File name: Pandora132s1_Berlin_20221214_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T185335.3Z 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_20221214_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: 20221214 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 20221214T080540.8Z 8383.337278 271 1 50.28 2 84.79 140.20 62.33 259.33 0.00 1 0.00 1 0 25 6.049e-01 6.398e-02 4.859e-01 5.362e-02 1.027914e+00 3.131696e-02 1.239455e-02 -6.000000e+00 3.520499e-01 220.13 -2.00 3.85 -2.00 322.12 0.00e+00 -3.548401e-03 1.129925e-02 5.898729e-03 -6.000000e+00 1.734641e-02 267.86 -2.00 20.00 -2.00 321.65 0.00e+00 9.554 0.019 302.00 328.00 3 2.3298e-01 9.9222e-02 1.1430e-01 -6.0000e+00 8.6549e-01 2.1888e+00 1.1681e-01 6.8543e-02 -6.0000e+00 9.5282e-01 -2.3492e+00 7.6151e-02 3.1401e-02 -6.0000e+00 5.5942e-01 8.3920e-01 4.3706e-02 9.3544e-03 -6.0000e+00 2.4236e-01 1.0204e-05 -1.0452e-03 1.4338e-03 1.2724e-04 -6.0000e+00 1.7730e-02 -4.2631e-02 0.0000e+00 12 8 8 10 0 0 92.60 15.00 1.04 -0.04263 -0.05049 31 7 4 8 0 1621.450 15.00 15.00 0.28 19.75 20.04 24.6 975.56 900000 42422 900000 30559 900000 -51801 900000 284950 -44880 900000 -22630 900000 -75187 900000 48740 195933 42816 96911 900000 6388 900000 -39248 900000 -14073 93151 118060 108199 204088 -41225 900000 16458 900000 40671 84034 900000 -11854 239 75261 900000 -6998 900000 66418 900000 101609 119609 900000 7296 900000 -41170 900000 526 115668 181349 -4830 87289 102 900000 9074 116218 -10297 93127 12201 59096 97927 55915 30167 -11457 134756 11827 9057 -4663 39567 76099 -14492 107812 -38740 95879 -28806 35109 28356 484 1260 3517 30407 -7453 31689 -1869 40508 8595 -7170 16478 -10443 15288 -20251 29110 -18155 11504 -5372 1199 -3248 -5208 3241 -20230 15280 -17909 3353 -7467 5700 -417 -5806 4111 -1564 2861 -5802 607 1087 963 1430 2234 715 -2217 10773 -1111 9306 -960 -818 3196 -1248 6823 -3764 6431 -7693 1727 -199 -1033 3289 -1010 2223 -2209 3677 -4098 1546 -2163 900000 4418 900000 2652 900000 -6743 900000 14837 -5258 900000 -2142 900000 -13376 900000 3691 10202 3851 5046 900000 726 900000 -5573 900000 -1532 4850 6147 5634 10626 -4098 900000 1091 900000 2695 4375 900000 -1066 19 3919 900000 -894 900000 4401 900000 5291 6228 900000 691 900000 -6626 900000 65 6023 9442 -777 6363 16 900000 1370 6051 -1555 4849 1525 5231 6628 6114 4241 -2446 7016 2340 2075 -1311 7211 9113 -3848 7298 -9884 5991 -6599 4936 5167 139 413 1245 8708 -3260 9735 -827 11811 3356 -3098 5234 -4133 4696 -9701 10004 -12005 6709 -3916 902 -2583 -4312 2160 -15168 7876 -13614 2183 -5754 4215 -376 -5909 4378 -1940 3535 -7800 745 1297 1167 1807 2940 968 -2969 13069 -1446 10660 -1190 -983 3661 -1632 9770 -6450 11323 -17114 3784 -481 -2713 8671 -2824 6040 -6168 9154 -10087 3615 -5046 SS 20221214T081151.2Z 8383.341564 274 1 49.50 2 84.20 141.50 63.25 260.58 0.00 1 0.00 1 0 17 5.338e-01 3.544e-02 5.032e-01 3.471e-02 9.855266e-01 1.932452e-02 1.148168e-02 -6.000000e+00 2.974174e-01 220.13 -2.00 3.85 -2.00 322.26 0.00e+00 -6.516101e-04 8.880007e-03 1.499268e-03 -6.000000e+00 1.298155e-02 267.86 -2.00 20.00 -2.00 321.86 0.00e+00 8.791 0.015 302.00 328.00 3 4.8040e-01 6.6435e-02 1.0268e-01 -6.0000e+00 7.3044e-01 1.5753e+00 7.9345e-02 5.4449e-02 -6.0000e+00 8.0069e-01 -1.9180e+00 5.9498e-02 2.8751e-02 -6.0000e+00 4.7549e-01 7.4152e-01 3.1664e-02 9.7452e-03 -6.0000e+00 2.0353e-01 2.1118e-05 1.9517e-04 9.1380e-04 1.4340e-04 -6.0000e+00 1.4736e-02 -4.3934e-02 0.0000e+00 12 8 8 10 0 0 8.46 15.01 0.81 -0.04393 -0.04247 51 11 4 8 0 970.400 14.98 15.01 0.75 19.75 20.14 24.4 977.45 -46110 900000 -91457 238295 55940 -27000 -124896 9404 -2508 93734 63476 -46085 -34929 -72861 265810 46928 26111 174970 53097 900000 -19842 80643 17812 53529 24174 -15637 -55046 -40070 28849 48003 900000 46767 -11860 4970 140100 202023 900000 -21061 -13316 8741 7788 28749 27959 29256 48282 33177 121624 -10572 84089 5370 19347 -4214 102749 76659 47943 88837 19187 96242 15416 38012 10686 9726 20355 42263 18214 8989 46181 -12485 31623 13204 9546 30763 33539 12370 -9295 44096 -11184 -12190 -7883 13382 -5751 9875 7344 8574 2254 -8641 11242 3601 4588 -6652 5461 -1741 743 2195 -14285 -6095 394 186 -870 -65 -1759 -5587 -1407 -8082 -5638 -6355 5728 -5407 465 -2697 -2147 -112 -4139 2034 -3220 384 -3816 1750 626 2244 3844 -1143 3102 2473 5639 85 4718 445 1847 1386 -984 2501 -1216 750 -414 -540 451 1657 924 -1658 -1037 -627 -2347 -2729 900000 -8249 8060 1892 -913 -9985 318 -85 3170 2147 -1842 -1504 -5601 8990 1587 1044 5918 1796 900000 -1098 2728 602 1810 818 -769 -3724 -2095 976 1624 900000 1582 -729 260 4739 6833 900000 -1425 -983 591 575 1945 1891 1880 2450 1908 4114 -965 3129 472 1636 -499 4518 4667 4054 5108 2206 4883 1616 2957 1084 1086 2341 4431 2587 1398 4998 -2576 4706 2680 2163 5723 5785 2385 -1949 4773 -2005 -2350 -1706 2852 -1770 3006 2534 3103 915 -4092 4525 1583 1955 -3015 2050 -671 281 898 -8117 -3835 276 138 -717 -53 -1369 -4365 -947 -5768 -4176 -5030 4282 -4956 419 -2944 -2680 -149 -5969 2740 -4436 499 -5268 2401 913 3263 5295 -1556 3873 3337 7191 111 5856 631 2778 2463 -2023 5421 -2950 1931 -1157 -1578 1323 4818 2661 -4623 -2631 -1451 -5340 SS 20221214T084221.6Z 8383.362749 284 1 50.30 2 81.52 148.02 67.83 266.63 0.00 1 0.00 1 0 17 6.425e-01 1.236e-02 2.650e-01 5.945e-03 7.916549e-01 3.254999e-03 9.314396e-03 -6.000000e+00 3.577000e-01 220.13 -2.00 3.85 -2.00 321.94 0.00e+00 7.403664e-03 1.612384e-03 1.388068e-03 -6.000000e+00 1.530336e-02 267.85 -2.00 20.00 -2.00 321.53 0.00e+00 6.391 0.006 302.00 328.00 3 6.2160e-01 1.0989e-02 7.8245e-02 -6.0000e+00 8.7790e-01 3.0400e-01 1.6548e-02 5.0680e-02 -6.0000e+00 9.6121e-01 -4.1434e-01 1.9289e-02 2.7134e-02 -6.0000e+00 5.7083e-01 1.7440e-01 9.1032e-03 1.2731e-02 -6.0000e+00 2.4213e-01 2.5145e-04 -4.3532e-04 1.6893e-04 1.5483e-04 -6.0000e+00 1.7503e-02 -4.4008e-02 0.0000e+00 12 8 8 10 0 0 82.63 15.06 0.37 -0.04401 -0.04728 216 46 4 8 0 228.580 15.01 15.06 2.37 19.75 20.14 24.3 984.42 -237727 -25774 -217742 -195278 -198719 -255591 -185414 -233447 -41178 -240333 -130976 -233193 -94542 -109549 -128212 -71677 -92810 -45778 -76657 -58456 -64758 -47412 -63797 -49900 -2990 -65662 -9010 -50964 -30579 -63031 -4197 -23787 -12100 -12002 -29624 -33307 -4615 5926 4709 2720 18856 -2862 18191 10215 4491 7801 24539 3713 11563 4813 15826 18247 4688 13140 11260 13069 8527 6738 2708 1179 642 5131 11001 9208 14373 6283 4683 3616 2490 5660 5342 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