File name: Pandora132s1_Berlin_20210901_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T154918.6Z 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_20210901_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: 20210901 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 20210901T050329.2Z 7914.210755 188 1 48.63 2 84.02 84.33 31.43 143.03 0.00 1 0.00 1 0 17 5.591e-01 5.532e-02 5.547e-01 6.184e-02 9.039031e-01 3.555040e-02 1.165233e-02 -6.000000e+00 3.334816e-01 230.47 -2.00 3.85 -2.00 321.83 0.00e+00 -3.853979e-03 1.275006e-02 7.406200e-03 -6.000000e+00 1.437588e-02 281.12 -2.00 20.00 -2.00 321.28 0.00e+00 8.551 0.014 302.00 328.00 3 1.5346e+00 1.1604e-01 1.0948e-01 -6.0000e+00 8.3644e-01 1.5931e+00 1.3591e-01 7.9031e-02 -6.0000e+00 9.0692e-01 -1.8815e+00 8.2727e-02 2.7522e-02 -6.0000e+00 5.3499e-01 7.4360e-01 4.5267e-02 1.1404e-02 -6.0000e+00 2.2848e-01 8.8862e-06 -1.8134e-03 1.6572e-03 9.2301e-05 -6.0000e+00 1.6053e-02 1.2599e-02 0.0000e+00 12 8 8 10 0 0 56.13 16.47 0.89 0.01260 -0.00103 18 4 4 8 0 2700.860 15.01 16.47 19.95 20.87 21.27 23.2 965.72 277683 -7063 -28652 -71823 6122 -77910 900000 14668 62769 -35574 -94238 158305 23112 63558 109363 -17199 -3785 900000 20237 132303 82873 -91895 900000 65354 -21667 -31172 -316 16202 21728 -27888 56561 900000 31348 59473 95999 900000 900000 206522 -17056 124507 45395 61667 197854 25392 67526 30802 22785 900000 50627 167502 85445 84758 101170 222 63155 53436 4662 18058 79322 163 75067 28493 19353 36955 20411 2300 6098 48887 25198 20063 11637 23581 1707 5056 -3002 -26396 -9500 -33018 -6169 -13810 25675 11281 11396 -1426 6727 11518 7251 19488 -5601 6872 7050 -16740 -16599 -8898 -10639 -17288 -1511 2331 -1350 -8648 -9889 553 1877 -10478 -6567 -230 -4613 -3940 3676 2957 5257 220 -91 302 755 -1117 2663 -6654 8423 2470 110 4640 -261 3000 4416 1550 -1446 -3861 1582 5398 673 813 -1166 -1582 452 -854 430 60 22 672 -1243 -1725 900000 16720 -602 -2732 -8649 369 -8103 900000 883 3779 -2531 -11864 9532 1392 3827 6585 -1789 -352 900000 1440 7966 4990 -16096 900000 3935 -2016 -3071 -21 976 1308 -2137 3406 900000 1888 3581 5780 900000 900000 12435 -2054 7497 3827 4456 11913 2446 4066 2597 2058 900000 3658 10086 5145 5614 6092 39 6084 5791 814 2610 5731 25 5424 3603 3030 5340 3564 471 1212 6770 5007 4711 3153 5679 483 1248 -705 -6993 -2059 -9741 -1634 -4740 6957 4008 4391 -661 3038 5201 3537 8449 -3035 3103 2971 -8568 -8595 -4715 -6726 -13845 -1210 1863 -1197 -8095 -8553 420 1311 -8517 -5496 -191 -4277 -3985 3940 3350 6532 306 -128 415 995 -1479 3499 -10125 11572 3623 159 6677 -380 4118 5796 2026 -1958 -5951 2705 10206 1341 1740 -2733 -4010 1197 -2374 1195 168 61 1702 -3240 -4196 900000 SS 20210901T050941.2Z 7914.215060 191 1 48.83 2 83.08 85.55 30.88 145.46 0.00 1 0.00 1 0 25 5.729e-01 4.894e-02 4.592e-01 3.794e-02 8.447711e-01 2.282563e-02 1.082302e-02 -6.000000e+00 3.473578e-01 230.47 -2.00 3.85 -2.00 321.83 0.00e+00 1.535940e-02 9.812695e-03 9.179357e-04 -6.000000e+00 1.707403e-02 281.12 -2.00 20.00 -2.00 321.32 0.00e+00 7.593 0.010 302.00 328.00 3 1.9286e+00 7.7025e-02 9.1868e-02 -6.0000e+00 8.7093e-01 1.5496e+00 9.3227e-02 5.8615e-02 -6.0000e+00 9.4573e-01 -1.7065e+00 6.4877e-02 2.5281e-02 -6.0000e+00 5.5744e-01 6.4466e-01 3.2849e-02 1.6083e-02 -6.0000e+00 2.3827e-01 1.3893e-05 -2.6618e-03 1.0723e-03 2.0694e-04 -6.0000e+00 1.6446e-02 1.2660e-02 0.0000e+00 12 8 8 10 0 0 -23.16 16.47 0.47 0.01266 -0.00734 17 4 4 8 0 2871.740 15.00 16.47 20.18 20.87 21.27 23.1 966.34 83987 900000 101911 900000 -82790 900000 -23436 900000 88387 -22318 900000 -81166 900000 -24323 900000 10065 900000 121151 99947 900000 117877 107318 -57724 109511 -53613 900000 -3101 31346 -8310 53127 72801 108856 900000 4505 144075 28523 -3537 50734 69200 50808 13271 167451 -13133 182894 17796 90700 900000 71082 139034 38654 120094 28260 108710 2564 207597 68111 121133 136347 57211 79766 19492 99737 -27072 64240 14337 25808 25181 17620 53147 16134 25632 -12800 25192 9391 56849 11901 19706 5443 -28826 3165 -15763 20090 -16277 1769 1870 -1475 6070 -10287 9440 -11064 9532 -2293 5981 -8578 3201 -2783 -8738 10881 -9907 -1597 -326 -5082 1804 53 245 -8629 -682 -3135 2889 -6208 4988 -1587 -328 -2143 3080 1950 -5580 4257 -2009 2186 4025 873 3456 772 6070 -2819 5801 -3808 1154 1165 2538 1042 -298 3444 -549 326 -1625 -568 -1341 -589 335 -1286 900000 3099 900000 3761 900000 -9930 900000 -1337 900000 3262 -1048 900000 -7624 900000 -2122 900000 844 900000 4471 3688 900000 4350 3960 -7553 4041 -6115 900000 -187 1262 -502 1961 2687 4017 900000 408 5317 1722 -308 2893 3714 3580 1425 6180 -1895 6749 1851 5021 900000 4984 5131 3761 6205 3603 7221 465 7661 7038 7152 6541 5700 6182 2877 7361 -7357 8534 2934 4589 4477 3547 9218 4114 6277 -4595 5832 2300 8392 2460 3636 1245 -9961 956 -6716 6740 -8464 807 897 -767 3034 -6108 4497 -6125 3997 -1023 2448 -4432 1718 -1886 -7387 8652 -10403 -1516 -279 -4024 1235 38 186 -7555 -588 -3029 2986 -8060 6459 -2321 -476 -3077 4029 2538 -8069 5899 -3121 3294 5752 1221 4533 1010 7291 -3575 6753 -5378 1807 2091 4955 2213 -686 8179 -1445 882 -4552 -1579 -3679 -1515 787 -2856 900000 SS 20210901T052242.4Z 7914.224102 194 1 49.68 2 81.10 88.12 29.85 150.78 0.00 1 0.00 1 0 17 5.770e-01 1.212e-02 3.678e-01 9.230e-03 7.331434e-01 5.302815e-03 9.312639e-03 -6.000000e+00 3.378483e-01 230.46 -2.00 3.85 -2.00 321.79 0.00e+00 8.778747e-03 2.846589e-03 3.461019e-03 -6.000000e+00 1.458198e-02 281.12 -2.00 20.00 -2.00 321.31 0.00e+00 6.114 0.005 302.00 328.00 3 1.6598e+00 1.9589e-02 7.5808e-02 -6.0000e+00 8.4543e-01 2.4247e-01 2.8018e-02 4.7124e-02 -6.0000e+00 9.1352e-01 -3.2034e-01 2.8987e-02 2.8626e-02 -6.0000e+00 5.4205e-01 1.3154e-01 1.3421e-02 1.2417e-02 -6.0000e+00 2.3209e-01 1.1614e-04 -6.1605e-04 2.7256e-04 1.8818e-04 -6.0000e+00 1.5847e-02 1.2481e-02 0.0000e+00 12 8 8 10 0 0 77.84 16.47 0.28 0.01248 0.00785 87 18 4 8 0 570.950 15.01 16.47 20.35 20.87 21.27 23.2 967.66 -194299 -101846 -236505 -151074 -89858 -191767 -208355 -164379 -121113 -199351 -154135 -164136 -127435 -98322 -29977 -56388 -109310 -68689 -75493 -41095 -75411 -62301 -93737 -30461 38306 -48308 -28405 -89578 -48250 -23448 26238 -26680 46932 -5372 -12729 -22267 -14947 58861 -11914 -2697 24298 31124 5763 15043 7138 -10316 25934 -4045 25849 12204 5479 8535 13427 12614 9823 19124 3300 10161 6903 7605 -6163 9143 3885 5933 9966 5667 4895 -882 4302 3062 7684 2100 2228 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