File name: Pandora101s1_Izana_20240110_L2Fit_fout2c12d20230620p1-8.txt File generation date: 20240113T082146.9Z 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 v1.8.59 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v12d20230620.txt Level 1 file used: Pandora101s1_Izana_20240110_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: 20240110 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 20240110T080933.0Z 8775.339965 40 1 7.32 2 88.82 115.91 81.00 129.76 0.00 1 0.00 1 7 257 1.351e-01 1.283e-01 4.560e-03 4.163e-03 1.228099e-01 2.167713e-03 2.934643e-03 -6.000000e+00 7.608310e-02 223.09 -2.00 3.19 -2.00 312.80 0.00e+00 1.676519e-03 1.255209e-04 3.734407e-04 -6.000000e+00 3.281789e-03 272.84 -2.00 20.00 -2.00 312.50 0.00e+00 18.625 0.067 302.00 328.00 3 -9.5022e+00 5.3829e-03 1.4766e-01 -6.0000e+00 1.8776e-01 1.6704e+00 5.9335e-03 1.6580e-02 -6.0000e+00 2.0436e-01 -3.3961e-01 3.4744e-03 3.5373e-03 -6.0000e+00 1.2139e-01 8.2504e-02 1.5066e-03 7.4372e-04 -6.0000e+00 5.2565e-02 6.4111e-03 -2.5655e-03 1.1377e-04 5.6436e-05 -6.0000e+00 3.6256e-03 -4.1151e-03 0.0000e+00 12 11 10 11 4 0 18.00 21.17 1.10 -0.00412 -0.02339 2515 641 3 5 0 2.890 21.17 15.00 14.57 10.21 0.3 887.56 21935 21821 17923 1096 -11630 -20099 -13995 -7517 -1089 -6872 -10997 -12739 -3549 3089 10782 12315 10628 10672 9363 10491 6280 4419 2453 5692 4196 5087 -3097 -12037 -20769 -24042 -22121 -18426 -16699 -21556 -30180 -32421 -20188 -7484 8428 16017 21789 20192 22395 19399 17771 14490 9759 3369 -1249 -2386 -648 4081 4853 8404 5443 7208 4638 3270 -1083 -335 2906 10029 14908 16915 9553 -3546 -12115 -15832 -6546 2476 8832 9343 8809 1256 -5554 -20388 -30601 -35603 -29766 -19576 -11088 -3369 -722 4558 9362 16721 19423 21786 18933 13994 2295 -7282 -18774 -20248 -15532 -6821 2084 9564 11885 6488 -1569 -10416 -10698 -5723 2989 4929 10077 11719 16449 19779 22309 19570 12633 2567 -7792 -11581 -12003 -5696 811 7862 7382 7671 2200 -2177 -9264 -14455 -20827 -18418 -12980 -9067 -6093 -7195 -4957 -2430 4210 6636 9078 9747 9948 6632 3466 -1184 14576 14622 11769 741 -7725 -13757 -9435 -5154 -729 -4740 -7434 -8815 -2418 2152 7437 8537 8007 8007 7130 7932 4841 3346 1883 4312 3272 3891 -2430 -9381 -16180 -18673 -17264 -14367 -13133 -16954 -23563 -25708 -15618 -5929 6597 12803 17137 16352 17780 15658 14338 11764 7893 2743 -1013 -1935 -535 3349 4432 7546 5038 6567 4309 3011 -1018 -313 2735 9382 14035 15855 9042 -3391 -11472 -15261 -6254 2404 8536 9147 8508 1246 -5398 -20352 -30333 -35462 -29637 -19563 -11166 -3367 -731 4575 9604 16988 20077 22342 19696 14449 2422 -7549 -19787 -21266 -16514 -7257 2221 10239 12714 6988 -1688 -11351 -11556 -6294 3256 5506 11115 13139 18350 22320 25110 22078 14252 2907 -8909 -13095 -13851 -7184 1038 9967 9571 9743 2858 -2805 -12132 -18783 -27485 -24180 -17109 -12053 -8056 -9647 -6587 -3285 5643 9030 12341 13410 13638 9154 4779 -1656 SS 20240110T080940.4Z 8775.340050 40 2 7.32 2 88.79 115.92 80.98 129.78 0.00 1 0.00 1 7 257 1.350e-01 1.282e-01 4.416e-03 4.035e-03 1.246120e-01 2.102349e-03 2.975483e-03 -6.000000e+00 7.602274e-02 223.09 -2.00 3.19 -2.00 312.79 0.00e+00 1.607997e-03 1.217838e-04 3.834621e-04 -6.000000e+00 3.279333e-03 272.84 -2.00 20.00 -2.00 312.50 0.00e+00 18.561 0.066 302.00 328.00 3 -9.4942e+00 5.2192e-03 1.4704e-01 -6.0000e+00 1.8761e-01 1.6716e+00 5.7529e-03 1.6521e-02 -6.0000e+00 2.0420e-01 -3.4059e-01 3.3683e-03 3.6091e-03 -6.0000e+00 1.2130e-01 8.1474e-02 1.4604e-03 8.1446e-04 -6.0000e+00 5.2519e-02 6.6391e-03 -2.5810e-03 1.1032e-04 5.7272e-05 -6.0000e+00 3.6232e-03 -3.4418e-03 0.0000e+00 12 11 10 11 4 0 9.69 21.17 1.09 -0.00344 -0.02284 2515 641 3 5 0 2.890 21.17 15.00 14.57 10.21 0.3 887.56 22016 22361 15644 2709 -13922 -17769 -15488 -5615 -3843 -5346 -12472 -10903 -5450 4024 10198 13058 9865 10386 10598 9019 8339 2660 3624 3610 6496 3200 -997 -12894 -20620 -24752 -22029 -18776 -16562 -21366 -30795 -30607 -22387 -5948 6319 18024 19563 22150 20710 19864 17483 15908 9531 4142 -1395 -3659 520 3361 6256 6249 6878 5953 6351 1991 331 -1018 3419 8961 15264 16178 9280 -2386 -13165 -14680 -8142 3767 7536 10594 6503 3123 -7718 -18743 -31484 -35092 -30645 -18787 -10248 -3774 -65 3596 10747 15392 20778 20585 20034 12523 3552 -8913 -18336 -20889 -15022 -6638 1771 10293 11076 7139 -2901 -9406 -11946 -5070 1928 6720 8917 13028 15963 20488 22375 19476 12568 2168 -6795 -12986 -10823 -6404 2213 6692 8949 6055 3188 -3198 -8444 -14901 -20121 -18252 -13285 -9126 -7082 -6268 -5776 -1332 3237 7678 8231 10281 9222 6941 2649 -656 14546 14828 10455 1792 -9413 -11831 -10561 -3766 -2638 -3621 -8535 -7391 -3777 2772 7062 9715 7475 7802 7958 6908 6286 2046 2748 2790 4948 2493 -765 -10126 -16023 -19348 -17169 -14689 -13006 -16764 -24182 -23834 -17712 -4643 5055 14130 15741 17597 16725 15957 14142 12727 7722 3345 -1132 -3006 425 3032 5636 5736 6278 5496 5804 1857 306 -958 3202 8471 14315 15271 8802 -2254 -12596 -13994 -7910 3611 7380 10243 6425 3040 -7658 -18383 -31453 -34756 -30779 -18628 -10235 -3787 -65 3643 10871 15839 21173 21346 20587 13102 3696 -9376 -19216 -22063 -15883 -7047 1893 10935 11936 7632 -3158 -10133 -13049 -5532 2120 7363 9935 14395 17872 22930 25138 21965 14170 2462 -7683 -14877 -12334 -8128 2791 8573 11405 7802 4093 -4154 -10947 -19412 -26323 -23892 -17547 -12129 -9448 -8321 -7735 -1780 4380 10335 11279 14061 12726 9541 3678 -912 SS 20240110T080947.8Z 8775.340136 40 3 7.37 2 88.77 115.94 80.96 129.79 0.00 1 0.00 1 7 257 1.347e-01 1.277e-01 4.265e-03 3.897e-03 1.265583e-01 2.027758e-03 2.902512e-03 -6.000000e+00 7.581972e-02 223.09 -2.00 3.19 -2.00 312.78 0.00e+00 1.556129e-03 1.174547e-04 3.770721e-04 -6.000000e+00 3.270466e-03 272.84 -2.00 20.00 -2.00 312.50 0.00e+00 18.496 0.065 302.00 328.00 3 -9.4877e+00 5.0346e-03 1.4641e-01 -6.0000e+00 1.8710e-01 1.6715e+00 5.5524e-03 1.6404e-02 -6.0000e+00 2.0365e-01 -3.4418e-01 3.2491e-03 3.5464e-03 -6.0000e+00 1.2097e-01 8.3532e-02 1.4082e-03 8.0969e-04 -6.0000e+00 5.2382e-02 6.8929e-03 -2.5877e-03 1.0665e-04 5.6176e-05 -6.0000e+00 3.6131e-03 -3.9412e-03 0.0000e+00 12 11 10 11 4 0 4.49 21.17 1.09 -0.00394 -0.02339 2515 641 3 5 0 2.890 21.17 15.00 14.58 10.21 0.3 887.56 20888 23945 15405 3044 -14592 -18248 -15431 -5438 -2061 -6415 -11712 -12655 -2755 2944 11132 10735 12026 9383 11044 9004 8385 2389 3005 3941 5059 4432 -2558 -11178 -22297 -23270 -22433 -17774 -17308 -20100 -31611 -30302 -22477 -5930 7031 17820 20415 20933 21747 19482 18360 14344 10965 2790 -927 -4282 450 2999 6243 6462 6780 5672 4723 2441 -354 -62 2044 9890 14238 16716 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