File name: Pandora101s1_Izana_20240529_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240530T010827.4Z 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_20240529_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: 20240529 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 20240529T062426.2Z 8915.266970 189 1 43.20 2 87.90 66.39 48.11 184.71 0.00 1 0.00 1 0 33 9.105e-01 6.357e-02 4.933e-01 4.409e-02 1.257097e+00 2.996853e-02 1.849197e-02 -6.000000e+00 5.534303e-01 229.08 -2.00 3.19 -2.00 322.15 0.00e+00 -1.202008e-01 1.086031e-02 1.961433e-02 -6.000000e+00 3.198175e-02 279.42 -2.00 20.00 -2.00 321.49 0.00e+00 16.018 0.042 302.00 328.00 3 1.4555e-02 1.0314e-01 2.7217e-01 -6.0000e+00 1.3900e+00 2.4365e+00 1.3689e-01 3.9360e-01 -6.0000e+00 1.5204e+00 -2.4702e+00 1.0360e-01 5.7077e-02 -6.0000e+00 8.8965e-01 8.8527e-01 5.1933e-02 1.0046e-01 -6.0000e+00 3.9515e-01 8.3066e-07 2.1821e-04 1.1453e-03 1.2076e-03 -6.0000e+00 2.6854e-02 4.0101e-03 0.0000e+00 12 9 9 12 1 1 -2.19 21.06 5.95 0.00401 0.00565 31 9 1 5 0 1349.760 21.06 15.00 14.53 20.00 1.7 743.14 56470 900000 77762 900000 -30399 900000 74928 138491 900000 900000 900000 258955 232932 900000 900000 127064 900000 224295 900000 34229 -24518 900000 900000 900000 -29877 900000 168115 900000 900000 900000 900000 900000 21112 900000 -46676 900000 900000 340016 900000 900000 193134 414239 900000 358033 900000 41341 900000 900000 900000 94926 139171 6052 900000 79717 900000 163882 99394 100366 62578 144072 -38277 71143 43210 49992 -34024 99275 699 28096 31157 34724 31122 44737 43713 -14715 63959 23033 29227 -1157 64790 -19775 38444 18559 8717 -3577 12015 375 -8082 3295 -24140 998 -10893 16968 251 14378 3430 14475 3483 -858 -11831 -6923 -20209 -7313 -2904 28 -22149 3834 8976 -6198 986 3249 10213 363 2861 -822 5136 1657 622 -5130 1098 -3375 4837 5231 -1291 4422 2749 7525 -3541 -2065 3211 842 -2129 -715 -3243 -1823 1336 -101 2706 8 1987 2524 -5689 -684 2611 900000 3318 900000 -1297 900000 3198 5910 900000 900000 900000 11051 9940 900000 900000 5422 900000 9572 900000 1461 -1807 900000 900000 900000 -13561 900000 8479 900000 900000 900000 900000 900000 1147 900000 -4346 900000 900000 14510 900000 900000 8242 17678 900000 15279 900000 2245 900000 900000 900000 4051 5939 610 900000 5258 900000 6994 8869 8177 5827 6148 -6237 3864 3353 4267 -6072 5084 104 3717 4787 5927 5977 7637 7089 -3768 6278 2949 3368 -188 6083 -5063 6562 4594 2678 -1343 4102 149 -3518 1237 -11126 328 -3812 4562 87 4970 1537 6610 2006 -579 -9340 -5023 -15178 -4244 -1512 15 -15880 2209 5210 -4628 804 3092 10547 455 3675 -1097 6268 2037 780 -7049 1457 -4566 5594 5603 -1433 4548 2804 7032 -3733 -2468 4399 1383 -4069 -1482 -7598 -4646 3574 -284 7403 23 5164 5924 -12940 -1349 SS 20240529T064021.6Z 8915.278028 196 1 47.89 2 84.67 68.19 48.48 189.61 0.00 1 0.00 1 0 17 7.059e-01 1.458e-02 6.745e-02 1.832e-03 1.024898e+00 1.050155e-03 1.014256e-02 -6.000000e+00 4.023997e-01 229.08 -2.00 3.19 -2.00 322.18 0.00e+00 3.422381e-03 6.127624e-04 1.764560e-03 -6.000000e+00 1.735967e-02 279.42 -2.00 20.00 -2.00 321.77 0.00e+00 9.416 0.009 302.00 328.00 3 3.3525e-01 4.1650e-03 8.9637e-02 -6.0000e+00 1.0050e+00 7.7719e-01 6.4135e-03 5.8542e-02 -6.0000e+00 1.0879e+00 -1.1038e+00 6.8244e-03 3.1201e-02 -6.0000e+00 6.4554e-01 4.5109e-01 3.0706e-03 1.1455e-02 -6.0000e+00 2.7894e-01 1.0942e-04 -1.1280e-03 4.5118e-05 1.3930e-04 -6.0000e+00 1.8294e-02 3.1185e-03 0.0000e+00 12 8 8 10 0 0 -7.07 21.06 0.48 0.00312 -0.00536 1025 261 1 5 0 46.670 21.06 15.00 14.54 21.08 1.6 748.64 -210065 -180842 -226999 -186315 -225835 -219618 -215951 -204155 -211539 -210788 -198904 -190727 -160584 -135500 -106860 -84941 -58945 -71862 -55873 -68972 -70990 -77516 -74228 -59230 -100024 -78283 -70137 -94648 -83756 -57548 -58788 -29301 -23944 -1599 -25806 -11427 -15199 4652 3320 19345 15901 12477 18211 14004 15142 2841 15851 5346 23577 15132 30025 26437 29694 29433 28720 23798 22113 17701 13900 8085 6146 13659 17754 19592 17363 16532 11911 15845 13307 14878 13723 11818 9370 4874 1613 -2889 -3410 -3576 -702 288 2492 1240 1396 948 2107 1991 2111 1895 1265 732 -934 -2534 -4006 -3218 -2801 -1793 -984 -537 -1160 -1074 -1758 -1701 -2064 -2558 -2774 -2098 -1647 -1674 -878 -746 47 -10 76 -430 -172 -516 -183 -173 155 580 1135 1706 1479 1302 1003 800 715 476 252 589 357 243 -86 -295 -16 66 463 119 -34 -152 -613 -1170 -2490 -1762 -3502 -1694 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20.00 -2.00 320.96 0.00e+00 7.181 0.004 302.00 328.00 3 2.5906e-01 1.1004e-03 6.9229e-02 -6.0000e+00 1.0294e+00 2.5256e-01 1.6178e-03 4.4367e-02 -6.0000e+00 1.1144e+00 -3.6604e-01 1.7545e-03 2.6063e-02 -6.0000e+00 6.6122e-01 1.4953e-01 8.2004e-04 9.8237e-03 -6.0000e+00 2.8573e-01 7.2401e-04 -5.8612e-04 1.4533e-05 1.3043e-04 -6.0000e+00 1.8737e-02 2.7368e-03 0.0000e+00 12 8 8 10 0 0 -6.96 21.06 0.32 0.00274 -0.00167 2891 736 1 5 0 16.540 21.06 14.99 14.54 21.49 1.6 751.67 -247889 -213526 -231524 -228168 -238893 -235427 -236215 -217839 -209522 -214797 -198580 -185839 -141178 -132231 -94685 -94536 -71144 -74796 -60686 -68675 -60627 -64936 -61566 -57325 -60074 -53214 -57973 -58725 -62744 -41033 -36780 -12414 -17265 -10535 -21813 -17692 -15797 -3832 2443 4992 9438 7780 10188 6353 8658 3724 8244 5258 9887 8624 11608 11517 13544 11815 11446 10213 8194 6584 3922 4552 3804 7363 7534 8783 6248 6011 3935 4596 4561 4664 4445 3372 2911 1086 145 -2428 -2814 -3300 -1201 -820 22 -1079 -1027 -1157 -840 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