File name: Pandora101s1_Izana_20231005_L2Fit_fout2c12d20230620p1-8.txt File generation date: 20231006T174215.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v12d20230620.txt Level 1 file used: Pandora101s1_Izana_20231005_L1_smca1c12d20230620p1-8.txt Full location name: Izana Atmospheric Research Center Short location name: Izana Country of location: Spain Location latitude [deg]: 28.3090 Location longitude [deg]: -16.4994 Location altitude [m]: 2360 Local noon date: 20231005 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 11 First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1333 305.2742 305.4151 305.5559 305.6968 305.8376 305.9784 306.1192 306.2600 306.4008 306.5416 306.6823 306.8231 306.9638 307.1045 307.2452 307.3859 307.5266 307.6673 307.8080 307.9486 308.0893 308.2299 308.3706 308.5112 308.6518 308.7924 308.9329 309.0735 309.2141 309.3546 309.4951 309.6357 309.7762 309.9167 310.0572 310.1976 310.3381 310.4786 310.6190 310.7594 310.8998 311.0403 311.1807 311.3210 311.4614 311.6018 311.7421 311.8825 312.0228 312.1631 312.3034 312.4437 312.5840 312.7243 312.8645 313.0048 313.1450 313.2852 313.4254 313.5656 313.7058 313.8460 313.9862 314.1263 314.2665 314.4066 314.5467 314.6869 314.8270 314.9670 315.1071 315.2472 315.3872 315.5273 315.6673 315.8073 315.9473 316.0873 316.2273 316.3673 316.5073 316.6472 316.7871 316.9271 317.0670 317.2069 317.3468 317.4867 317.6265 317.7664 317.9062 318.0461 318.1859 318.3257 318.4655 318.6053 318.7451 318.8848 319.0246 319.1643 319.3041 319.4438 319.5835 319.7232 319.8629 320.0025 320.1422 320.2819 320.4215 320.5611 320.7007 320.8403 320.9799 321.1195 321.2591 321.3986 321.5382 321.6777 321.8172 321.9568 322.0962 322.2357 322.3752 322.5147 322.6541 322.7936 322.9330 323.0724 323.2118 323.3512 323.4906 323.6300 323.7693 323.9087 324.0480 324.1873 324.3266 324.4659 324.6052 324.7445 324.8838 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20231005T071507.8Z 8678.302174 226 1 25.08 2 87.71 96.55 17.11 273.84 0.00 1 0.00 1 0 25 7.677e-01 7.167e-02 4.817e-01 5.212e-02 1.105888e+00 3.053345e-02 1.212214e-02 -6.000000e+00 4.460529e-01 226.06 -2.00 3.19 -2.00 321.61 0.00e+00 -3.828825e-02 1.113780e-02 2.413862e-03 -6.000000e+00 2.291395e-02 279.43 -2.00 20.00 -2.00 321.07 0.00e+00 15.492 0.038 302.00 328.00 3 -1.9682e-01 9.7077e-02 1.3803e-01 -6.0000e+00 1.1028e+00 2.5505e+00 1.1362e-01 9.4187e-02 -6.0000e+00 1.1990e+00 -1.9307e+00 7.7760e-02 2.7149e-02 -6.0000e+00 7.0959e-01 6.0074e-01 4.1606e-02 3.5279e-02 -6.0000e+00 3.0756e-01 1.1365e-06 5.3652e-05 1.2286e-03 4.1521e-04 -6.0000e+00 2.1430e-02 -2.2900e-02 0.0000e+00 12 9 9 12 5 1 3.70 21.06 3.77 -0.02290 -0.02250 10 5 1 5 0 2279.410 21.06 14.99 14.56 19.10 0.0 962.91 69935 242824 -70384 900000 -70208 900000 -18280 66167 -26486 900000 27734 2041 212326 -3755 180453 -11531 21460 -3934 900000 -53150 900000 65108 128168 73184 900000 900000 -1221 900000 -690 900000 46247 296745 -54951 22698 -98762 288932 37291 29390 348012 900000 96886 263071 87181 47141 39692 -6407 69133 -20146 192872 11235 191844 -25707 39374 77245 72223 87973 -60821 33500 64575 108025 -20938 32869 34057 28615 -8049 110237 17307 19804 27264 52411 11362 15494 13044 40070 6304 -11007 42114 -36029 10021 -24242 8780 1180 12262 15246 12072 2325 17635 10605 1427 566 -445 -7705 -5038 3856 -15534 9378 -3194 5277 -8138 3858 -5752 -2703 -711 2139 -8159 1824 -3879 -5308 970 -2694 810 -2520 7856 1718 7287 -13973 4768 -2348 1327 -2998 5588 1922 1357 2376 -716 1903 -5501 -2119 -880 6797 3616 1325 -810 -625 -1197 530 -306 -378 893 -1424 2544 -2967 3547 12315 -5950 900000 -4154 900000 -927 3356 -2015 900000 1407 138 10769 -312 9152 -1116 1484 -345 900000 -6862 900000 3302 6500 3712 900000 900000 -135 900000 -51 900000 2346 15050 -9121 1674 -22313 14654 2407 2575 17650 900000 7147 13342 6431 4564 3660 -857 4144 -2972 9782 1399 9730 -5808 5591 8227 8791 9816 -27762 6117 7533 7122 -4779 4668 5355 5225 -2164 8946 3687 4520 6637 11164 3861 5029 4036 8332 1567 -2847 6194 -12426 2541 -10328 3162 527 5348 6804 5816 1273 8407 5325 745 276 -203 -3674 -2428 1917 -11030 6088 -2721 4684 -8750 3561 -5251 -2070 -487 1454 -6538 1378 -3285 -5007 994 -3361 1113 -3859 11116 2545 9831 -22748 6553 -3609 2032 -4713 7538 2495 1700 2868 -864 2152 -6724 -2837 -1397 11652 7171 2924 -1981 -1657 -3113 1397 -817 -1007 2495 -3755 5820 -6561 SS 20231005T072913.7Z 8678.311964 232 1 48.01 2 84.63 98.25 20.14 274.80 0.00 1 0.00 1 0 25 4.887e-01 1.972e-02 2.040e-01 6.003e-03 9.256730e-01 3.419446e-03 9.560750e-03 -6.000000e+00 2.791743e-01 226.06 -2.00 3.19 -2.00 321.83 0.00e+00 4.622012e-03 1.755933e-03 3.289420e-03 -6.000000e+00 1.291095e-02 279.43 -2.00 20.00 -2.00 321.40 0.00e+00 9.368 0.008 302.00 328.00 3 2.4538e+00 1.2120e-02 8.4925e-02 -6.0000e+00 6.9265e-01 9.2412e-01 1.6575e-02 4.8218e-02 -6.0000e+00 7.5118e-01 -1.0874e+00 1.6161e-02 2.7127e-02 -6.0000e+00 4.4624e-01 4.2917e-01 7.6773e-03 9.7279e-03 -6.0000e+00 1.9441e-01 1.3461e-05 -7.3920e-04 1.5195e-04 1.4879e-04 -6.0000e+00 1.3359e-02 -2.2765e-02 0.0000e+00 12 9 8 11 4 0 99.56 21.17 0.49 -0.02276 -0.02832 95 24 1 5 0 505.320 21.17 14.99 14.57 20.08 0.0 968.45 -158243 -75300 -157451 900000 -202581 32138 -187962 204081 -169502 900000 -160203 73126 -144961 -67975 -103173 -38575 -53913 -26251 5559 -64120 15216 -58050 40229 -37172 -331 -31175 -23221 -82833 37780 -36394 -11712 -10718 -7853 16689 -37438 15890 -15043 20476 19189 46530 9551 50982 13609 52744 9993 12378 12706 9491 23460 9897 30268 11530 31378 20582 36379 13553 4779 7348 31203 7188 18062 11963 13913 15481 16654 17747 13408 16757 7060 15201 5389 15934 5433 10098 -1358 1486 -4287 433 -3565 -72 982 -737 720 -1499 564 -372 2614 -1464 2390 -1702 1461 -3981 -1589 -4153 -3307 -4028 -769 -1403 -2085 -133 -2275 147 -1737 -2128 -5287 -1700 -3250 -1190 -1581 -464 89 330 372 -852 1151 -1873 221 -381 1013 80 2425 1446 2588 1295 1747 692 1063 497 689 1144 497 753 -128 187 -534 392 242 50 -759 -205 -1103 -909 -3535 -801 -3769 900000 -5926 188 -4699 1194 -3967 900000 -3664 428 -4472 -1392 -3402 -858 -1405 -614 98 -2046 231 -1766 471 -1000 -6 -821 -543 -3344 464 -1086 -343 -376 -303 508 -1818 446 -634 719 820 1742 564 2088 828 2160 626 768 810 661 1524 811 2285 1174 2864 2252 3555 1713 660 950 2994 850 1997 1589 2108 2618 2913 3053 2463 3206 1702 3842 1462 3924 1410 2493 -331 317 -948 100 -1024 -22 354 -309 325 -730 285 -199 1413 -832 1276 -895 696 -1916 -756 -2253 -2107 -3092 -675 -1427 -2297 -141 -2240 123 -1365 -1722 -4736 -1547 -3204 -1262 -1770 -597 129 508 579 -1309 1663 -2737 325 -596 1640 132 3704 2098 3572 1761 2292 885 1350 708 1161 2218 1077 1616 -296 465 -1432 1077 672 140 -2086 -523 -2601 -1976 SS 20231005T073912.3Z 8678.318893 235 1 47.87 2 82.46 99.48 22.28 275.46 0.00 1 0.00 1 0 17 6.198e-01 9.998e-03 1.977e-02 5.779e-04 7.696655e-01 3.121127e-04 8.087114e-03 -6.000000e+00 3.539551e-01 226.06 -2.00 3.19 -2.00 321.20 0.00e+00 4.804217e-03 1.473264e-04 2.751353e-03 -6.000000e+00 1.548577e-02 279.43 -2.00 20.00 -2.00 320.72 0.00e+00 7.097 0.004 302.00 328.00 3 2.4319e-01 1.0341e-03 6.5829e-02 -6.0000e+00 8.7741e-01 1.7951e-01 1.4762e-03 3.9678e-02 -6.0000e+00 9.5106e-01 -2.4042e-01 1.5820e-03 2.4119e-02 -6.0000e+00 5.6576e-01 9.3382e-02 7.5304e-04 9.6829e-03 -6.0000e+00 2.4554e-01 8.5677e-04 1.6233e-04 1.4804e-05 1.2309e-04 -6.0000e+00 1.6630e-02 -2.3194e-02 0.0000e+00 12 9 8 11 4 0 99.55 21.06 0.30 -0.02319 -0.02197 2739 698 1 5 0 17.460 21.06 15.00 14.56 20.54 0.0 974.56 -223845 -182804 -208429 -188740 -218408 -207205 -202597 -192848 -175507 -187303 -155180 -166736 -111992 -116543 -66487 -75149 -51529 -59996 -40946 -54491 -46553 -48843 -49478 -44425 -48036 -34531 -50010 -37027 -49277 -26534 -30278 -8223 -14081 -4545 -14697 -12810 -11942 -5571 880 1892 6186 2661 7893 3245 8254 3124 7628 3399 8132 5459 8249 8099 9095 8726 6709 6448 3200 3977 2063 3530 2839 5985 5643 6030 4275 5101 2628 3409 3410 2852 2894 1695 1754 184 -86 -1916 -1841 -2538 -855 -1168 -310 -1689 -1499 -1455 -1149 -521 -216 255 154 479 -187 -280 -1241 -742 -1265 -430 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