3288 2704 2439 6172 3080 261 850 -156 -4240 -6928 -4835 969 1634 809 277 1875 -5418 3034 1242 598 983 139 -1520 -1449 -79 3283 8733 -1245 -1170 1778 -5465 -2603 -5576 -3855 198 -3495 -1530 -8048 -1103 2069 798 -2514 1049 -943 906 -4046 -1431 778 919 2450 903 8873 1724 3246 -742 1624 -7293 5295 428 5556 1391 -1772 6158 -3922 3618 -860 -5027 -3851 -847 942 4787 8924 -6782 -4973 SS 20221012T061553.8Z 8320.261039 198 1 49.71 2 83.64 110.98 72.63 275.31 0.00 1 0.00 1 0 25 5.205e-01 2.975e-02 4.138e-01 2.142e-02 8.970816e-01 1.263641e-02 1.028070e-02 -6.000000e+00 3.027425e-01 224.80 -2.00 3.85 -2.00 322.31 0.00e+00 -1.098575e-03 6.947177e-03 2.716641e-03 -6.000000e+00 1.523624e-02 275.94 -2.00 20.00 -2.00 321.85 0.00e+00 8.155 0.012 302.00 328.00 3 6.0105e-01 4.7554e-02 9.7545e-02 -6.0000e+00 7.4869e-01 1.1433e+00 6.1863e-02 5.7675e-02 -6.0000e+00 8.2049e-01 -1.5625e+00 5.3563e-02 2.8851e-02 -6.0000e+00 4.8143e-01 6.3089e-01 2.5643e-02 9.0072e-03 -6.0000e+00 2.0609e-01 4.1047e-05 -6.7403e-04 6.1927e-04 1.2139e-04 -6.0000e+00 1.5202e-02 -1.3395e-02 0.0000e+00 12 8 8 10 0 0 -22.27 16.00 0.59 -0.01340 -0.01846 77 16 4 8 0 645.400 15.02 16.00 14.18 20.46 20.87 25.9 983.46 900000 -50430 900000 -53595 900000 900000 900000 -123832 -38342 900000 -135313 900000 -86634 56325 3426 58601 76038 -12409 900000 -74766 82334 -29051 41169 -12069 119522 48860 23909 900000 -63172 900000 -45801 900000 101901 52911 92751 13335 900000 -20463 337167 -10400 75125 52434 131149 36609 18670 159433 -11955 900000 -11252 65843 11967 81961 55770 29717 92415 34689 80005 37720 28377 -12297 32584 11857 31168 13367 37600 44104 -1164 30536 7287 26795 8815 26286 21733 2036 21898 1632 11172 -20022 26215 -10893 -536 2622 -7925 3444 2976 11295 308 4802 4195 3051 4828 -11143 7284 -10725 -2210 -2465 1448 -3687 783 -3775 -6896 1686 -5864 1430 -6769 -1342 -3081 -845 -1150 -1996 -65 -4270 338 -2751 729 -2043 -26 -151 962 2184 -803 5185 1384 3523 444 1756 2300 859 3031 -780 2201 -355 353 -827 -90 16 1007 930 -154 1149 -1914 -694 -2645 900000 -1719 900000 -1523 900000 900000 900000 -5864 -799 900000 -7433 900000 -3938 1174 91 1221 1584 -470 900000 -5098 1715 -1101 858 -411 2490 1018 543 900000 -2991 900000 -2342 900000 2123 1433 1933 472 900000 -1279 7025 -802 2661 2404 2733 1907 1128 3322 -971 900000 -985 2881 997 3757 3602 2662 4621 3180 4667 3222 2483 -1537 2648 1309 3247 1866 4309 4687 -196 4008 1366 4690 1984 5039 4166 433 3376 275 1653 -4339 4206 -3064 -161 874 -3220 1327 1222 4495 142 2151 1853 1297 1891 -4899 2686 -5207 -1156 -1401 932 -2877 633 -3175 -5512 1096 -3788 962 -4821 -961 -2399 -706 -1102 -2238 -80 -5953 460 -3783 935 -2647 -33 -207 1379 3136 -1148 6620 1770 4304 544 2059 2679 1119 4536 -1403 4281 -766 811 -2073 -241 46 2811 2607 -427 2975 -4702 -1562 -5967 SS 20221012T062844.9Z 8320.269964 201 1 50.26 2 81.83 113.62 74.49 277.74 0.00 1 0.00 1 0 17 5.930e-01 1.729e-02 3.084e-01 6.586e-03 7.726075e-01 3.679384e-03 9.206580e-03 -6.000000e+00 3.359829e-01 224.80 -2.00 3.85 -2.00 322.02 0.00e+00 8.615509e-03 2.031681e-03 1.521863e-03 -6.000000e+00 1.580077e-02 275.93 -2.00 20.00 -2.00 321.56 0.00e+00 6.600 0.006 302.00 328.00 3 5.6844e-01 1.3504e-02 7.9497e-02 -6.0000e+00 8.3346e-01 3.8234e-01 1.9474e-02 4.8371e-02 -6.0000e+00 9.1130e-01 -5.5781e-01 2.0558e-02 2.6059e-02 -6.0000e+00 5.3913e-01 2.3487e-01 9.4992e-03 1.2853e-02 -6.0000e+00 2.2690e-01 2.1956e-04 -3.4335e-04 1.9066e-04 1.7495e-04 -6.0000e+00 1.6340e-02 -1.3936e-02 0.0000e+00 12 8 8 10 0 0 8.29 16.01 0.29 -0.01394 -0.01652 199 42 4 8 0 247.540 15.01 16.01 15.24 20.56 20.87 26.2 989.25 -248605 -119820 -207646 -151509 -23523 -206896 46010 -247556 900000 -216060 900000 -164872 -85118 -94297 -100795 78272 -125302 84990 -72481 900000 -41529 66123 -16189 -24110 41700 -90913 16102 -45797 121722 -70489 80134 -1505 -3075 60431 -38780 85157 -49233 78256 -11485 53579 5282 20010 17832 -8228 52841 10782 61611 5236 38560 19654 22080 18739 12463 28784 8925 30459 9299 18567 4760 7777 13168 6367 21439 5799 22364 6172 13818 1076 9754 7760 5605 8398 801 10002 -6643 3812 -5019 106 -1225 -1701 3277 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