File name: Pandora101s1_Izana_20231113_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T133123.7Z 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_20231113_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: 20231113 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 20231113T074034.7Z 8717.319846 33 1 41.46 2 87.90 111.68 88.57 114.05 0.00 1 0.00 1 0 25 6.895e-01 4.624e-02 4.969e-01 4.076e-02 1.146584e+00 2.726070e-02 1.276339e-02 -6.000000e+00 4.006298e-01 224.06 -2.00 3.19 -2.00 322.30 0.00e+00 -9.837028e-03 1.466905e-02 8.080107e-03 -6.000000e+00 2.893651e-02 276.11 -2.00 20.00 -2.00 321.91 0.00e+00 16.063 0.043 302.00 328.00 3 -3.4759e-01 1.0009e-01 1.3985e-01 -6.0000e+00 9.9427e-01 2.3621e+00 1.2273e-01 6.1522e-02 -6.0000e+00 1.0897e+00 -2.0186e+00 1.0415e-01 3.2164e-02 -6.0000e+00 6.3515e-01 7.1856e-01 5.1808e-02 1.3180e-02 -6.0000e+00 2.8783e-01 9.0052e-07 -3.1179e-03 1.1097e-03 3.1435e-04 -6.0000e+00 2.1072e-02 2.2536e-03 0.0000e+00 12 9 9 12 1 1 -26.69 20.96 5.51 0.00225 -0.02118 32 10 1 5 0 1256.300 20.96 15.01 14.41 16.38 0.0 940.02 -25248 900000 900000 900000 -149390 900000 -155029 900000 900000 900000 -68236 900000 900000 131598 900000 157693 93051 14135 900000 5419 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 -23473 113013 -82110 900000 900000 900000 900000 900000 300865 900000 900000 900000 55061 73783 142810 91066 153611 140822 900000 35852 103009 774 106162 92977 154577 16676 331290 101915 21079 4624 68005 45028 -3059 26112 37017 19580 12596 61019 -2531 30351 -10321 27951 33713 17210 2546 -15753 -13236 -27626 5765 780 -1044 -570 -2486 3027 4198 -16192 8385 -13376 16766 -8267 -5939 315 -3772 -2887 -271 36 -2063 1812 -4226 10305 3728 -4676 -13313 2971 -5551 -4777 -5515 5183 1804 4136 4494 -2461 4863 -9775 1174 -5098 3135 1605 5112 2667 -5524 4373 1226 -369 2399 -1788 3996 5696 -3355 2028 -1067 542 507 -45 -815 -949 -620 1642 -45 -1546 -996 900000 900000 900000 -8347 900000 -9172 900000 900000 900000 -2691 900000 900000 5190 900000 6219 3670 557 900000 214 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 -1347 4457 -7360 900000 900000 900000 900000 900000 11866 900000 900000 900000 2172 2910 5632 3592 6058 5554 900000 2314 4063 83 4187 4334 6097 1555 13066 4020 1663 474 4291 4085 -471 2987 3942 2703 2136 7220 -599 5147 -2442 3969 3856 2036 341 -2796 -2767 -8172 1455 240 -358 -205 -951 1134 1590 -7472 2910 -5381 4629 -2837 -2061 117 -1756 -1605 -175 27 -1701 1408 -3150 5690 1955 -2692 -8926 1770 -3832 -3617 -4916 4947 2064 5040 5636 -3280 5830 -13301 1467 -7117 4192 2152 6170 3039 -6536 4570 1287 -380 2394 -2116 5437 9008 -6577 4120 -2424 1315 1319 -121 -2226 -2585 -1632 3892 -96 -3073 SS 20231113T075647.6Z 8717.331107 40 1 51.08 2 84.61 113.69 85.47 116.05 0.00 1 0.00 1 0 17 6.832e-01 1.413e-02 5.205e-02 1.499e-03 8.950950e-01 8.260789e-04 8.964896e-03 -6.000000e+00 3.821634e-01 224.06 -2.00 3.19 -2.00 321.93 0.00e+00 5.569512e-03 4.473770e-04 1.322249e-03 -6.000000e+00 1.657068e-02 276.11 -2.00 20.00 -2.00 321.52 0.00e+00 9.349 0.008 302.00 328.00 3 2.9497e-01 3.0296e-03 8.3321e-02 -6.0000e+00 9.4450e-01 5.2966e-01 4.5532e-03 4.6714e-02 -6.0000e+00 1.0267e+00 -7.6226e-01 4.9703e-03 2.6656e-02 -6.0000e+00 6.1040e-01 3.1410e-01 2.2946e-03 1.0767e-02 -6.0000e+00 2.6598e-01 1.4540e-04 -1.1235e-03 3.8216e-05 1.3097e-04 -6.0000e+00 1.7679e-02 1.4994e-03 0.0000e+00 12 8 8 10 0 0 -3.31 20.96 0.44 0.00150 -0.00694 1196 305 1 5 0 39.990 20.96 15.00 14.41 17.73 0.0 948.35 -233533 -162984 -209970 -186198 -245470 -203676 -221422 -210813 -203541 -213623 -188015 -182754 -117557 -142652 -85333 -102720 -45590 -82622 -42104 -80830 -44085 -77039 -59508 -65687 -61431 -53051 -72071 -51841 -80629 -30190 -49372 -3557 -20486 -670 -34792 -14573 -17542 -595 10299 16611 16685 15085 21675 9366 19847 3671 19257 7198 21852 13240 25109 18220 25125 17797 20777 18309 14780 11682 8016 10901 5998 15936 11680 16378 10350 13423 7656 10028 8397 9753 8370 6946 6040 3077 1811 -3947 -2443 -5143 -224 -837 1875 -684 439 -722 667 421 815 865 620 1022 -837 -786 -3539 -1965 -2953 -894 -1116 -413 -831 -818 -1421 -1465 -1459 -2437 -2551 -2204 -1613 -1457 -392 -561 321 107 422 -284 17 -433 -186 -91 216 527 852 1530 1099 1340 495 734 533 840 199 667 289 368 -36 -233 -157 -62 280 35 -26 -273 -309 -1026 -3476 -1343 -2818 -1782 -3784 -2030 -2825 -2661 -2570 -3094 -2473 -2832 -1289 -2690 -1160 -1982 -560 -1618 -579 -1666 -612 -1453 -992 -1258 -1185 -962 -1549 -879 -1886 -507 -1292 -72 -569 -15 -1053 -362 -505 -17 331 585 646 631 881 434 838 188 881 398 1128 828 1597 1398 1983 1642 1956 1833 1547 1219 825 1069 654 1803 1622 2480 1740 2174 1353 1872 1841 2199 2055 1752 1463 699 406 -845 -510 -1213 -55 -255 658 -283 196 -345 335 224 449 483 340 529 -412 -372 -1745 -1064 -1922 -682 -925 -393 -852 -820 -1302 -1280 -1176 -2060 -2327 -1933 -1505 -1493 -456 -761 487 159 633 -418 25 -650 -287 -138 343 836 1287 2346 1637 1936 700 1000 726 1280 335 1286 620 847 -83 -578 -418 -169 775 97 -71 -699 -726 -2428 SS 20231113T080717.1Z 8717.338392 43 1 51.02 2 82.51 115.05 83.50 117.40 0.00 1 0.00 1 0 25 5.723e-01 9.592e-03 1.622e-02 5.025e-04 7.376865e-01 2.656726e-04 7.677591e-03 -6.000000e+00 3.201690e-01 224.06 -2.00 3.19 -2.00 321.11 0.00e+00 3.913656e-03 1.201453e-04 1.780514e-03 -6.000000e+00 1.388242e-02 276.11 -2.00 20.00 -2.00 320.65 0.00e+00 7.138 0.004 302.00 328.00 3 2.2978e-01 8.6088e-04 6.4475e-02 -6.0000e+00 7.9128e-01 1.3449e-01 1.2085e-03 3.6672e-02 -6.0000e+00 8.6010e-01 -2.0253e-01 1.3097e-03 2.1456e-02 -6.0000e+00 5.1137e-01 8.0802e-02 6.3172e-04 8.3223e-03 -6.0000e+00 2.2284e-01 9.0285e-04 -5.9980e-04 1.3037e-05 9.5081e-05 -6.0000e+00 1.4810e-02 1.0592e-03 0.0000e+00 12 8 8 10 0 0 -10.42 20.96 0.31 0.00106 -0.00345 3271 833 1 5 0 14.620 20.96 15.00 14.41 18.27 0.0 953.69 -187589 -190114 -181128 -188342 -194342 -197006 -188287 -168248 -170992 -160741 -167866 -138164 -121838 -88444 -80730 -59046 -57180 -45368 -44072 -43198 -45020 -47640 -42392 -41318 -36767 -37227 -36241 -43280 -37055 -32230 -19796 -13230 -6022 -10233 -13403 -13305 -9481 -3788 396 3977 3833 4936 4235 5882 3885 4513 3828 4580 4273 6601 6859 7612 7780 7011 6686 5000 4376 2673 2346 1821 2900 4061 5974 5223 4499 3192 2222 2134 2952 3025 2539 1976 1584 634 -670 -1569 -2933 -2437 -1385 -974 -1002 -1383 -1925 -1638 -1094 -494 5 289 629 433 29 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