File name: Pandora132s1_Berlin_20211029_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T161208.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20211029_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: 20211029 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 20211029T064559.8Z 7972.281943 249 1 48.69 2 84.24 121.17 33.70 210.76 0.00 1 0.00 1 0 25 6.324e-01 4.962e-02 4.486e-01 4.180e-02 8.450890e-01 2.315092e-02 9.885754e-03 -6.000000e+00 3.572117e-01 222.74 -2.00 3.85 -2.00 321.97 0.00e+00 -5.423922e-03 1.027850e-02 1.083382e-03 -6.000000e+00 1.780762e-02 273.50 -2.00 20.00 -2.00 321.45 0.00e+00 8.835 0.015 302.00 328.00 3 9.3165e-01 7.8497e-02 9.9397e-02 -6.0000e+00 8.8196e-01 1.4163e+00 9.5198e-02 4.8697e-02 -6.0000e+00 9.6815e-01 -1.6359e+00 6.9565e-02 2.4141e-02 -6.0000e+00 5.7305e-01 6.2500e-01 3.5492e-02 8.2818e-03 -6.0000e+00 2.4666e-01 1.4748e-05 -4.3014e-04 1.1744e-03 9.9412e-05 -6.0000e+00 1.7877e-02 -8.4935e-03 0.0000e+00 12 8 8 10 0 0 93.70 15.84 0.86 -0.00849 -0.01173 28 6 4 8 0 1738.530 14.98 15.84 12.78 20.35 20.77 23.1 964.32 900000 -59772 900000 -16463 900000 25792 -6384 -17410 -21497 900000 -30400 900000 -99506 271506 13535 113075 -9070 76747 900000 59772 900000 -7131 900000 7266 80581 217395 -64991 266499 -40141 900000 -5030 900000 216 187803 -41488 710 222091 18334 900000 -5675 165410 -3256 136716 -9589 9582 14589 5301 263228 41744 900000 2814 62108 98151 53105 61214 20641 38105 30199 98298 19881 20919 -25612 32800 26443 4994 37489 -13470 38187 9704 40903 4746 5639 37143 -15660 23335 -25807 14332 -2455 50451 -23830 -159 2762 -10375 5195 -4765 18582 -842 10390 1334 6753 -4332 -5677 15106 -6346 4076 -14214 2320 -1420 336 -5369 -8036 6004 -4697 554 -5238 -999 -7952 -1590 522 2172 1698 -5066 5974 -5289 3911 -3311 -531 -3174 89 3995 -2124 6278 1264 6294 -2164 2225 2438 157 182 -1202 4528 -1859 4758 -1643 -908 901 415 1933 -922 -940 -2761 2407 -2551 900000 -5672 900000 -852 900000 1049 -260 -772 -1033 900000 -1573 900000 -12876 11041 751 4598 -704 3121 900000 2431 900000 -448 900000 430 3277 8841 -7449 10838 -2968 900000 -316 900000 16 7637 -4141 45 9032 1342 900000 -650 6727 -397 5560 -1170 1013 1424 561 10705 3225 900000 378 5051 5987 5399 5975 3106 4804 3930 5996 2506 2637 -5624 4535 4301 1036 5488 -3287 5901 2249 7818 1390 1651 7553 -4904 4365 -7032 2506 -539 7591 -9013 -56 1067 -4979 2261 -2422 7859 -449 4986 683 3103 -2079 -2632 5713 -3252 2188 -10810 1745 -1150 287 -4784 -6744 4273 -3458 397 -4260 -824 -7503 -1539 511 2409 2121 -7211 7709 -7450 4829 -4309 -690 -4459 127 5568 -3047 8655 1768 8166 -2966 2823 3084 224 302 -2110 8304 -3903 10009 -3966 -2327 2358 1109 5110 -2458 -2366 -7187 5540 -6100 SS 20211029T065208.3Z 7972.286207 252 1 49.62 2 83.45 122.44 34.20 213.09 0.00 1 0.00 1 0 17 6.125e-01 3.598e-02 4.027e-01 2.339e-02 7.828728e-01 1.322116e-02 9.325191e-03 -6.000000e+00 3.496404e-01 222.74 -2.00 3.85 -2.00 321.99 0.00e+00 -8.907164e-04 6.280141e-03 1.295473e-03 -6.000000e+00 1.676887e-02 273.50 -2.00 20.00 -2.00 321.52 0.00e+00 7.963 0.011 302.00 328.00 3 1.1653e+00 4.5714e-02 9.0363e-02 -6.0000e+00 8.6022e-01 1.0078e+00 5.6620e-02 4.5360e-02 -6.0000e+00 9.4358e-01 -1.3882e+00 4.5682e-02 2.3072e-02 -6.0000e+00 5.6068e-01 5.8046e-01 2.2621e-02 7.0464e-03 -6.0000e+00 2.3688e-01 3.1869e-05 -1.2611e-03 6.9677e-04 1.0330e-04 -6.0000e+00 1.7261e-02 -9.1260e-03 0.0000e+00 12 8 8 10 0 0 96.26 15.85 0.60 -0.00913 -0.01860 46 10 4 8 0 1078.440 15.00 15.85 13.14 20.35 20.77 23.0 965.30 39514 900000 -63323 900000 -99865 900000 -96577 104301 85555 -48700 83983 -122499 900000 40353 900000 -19506 900000 72585 90603 900000 -5846 900000 -23161 900000 15348 900000 30066 58051 900000 -6322 174577 -43610 267604 -13395 148437 10246 111304 152143 11334 169246 23603 139224 4872 315821 32622 58876 97098 56494 68195 14136 93047 20451 110073 49212 40122 73624 5901 95223 -4030 41868 4203 38398 -971 15491 28133 5746 19962 -104 25935 5610 20783 8017 18542 17629 11227 12244 -13511 2878 -19382 16234 -439 3465 -1782 -8491 14919 -8163 7440 -2310 1642 -3183 4127 -3943 -9503 -3412 -10402 237 -8062 433 -5552 -389 35 333 2354 -7653 3777 -9200 3003 -2465 -3290 -2498 -1167 -493 -267 617 -2724 310 -1056 1777 -445 -17 3778 715 3454 -572 6388 934 2511 4706 1894 2475 -1258 605 -924 1031 -230 1003 -198 435 254 -957 94 -4029 26 899 900000 -3931 900000 -6405 900000 -5595 2374 1947 -1914 1911 -10899 900000 1002 900000 -1130 900000 1802 2062 900000 -290 900000 -1294 900000 635 900000 995 1453 900000 -302 3973 -3700 6091 -915 3378 536 2533 3463 877 3852 1988 3802 510 7188 2450 3350 3757 3343 3725 1416 4659 2327 5511 4816 4475 6032 954 6068 -651 4097 612 4370 -186 2785 4610 1151 3453 -23 5017 1507 5156 2299 4600 4052 2453 2369 -3229 616 -5999 4212 -158 1364 -807 -3970 6451 -4273 3479 -1209 812 -1574 1954 -1921 -4866 -1779 -6112 148 -6372 359 -5272 -348 28 243 1569 -5780 2735 -8052 2479 -2341 -3560 -3070 -1582 -705 -385 857 -3748 404 -1431 2471 -668 -27 5417 1009 4581 -769 7772 1160 3044 6075 2908 4316 -2510 1267 -2092 2456 -592 2660 -541 1187 683 -2468 223 -9252 57 SS 20211029T070516.4Z 7972.295329 255 1 49.39 2 81.79 125.19 35.37 217.90 0.00 1 0.00 1 0 17 5.159e-01 1.453e-02 2.938e-01 7.802e-03 6.946606e-01 4.271731e-03 8.349198e-03 -6.000000e+00 2.908109e-01 222.74 -2.00 3.85 -2.00 321.78 0.00e+00 1.030076e-02 2.162508e-03 1.012064e-03 -6.000000e+00 1.303942e-02 273.50 -2.00 20.00 -2.00 321.31 0.00e+00 6.573 0.006 302.00 328.00 3 1.0201e+00 1.4700e-02 7.7017e-02 -6.0000e+00 7.1613e-01 2.7859e-01 2.0709e-02 4.6222e-02 -6.0000e+00 7.8407e-01 -3.5171e-01 2.2203e-02 2.2784e-02 -6.0000e+00 4.6618e-01 1.4729e-01 1.0510e-02 1.3683e-02 -6.0000e+00 1.9682e-01 1.5566e-04 -6.4758e-04 2.3111e-04 1.5525e-04 -6.0000e+00 1.4257e-02 -9.7280e-03 0.0000e+00 12 8 8 10 0 0 78.03 15.86 0.32 -0.00973 -0.01459 126 27 4 8 0 391.900 14.98 15.86 13.64 20.35 20.77 23.2 968.61 33283 -212494 900000 -183216 900000 -252500 -132205 -201587 -56246 -199564 -172968 11260 -157703 -21661 -75683 900000 -57479 10729 -12804 -64041 55380 -84928 37708 -64453 12053 -57705 -15768 -16585 -45648 878 -55289 46591 -47971 43265 -10211 42460 -25696 5033 10426 -12467 29906 -11209 17144 -7791 14500 5835 29439 27052 14531 23840 6544 23823 4392 13929 14636 9008 19145 -1151 6036 777 13293 5937 8486 6594 7241 3748 2735 8382 1952 9625 3237 5669 831 5284 1191 -3864 4128 -7111 1331 -3685 2249 -2000 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