File name: Pandora101s1_Izana_20240921_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240922T010718.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c22p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20240921_L1_smca1c22d20230904p1-8.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: 20240921 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: Based on session 12 fieldcal with sens applied First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1209 305.2618 305.4026 305.5434 305.6843 305.8251 305.9659 306.1066 306.2474 306.3882 306.5289 306.6697 306.8104 306.9511 307.0918 307.2325 307.3732 307.5139 307.6545 307.7952 307.9358 308.0764 308.2170 308.3576 308.4982 308.6388 308.7794 308.9199 309.0605 309.2010 309.3415 309.4820 309.6225 309.7630 309.9035 310.0440 310.1844 310.3249 310.4653 310.6057 310.7461 310.8865 311.0269 311.1673 311.3076 311.4480 311.5883 311.7287 311.8690 312.0093 312.1496 312.2898 312.4301 312.5704 312.7106 312.8509 312.9911 313.1313 313.2715 313.4117 313.5519 313.6920 313.8322 313.9723 314.1125 314.2526 314.3927 314.5328 314.6729 314.8129 314.9530 315.0931 315.2331 315.3731 315.5131 315.6531 315.7931 315.9331 316.0731 316.2130 316.3530 316.4929 316.6329 316.7728 316.9127 317.0526 317.1924 317.3323 317.4722 317.6120 317.7518 317.8916 318.0315 318.1712 318.3110 318.4508 318.5906 318.7303 318.8701 319.0098 319.1495 319.2892 319.4289 319.5686 319.7082 319.8479 319.9875 320.1272 320.2668 320.4064 320.5460 320.6856 320.8252 320.9647 321.1043 321.2438 321.3833 321.5229 321.6624 321.8019 321.9413 322.0808 322.2203 322.3597 322.4991 322.6386 322.7780 322.9174 323.0568 323.1961 323.3355 323.4749 323.6142 323.7535 323.8928 324.0321 324.1714 324.3107 324.4500 324.5893 324.7285 324.8677 --------------------------------------------------------------------------------------- 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 20240921T070800.3Z 9030.297225 215 1 26.74 2 87.79 90.65 48.09 270.25 0.00 1 0.00 1 0 25 9.174e-01 8.282e-02 4.704e-01 5.117e-02 1.055474e+00 3.001189e-02 1.460283e-02 -6.000000e+00 5.330891e-01 226.60 -2.00 3.19 -2.00 321.45 0.00e+00 -8.557031e-02 7.839932e-03 7.325371e-03 -6.000000e+00 2.497560e-02 280.45 -2.00 20.00 -2.00 320.64 0.00e+00 15.705 0.040 302.00 328.00 3 2.5982e-01 8.9590e-02 1.7570e-01 -6.0000e+00 1.3305e+00 2.2992e+00 1.0981e-01 2.0526e-01 -6.0000e+00 1.4522e+00 -2.1112e+00 7.6220e-02 2.6711e-02 -6.0000e+00 8.5587e-01 7.1998e-01 4.0687e-02 7.8468e-02 -6.0000e+00 3.6968e-01 9.4372e-07 1.0986e-03 1.2609e-03 8.6286e-04 -6.0000e+00 2.4908e-02 4.6736e-03 0.0000e+00 12 9 9 12 1 1 82.24 20.96 4.03 0.00467 0.01293 11 5 1 5 0 2227.790 20.96 14.99 14.53 19.23 1.5 735.01 13262 900000 73643 900000 47559 900000 123967 195224 285136 900000 193280 353436 900000 91987 900000 97432 900000 21165 17110 36156 119924 -15144 86015 153993 -44617 133935 188216 127419 118787 900000 248911 900000 -51907 900000 -78001 93099 -33216 95478 220761 183490 95065 125312 336879 49448 83763 245 262784 -439 332999 -12608 78749 41402 107512 143216 66595 44551 92869 49128 39861 82851 -53360 36417 44692 22994 -572 85165 21264 30815 12492 5454 23278 52775 12763 41227 20571 -23917 47781 -22667 -1656 -31449 24653 -9491 12707 -3411 22816 2293 20864 11809 1714 -3488 2232 115 10197 27141 -11466 806 -8050 1183 -15003 10153 -18795 -7147 -2463 -6566 -2142 -4447 -2951 -4395 1762 -4646 816 -1231 7415 -2561 10564 -4810 -931 -5270 -751 2380 454 7585 -322 7881 -1972 3122 1366 -275 2150 8563 -122 -1151 -4487 1853 3043 739 -344 -378 357 2546 -6444 -605 1541 900000 3667 900000 2368 900000 6173 9720 14197 900000 10499 17598 900000 7078 900000 5733 900000 2203 1704 2782 5971 -2056 6230 9062 -25649 13338 9372 6921 5915 900000 12394 900000 -10103 900000 -16948 4636 -5864 6483 10992 9136 12479 11344 16774 6267 6066 34 13084 -54 16581 -1997 6274 5360 8030 8557 9948 9539 12947 9785 7145 7838 -17801 5077 6231 4236 -131 8057 4023 5984 3421 1819 6954 11825 4004 8622 4507 -7145 6661 -6659 -445 -13310 6997 -4395 5188 -1750 9543 1222 9349 5645 854 -1684 956 50 4214 10676 -7650 542 -6694 1002 -15538 7836 -17500 -5231 -1631 -4806 -1610 -3565 -2469 -4092 1781 -5853 1106 -1826 10337 -3877 13466 -6969 -1322 -8135 -1148 3472 635 9291 -415 9143 -2454 3544 1591 -371 3362 14454 -251 -2579 -11304 4788 8379 1952 -927 -1014 1004 6439 -16171 -1326 SS 20240921T072307.2Z 9030.307723 222 1 47.85 2 84.47 92.45 51.31 271.99 0.00 1 0.00 1 0 25 7.578e-01 1.298e-02 6.449e-02 1.673e-03 9.003769e-01 9.328382e-04 9.069899e-03 -6.000000e+00 4.280858e-01 226.60 -2.00 3.19 -2.00 321.87 0.00e+00 4.962555e-03 5.175305e-04 1.197138e-03 -6.000000e+00 1.871689e-02 280.45 -2.00 20.00 -2.00 321.42 0.00e+00 9.149 0.008 302.00 328.00 3 6.3748e-01 3.4741e-03 8.2469e-02 -6.0000e+00 1.0625e+00 4.5579e-01 5.3259e-03 4.7315e-02 -6.0000e+00 1.1521e+00 -6.3205e-01 5.7665e-03 2.6812e-02 -6.0000e+00 6.8537e-01 2.5773e-01 2.6270e-03 1.0852e-02 -6.0000e+00 2.9807e-01 1.1596e-04 -1.0320e-03 4.2167e-05 1.2461e-04 -6.0000e+00 1.9627e-02 2.3073e-03 0.0000e+00 12 8 8 10 0 0 92.72 21.06 0.41 0.00231 -0.00545 823 210 1 5 0 58.130 21.06 15.00 14.53 20.07 1.5 739.27 -234941 -215986 -240078 -195715 -258970 -231938 -249078 -221400 -248637 -212039 -223726 -178790 -169856 -144656 -118184 -97447 -77374 -91046 -55553 -75011 -62008 -89807 -64979 -74484 -83950 -69083 -53800 -85982 -54787 -60661 -40579 -19504 -28636 -11640 -40202 -13003 -25519 803 2143 16694 9137 17709 6534 14103 6128 3953 9388 6065 10165 12715 17539 15619 17860 15644 19036 15485 14733 7428 10840 4467 7513 8842 12012 12564 9596 10450 6039 7682 7162 8596 7870 7303 4334 4140 269 -2477 -5298 -3345 -1501 -331 701 82 -204 -569 541 512 1359 510 1388 537 386 -1622 -2150 -2432 -1787 -1051 -769 -342 -926 -553 -1516 -1483 -1648 -1975 -2541 -1800 -1889 -1265 -543 -114 367 278 271 23 -116 -286 -79 -141 113 176 775 1310 1140 1037 745 507 707 454 201 542 278 269 -28 -185 -165 33 149 216 -91 -214 -530 -737 -2265 -1954 -2849 -1364 -3073 -2098 -2918 -2200 -3540 -2422 -3103 -1983 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5.6304e-01 9.0835e-04 6.2603e-02 -6.0000e+00 7.4019e-01 1.1652e-01 1.2507e-03 3.6218e-02 -6.0000e+00 8.0254e-01 -1.6300e-01 1.3033e-03 2.0152e-02 -6.0000e+00 4.7744e-01 6.3266e-02 6.3090e-04 7.0184e-03 -6.0000e+00 2.0766e-01 7.9286e-04 -4.8357e-04 1.3616e-05 8.4452e-05 -6.0000e+00 1.3671e-02 1.5924e-03 0.0000e+00 11 8 0 10 0 0 22.95 20.96 0.29 0.00159 -0.00204 2353 599 1 5 0 20.320 20.96 15.00 14.53 20.51 1.5 743.74 -181466 -170481 -168366 -174545 -188017 -173461 -172874 -157609 -162874 -144785 -148774 -126068 -113241 -87529 -69698 -54932 -49543 -46404 -39766 -38320 -36501 -38000 -39173 -35988 -32562 -31288 -29424 -39414 -34173 -29938 -17290 -10773 -8401 -8147 -13791 -11868 -9307 -2038 506 4039 3055 4569 3994 4652 3965 3893 3512 3324 3494 5017 5275 6288 6484 5819 5406 4548 3833 2070 2174 1450 2547 3885 4917 4655 3476 2712 1605 1870 2513 2367 2268 1540 869 356 -495 -1568 -2534 -2283 -1664 -1386 -1176 -1687 -1964 -1538 -958 -417 277 535 636 569 82 -553 -1049 -992 -747 -307 289 324 -20 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