File name: Pandora101s1_Izana_20231014_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T125919.7Z 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_20231014_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: 20231014 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 20231014T071901.5Z 8687.304878 33 1 32.12 2 87.97 100.30 83.82 100.04 0.00 1 0.00 1 0 17 7.277e-01 7.578e-02 4.321e-01 5.321e-02 1.077826e+00 3.061904e-02 1.149883e-02 -6.000000e+00 4.147650e-01 225.69 -2.00 3.19 -2.00 321.27 0.00e+00 2.410752e-02 9.902044e-03 3.656820e-03 -6.000000e+00 1.948700e-02 278.73 -2.00 20.00 -2.00 320.79 0.00e+00 16.224 0.044 302.00 328.00 3 -6.7899e-01 9.2659e-02 1.4205e-01 -6.0000e+00 1.0251e+00 3.0190e+00 1.0635e-01 8.5441e-02 -6.0000e+00 1.1135e+00 -2.2147e+00 6.2001e-02 2.4631e-02 -6.0000e+00 6.6147e-01 7.4735e-01 3.3770e-02 2.6841e-02 -6.0000e+00 2.9080e-01 7.6933e-07 -8.6874e-04 1.1852e-03 2.7216e-04 -6.0000e+00 1.9614e-02 -1.0784e-03 0.0000e+00 12 9 9 12 1 1 -16.58 21.06 5.61 -0.00108 -0.00761 9 4 1 5 0 3211.370 21.06 15.00 14.51 19.55 0.0 965.49 -33000 900000 -9127 900000 -38293 900000 -755 63125 106905 72446 230619 -42658 900000 -26515 900000 13387 96529 33981 360122 33959 42954 -7551 -14117 -31469 -45815 900000 -26434 73528 33216 900000 37272 338817 -10582 122285 -39576 208669 3179 89934 900000 81554 34202 22962 239431 278101 41718 -48083 -13857 2282 199049 -17926 127914 -22366 70534 29709 25212 29764 53499 6527 5837 16974 11569 40491 -25275 124098 -32535 84598 6749 59575 6116 17552 27125 867 7467 27485 42830 -34536 9051 -21038 26482 -24869 10069 9784 24393 -181 4940 2662 10055 1369 -3666 290 -10366 8144 -18523 11230 -23951 13250 -3881 13048 -5648 12125 -9185 3692 8090 -9090 -2210 -4278 -633 -10794 8836 -6440 5224 2228 9102 -8770 3564 -14284 5665 -7871 4269 990 4518 7404 679 9904 -1897 8261 -5179 -1557 2747 4757 -2481 6985 -1427 2421 701 -1943 882 -2181 -954 -1692 3207 -3309 -6980 900000 -1458 900000 -5124 900000 -49 3270 5537 3752 11945 -3498 900000 -3871 900000 1891 6364 4320 18653 3838 3843 -960 -1728 -4149 -6256 900000 -2489 3809 1721 900000 2984 17550 -1794 6334 -7268 10808 359 4658 900000 5376 3704 2811 12402 14405 4125 -11774 -2480 365 10310 -3967 7228 -6108 7971 5176 4511 4905 7205 1285 1058 2638 1977 5872 -8248 10285 -13313 10517 1853 10183 1996 5637 8149 328 2398 6264 7099 -10912 1828 -6429 6173 -11851 3964 4358 9981 -97 2610 1476 5260 773 -2089 147 -5369 3332 -10074 5119 -18733 8647 -3578 11760 -6553 11368 -9467 2831 5280 -7109 -1706 -3501 -531 -11070 8651 -8639 7089 3323 12824 -14400 4966 -23379 7835 -13087 6523 1534 6272 9204 861 11081 -2310 8729 -6278 -2081 4255 8427 -5282 14616 -3490 6121 1915 -5059 2454 -6225 -2595 -4259 6911 -6907 SS 20231014T073502.5Z 8687.316002 40 1 47.87 2 84.52 102.25 80.48 102.04 0.00 1 0.00 1 0 17 6.978e-01 1.364e-02 6.295e-02 1.714e-03 8.939887e-01 9.533782e-04 9.003406e-03 -6.000000e+00 3.928892e-01 225.69 -2.00 3.19 -2.00 321.90 0.00e+00 5.989983e-03 5.238574e-04 1.206777e-03 -6.000000e+00 1.711334e-02 278.73 -2.00 20.00 -2.00 321.47 0.00e+00 9.218 0.008 302.00 328.00 3 6.2841e-01 3.5328e-03 8.2752e-02 -6.0000e+00 9.7371e-01 5.1141e-01 5.3246e-03 4.7229e-02 -6.0000e+00 1.0567e+00 -7.1012e-01 5.7490e-03 2.6662e-02 -6.0000e+00 6.2843e-01 2.9072e-01 2.6387e-03 1.1386e-02 -6.0000e+00 2.7351e-01 1.1171e-04 -1.1426e-03 4.3390e-05 1.3273e-04 -6.0000e+00 1.8066e-02 7.6413e-04 0.0000e+00 12 8 8 10 0 0 23.60 21.06 0.41 0.00076 -0.00782 865 220 1 5 0 55.270 21.06 14.99 14.50 20.48 0.0 971.36 -228366 -177579 -216263 -208682 -221222 -239533 -224921 -227134 -161002 -233245 -165437 -211040 -107026 -144866 -95350 -100780 -58689 -76370 -61706 -66607 -80150 -60593 -77845 -46395 -76443 -33119 -77262 -44684 -92308 -28670 -46603 -2287 -20839 -6763 -25427 -24717 -10268 -9073 16435 5228 20228 1476 26064 -519 19187 287 20451 9554 19632 10735 18065 18002 18187 22315 15422 20531 10859 16995 2755 13217 4844 14276 10131 14560 10016 10927 8005 7881 8755 7757 8556 6041 6716 1536 2404 -5083 -1563 -5742 -755 -1156 935 -22 -149 -141 45 962 642 1315 558 1615 -1153 -414 -3087 -1616 -2538 -1198 -1149 -290 -756 -1011 -1302 -1617 -1014 -2321 -1802 -2624 -1218 -1683 -387 -579 211 150 302 -210 -3 -189 -273 208 154 613 707 1500 840 1055 354 867 388 804 409 526 322 154 17 -262 -135 -119 465 -12 4 -398 -346 -941 -2810 -1484 -2726 -2219 -2386 -3056 -2665 -3036 -1318 -3720 -1576 -3590 -966 -2566 -1322 -1768 -765 -1314 -969 -1124 -1513 -921 -1483 -698 -1635 -470 -1678 -679 -2344 -460 -1152 -45 -568 -163 -688 -669 -271 -287 492 204 750 70 1010 -27 818 15 929 519 1043 694 1244 1399 1556 1991 1551 2038 1199 1709 304 1292 545 1677 1459 2294 1727 1855 1440 1535 1777 1825 2147 1575 1658 364 550 -1131 -332 -1397 -192 -361 339 -9 -68 -68 23 521 364 750 315 853 -585 -200 -1551 -891 -1679 -936 -972 -281 -791 -1037 -1216 -1324 -831 -2000 -1525 -2357 -1153 -1759 -458 -798 301 227 460 -312 -4 -286 -396 317 248 986 1085 2333 1271 1547 507 1193 534 1236 690 1021 695 333 40 -654 -360 -328 1293 -35 11 -1028 -821 -2082 SS 20231014T074531.3Z 8687.323279 43 1 47.96 2 82.27 103.56 78.31 103.39 0.00 1 0.00 1 0 17 5.351e-01 8.989e-03 1.638e-02 5.122e-04 7.255405e-01 2.729713e-04 7.552057e-03 -6.000000e+00 3.012572e-01 225.69 -2.00 3.19 -2.00 321.03 0.00e+00 3.455370e-03 1.223180e-04 1.835103e-03 -6.000000e+00 1.312187e-02 278.72 -2.00 20.00 -2.00 320.54 0.00e+00 6.945 0.003 302.00 328.00 3 4.2327e-01 8.8058e-04 6.3124e-02 -6.0000e+00 7.4662e-01 1.3434e-01 1.2181e-03 3.6230e-02 -6.0000e+00 8.1023e-01 -1.8278e-01 1.2888e-03 2.0786e-02 -6.0000e+00 4.8185e-01 7.0720e-02 6.2415e-04 7.6927e-03 -6.0000e+00 2.0973e-01 8.4908e-04 -5.8773e-04 1.3233e-05 8.7657e-05 -6.0000e+00 1.3851e-02 3.0883e-04 0.0000e+00 11 8 0 10 0 0 -7.81 21.06 0.31 0.00031 -0.00411 2792 711 1 5 0 17.130 21.06 15.00 14.50 20.88 0.0 975.26 -174302 -173640 -171302 -176587 -186560 -185063 -178702 -163085 -159687 -151690 -150644 -128728 -110753 -83377 -73013 -54639 -51083 -44563 -41625 -40452 -40285 -41754 -39149 -36946 -32747 -33537 -34179 -37264 -34978 -27613 -17706 -9299 -6698 -8624 -11364 -14551 -8539 -4435 177 4225 3255 4345 4105 4884 4944 3992 3215 3966 4486 5162 6227 6189 6699 6393 5236 4770 3596 2545 1766 1629 2747 4096 5094 4757 3650 2854 1546 2024 2681 2642 2229 1682 1119 394 -671 -1763 -2413 -2176 -1498 -1107 -975 -1611 -1962 -1571 -1114 -383 40 396 547 509 63 -626 -967 -1069 -782 -427 240 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