File name: Pandora132s1_Berlin_20211024_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T161139.1Z 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_20211024_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: 20211024 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 20211024T063509.9Z 7967.274420 241 1 49.31 2 84.32 117.92 64.12 273.56 0.00 1 0.00 1 0 25 5.037e-01 3.816e-02 5.174e-01 4.027e-02 8.544080e-01 2.222662e-02 9.900775e-03 -6.000000e+00 2.886060e-01 223.31 -2.00 3.85 -2.00 322.16 0.00e+00 -1.703414e-02 1.040531e-02 6.505405e-03 -6.000000e+00 1.319279e-02 274.22 -2.00 20.00 -2.00 321.67 0.00e+00 8.924 0.016 302.00 328.00 3 8.8473e-01 7.6803e-02 1.1248e-01 -6.0000e+00 7.1421e-01 1.1612e+00 9.5535e-02 8.8434e-02 -6.0000e+00 7.8255e-01 -1.6097e+00 7.2995e-02 2.8934e-02 -6.0000e+00 4.5869e-01 6.6549e-01 3.7067e-02 1.4366e-02 -6.0000e+00 1.9153e-01 1.6913e-05 -1.2468e-03 1.1289e-03 1.4357e-04 -6.0000e+00 1.4334e-02 -9.6398e-03 0.0000e+00 12 8 8 10 0 0 57.62 15.76 0.66 -0.00964 -0.01901 38 8 4 8 0 1297.420 15.00 15.76 11.74 20.25 20.67 23.0 955.55 97446 -48708 5495 -41143 900000 900000 15049 900000 900000 -8683 -107675 -110516 900000 -11414 900000 -28731 67371 123489 121376 7386 -49940 66293 -12382 44657 135320 114103 58624 900000 9609 -93406 31246 43453 398 -13223 41759 148368 128346 36929 126722 73278 73934 43442 73094 253924 17041 12285 52674 -26848 42759 21184 47818 64131 27960 27928 27015 13355 130981 53591 22293 68293 67509 12040 61282 37058 17449 3473 35947 -3916 -515 7226 56277 13631 29645 14998 15016 -10400 10025 12838 -4545 20296 -4467 2363 7604 5945 6416 -2051 417 6505 3478 -6480 5444 -1643 -1769 -807 -11900 -4899 -1837 2432 -8726 -4143 -3695 -6496 -3731 -6970 -2120 -4734 -518 -6698 1645 -5031 1707 -2654 -1005 -1150 1834 -242 -727 1828 2727 1718 3834 -1095 504 4858 6465 1089 3860 2163 242 647 72 -2049 500 1355 -593 1377 -672 1288 -527 -51 -2210 -690 -1187 3822 -2952 215 -1760 900000 900000 590 900000 900000 -341 -10365 -11426 900000 -529 900000 -1844 2642 4843 4760 316 -3561 2600 -618 1751 5307 4475 2299 900000 377 -9324 1225 1704 23 -882 1638 5819 5033 1738 4970 3449 3769 3067 3727 9958 1337 964 2685 -3053 2515 1662 3188 4024 2741 2957 3072 1833 5650 4834 2535 4553 4501 1511 5287 4505 2669 599 4511 -783 -113 1672 8608 3261 5813 3117 2768 -2203 1651 2165 -1052 4378 -1454 825 2773 2355 2692 -989 204 3036 1637 -3202 2242 -696 -756 -374 -7140 -3227 -1369 1984 -7809 -3516 -3174 -5121 -2663 -5276 -1646 -4010 -449 -6750 1735 -5955 2129 -3710 -1407 -1582 2361 -312 -962 2483 3870 2505 5317 -1519 731 6592 8392 1444 4950 3087 409 1142 141 -4435 1131 3276 -1566 3722 -1886 3558 -1455 -133 -5406 -1699 -2890 SS 20211024T064114.2Z 7967.278636 244 1 49.36 2 83.51 119.17 65.01 274.70 0.00 1 0.00 1 0 17 4.857e-01 2.915e-02 4.320e-01 2.059e-02 7.949440e-01 1.152699e-02 9.373163e-03 -6.000000e+00 2.774104e-01 223.31 -2.00 3.85 -2.00 322.10 0.00e+00 3.935227e-03 5.956888e-03 1.096144e-03 -6.000000e+00 1.263199e-02 274.22 -2.00 20.00 -2.00 321.63 0.00e+00 8.020 0.011 302.00 328.00 3 8.0093e-01 4.1587e-02 9.1574e-02 -6.0000e+00 6.8358e-01 8.8734e-01 5.3328e-02 4.7382e-02 -6.0000e+00 7.4976e-01 -1.2216e+00 4.6349e-02 2.4184e-02 -6.0000e+00 4.4307e-01 5.0529e-01 2.2322e-02 8.3454e-03 -6.0000e+00 1.8495e-01 4.3827e-05 -1.4416e-03 5.9638e-04 1.1554e-04 -6.0000e+00 1.3624e-02 -1.0045e-02 0.0000e+00 12 8 8 10 0 0 28.09 15.76 0.49 -0.01005 -0.02088 71 15 4 8 0 695.130 14.99 15.76 12.17 20.25 20.67 22.9 957.19 -62000 -61922 -76531 900000 -121328 900000 -171212 19767 -24083 22369 -129726 -24169 22470 -69691 900000 -58901 168042 34228 145717 52668 70036 42013 -45548 206866 -54359 900000 -52582 71800 56317 8863 96011 -29436 78240 9526 900000 -29288 66322 53184 53118 61317 33 142753 -6078 37005 1213 108781 15486 99744 44914 3866 30162 21978 64411 19125 80790 30948 15712 29618 16931 39643 -6452 53238 5601 57325 11540 26947 25528 5626 35360 2011 19159 -233 28911 711 8297 1234 -7813 -972 -15589 5075 -6477 11680 -6640 8918 -405 -320 8095 -3999 8344 -608 6018 -3933 -219 -8352 -4052 -1167 -5412 -777 -3038 904 -6222 -2162 -2158 -1243 -826 -5344 -444 -7750 326 -2936 581 -945 -1371 415 -2682 165 -512 2569 -382 1357 631 2681 3165 2061 4149 383 1281 115 3114 353 1295 637 -576 966 -916 777 -619 646 476 -1123 49 -1382 -1572 -1696 -1807 -2512 900000 -4646 900000 -9991 397 -483 449 -5441 -485 451 -2796 900000 -2900 3371 749 2923 1057 1405 843 -1993 4150 -2776 900000 -2493 1440 1130 249 1926 -1712 1726 420 900000 -1704 1597 1707 2025 2460 3 2864 -549 2153 100 3055 1118 3201 2613 365 2420 2116 4393 2187 5186 3352 1986 3149 1936 3499 -932 4699 910 6210 2060 4054 3892 1106 5816 525 4535 -68 6090 183 1764 252 -1677 -207 -4472 1425 -2404 4124 -3077 3757 -199 -151 4043 -2086 4168 -317 2752 -1886 -100 -4507 -2431 -732 -4155 -653 -2825 803 -5481 -1628 -1508 -879 -625 -4493 -379 -7759 341 -3635 778 -1367 -2013 582 -3726 219 -699 3589 -582 2072 945 3754 4259 2733 5228 484 1595 157 4810 642 2579 1367 -1334 2367 -2446 2127 -1750 1816 1319 -3004 120 -3205 -3595 SS 20211024T065418.4Z 7967.287713 247 1 49.38 2 81.79 121.89 66.92 277.13 0.00 1 0.00 1 0 17 5.349e-01 1.389e-02 3.059e-01 7.929e-03 7.054980e-01 4.301315e-03 8.542044e-03 -6.000000e+00 3.003206e-01 223.31 -2.00 3.85 -2.00 321.81 0.00e+00 7.174085e-03 2.204833e-03 1.841230e-03 -6.000000e+00 1.306046e-02 274.22 -2.00 20.00 -2.00 321.34 0.00e+00 6.575 0.006 302.00 328.00 3 9.8945e-01 1.4988e-02 7.6332e-02 -6.0000e+00 7.4042e-01 2.9771e-01 2.0979e-02 4.1854e-02 -6.0000e+00 8.0943e-01 -3.8313e-01 2.2144e-02 2.3831e-02 -6.0000e+00 4.8135e-01 1.5722e-01 1.0467e-02 1.0648e-02 -6.0000e+00 2.0276e-01 1.5942e-04 -7.3309e-04 2.3215e-04 1.4603e-04 -6.0000e+00 1.4616e-02 -1.0043e-02 0.0000e+00 12 8 8 10 0 0 25.73 15.77 0.29 -0.01004 -0.01555 134 28 4 8 0 368.450 15.00 15.77 12.81 20.25 20.67 23.0 960.36 -171743 -59938 -213182 -130891 -205539 -143321 -197849 -155803 -223187 -188223 -109438 -51500 73992 -134714 15891 -93354 -29131 -46787 -7222 -32173 -60848 -4555 -64832 37720 -71628 8200 -19661 764 -26628 6153 10100 -55842 85508 -18984 1263 -12903 -54 7339 11371 7499 -808 1222 -4947 18054 -2362 3718 15816 -837 25287 7173 20248 738 19319 12212 15784 13308 3308 10656 5891 9277 -107 12745 6527 11947 8707 3805 7096 1758 5818 5534 7052 4184 4954 1079 178 3293 -4760 3164 -81 1764 -759 -521 -823 -2935 -188 -1108 253 -1846 42 -1821 1008 -384 -1871 207 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