File name: Pandora101s1_Izana_20241126_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20241127T011112.2Z 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 v1.8.60 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20241126_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: 20241126 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 20241126T075013.4Z 9096.326543 171 1 48.10 2 88.21 115.15 39.70 143.19 0.00 1 0.00 1 0 33 2.576e-01 5.897e-02 2.337e-02 7.231e-03 8.317317e-01 3.752180e-03 9.443774e-03 -6.000000e+00 1.437615e-01 223.61 -2.00 3.19 -2.00 318.66 0.00e+00 -7.509854e-03 5.711031e-04 2.784449e-03 -6.000000e+00 6.221296e-03 275.14 -2.00 20.00 -2.00 317.98 0.00e+00 16.932 0.050 302.00 328.00 3 -2.8680e+00 9.8501e-03 1.3814e-01 -6.0000e+00 3.5506e-01 2.5943e+00 1.1286e-02 4.5647e-02 -6.0000e+00 3.8623e-01 -1.6586e+00 6.5396e-03 1.8600e-02 -6.0000e+00 2.2959e-01 5.2161e-01 3.2045e-03 9.2794e-03 -6.0000e+00 9.9972e-02 7.4569e-06 1.8438e-04 1.6931e-04 1.1307e-04 -6.0000e+00 6.6674e-03 6.8062e-03 0.0000e+00 12 9 9 12 32 32 -37.24 21.06 2.06 0.00681 0.00819 22 6 1 5 0 2186.030 21.06 15.00 14.59 15.56 1.6 709.08 96984 113446 5066 -8453 -31382 59052 -36365 -14288 -25817 -16550 -22061 -9941 -9626 89943 10299 23344 16775 15546 99754 2175 6231 -9648 78624 -972 26699 2952 82415 68238 -34838 -32280 -8050 -4427 75624 -6415 -20946 -18829 77275 4429 2123 25802 13568 20396 4126 11656 -7440 -8350 -12520 -10318 -2820 -4597 2660 4497 14235 4940 16967 7612 13022 -520 -4157 -12064 -8360 -8932 1106 5945 -4395 -1481 -3680 -1268 7130 9087 4269 10258 2124 -1234 -18217 -22661 -24733 -24504 -15100 -8352 -242 1372 5718 5582 6258 4003 8372 1753 1717 -5188 -7364 -10053 -9071 -8231 -3544 964 3446 4390 4707 1812 -3187 -5752 -8434 -3982 -3470 -529 -1183 3161 4201 19108 6297 5252 3390 -2114 -3408 -5116 -2405 -2270 1110 131 3874 2902 3247 1856 1502 -2461 -837 -817 373 -571 -2203 -2706 -4272 -2862 -2791 2096 -464 4325 854 134 556 1148 10754 10397 1227 -1896 -7361 5374 -9160 -3114 -6519 -3723 -5147 -2236 -2474 9742 2753 5760 4462 4175 12237 608 1521 -2597 10033 -269 5733 774 9587 7890 -9467 -9082 -2247 -1329 10823 -1954 -6527 -5602 9643 1349 781 8368 5185 7233 1652 4035 -2932 -3173 -4828 -3906 -1014 -1789 1054 1880 5710 2278 7105 3552 5637 -239 -1799 -5282 -3566 -4181 523 2892 -2339 -729 -1850 -659 3846 5324 2730 6075 1264 -674 -10172 -11647 -12467 -13147 -8602 -5240 -161 1002 4241 4317 5034 3409 6953 1536 1441 -4313 -5742 -7605 -6811 -6726 -3203 967 3525 4997 5553 2095 -3462 -6148 -8639 -4070 -3756 -578 -1248 3464 5150 22986 9492 8307 5407 -3408 -5271 -7857 -3690 -3649 1802 214 5767 4106 4412 2463 1926 -3132 -1045 -1140 599 -1046 -4098 -5362 -9133 -6463 -6703 4915 -1124 9988 1977 291 1101 2291 SS 20241126T075310.0Z 9096.328587 175 1 11.11 2 87.62 115.51 39.33 144.17 0.00 1 0.00 1 7 257 1.348e-01 1.278e-01 3.468e-03 3.215e-03 1.749318e-01 1.655216e-03 2.826779e-03 -6.000000e+00 7.521384e-02 223.61 -2.00 3.19 -2.00 312.55 0.00e+00 1.125569e-03 9.286944e-05 3.509972e-04 -6.000000e+00 3.254667e-03 275.14 -2.00 20.00 -2.00 312.26 0.00e+00 15.317 0.037 302.00 328.00 3 -4.5401e+00 4.1108e-03 1.1801e-01 -6.0000e+00 1.8576e-01 1.6084e+00 4.5378e-03 1.4136e-02 -6.0000e+00 2.0206e-01 -4.2791e-01 2.6563e-03 3.9570e-03 -6.0000e+00 1.2011e-01 7.7826e-02 1.1490e-03 1.1341e-03 -6.0000e+00 5.2309e-02 4.5763e-04 -2.4216e-03 8.4061e-05 4.7688e-05 -6.0000e+00 3.4878e-03 5.8688e-03 0.0000e+00 12 11 11 12 1 1 15.03 21.06 1.21 0.00587 -0.01233 1410 861 1 5 0 7.870 21.06 15.00 14.58 15.64 1.6 709.34 23255 23229 18374 2404 -13701 -20498 -15487 -6687 -2165 -5701 -12965 -12925 -4288 3660 11617 14330 11624 11772 10590 10688 7740 3661 2221 5133 5768 5551 -1012 -11721 -21799 -24759 -21260 -17301 -13651 -19921 -30199 -31618 -21874 -8040 7581 17103 21235 21942 21453 19353 16827 13988 9222 3143 -2800 -3308 -329 4009 5776 8122 6958 7206 6353 2676 -673 -1827 1183 8690 13936 16372 9478 -3203 -12270 -15064 -7188 3119 9276 10195 7588 1874 -7205 -20420 -31117 -36226 -30174 -19341 -10329 -2934 -336 3763 9307 14968 19174 20200 18426 12347 2228 -8656 -18788 -20873 -15320 -6577 1345 9548 11090 6146 -2036 -10366 -12231 -6060 1393 4951 8391 10949 14760 19030 21497 18663 11958 2047 -7622 -12361 -11776 -6798 374 6564 7372 5910 2991 -2793 -8826 -14514 -19597 -18059 -13172 -8792 -6450 -6824 -5730 -2953 2439 5621 7966 9339 9525 7043 3984 663 16159 16298 12796 1691 -9660 -14634 -11040 -4762 -1544 -4095 -9337 -9383 -3110 2693 8512 10474 8593 8666 7881 7966 5776 2720 1670 4184 4740 4534 -832 -9656 -18077 -20497 -17563 -14312 -11301 -16724 -25154 -26364 -18202 -6770 6365 14441 17887 18533 18200 16434 14347 11939 7834 2685 -2415 -2839 -285 3473 5055 7090 6139 6348 5603 2378 -599 -1632 1061 7727 12481 14659 8554 -2903 -11091 -13685 -6573 2872 8509 9404 7008 1737 -6656 -18981 -28836 -33746 -28169 -18106 -9719 -2759 -320 3931 9846 15905 20369 21535 19684 13209 2395 -9282 -20213 -22554 -16712 -7202 1494 10640 12487 6927 -2287 -11617 -13642 -6791 1568 5609 9556 12586 17101 22256 25290 22161 14233 2449 -9141 -14770 -14197 -8231 456 7974 9004 7182 3628 -3410 -10850 -17829 -24105 -22400 -16636 -11228 -8303 -8888 -7495 -3925 3265 7590 10752 12690 12904 9502 5354 891 SS 20241126T091431.3Z 9096.385085 208 1 2.02 2 72.30 126.89 33.59 176.78 0.00 1 0.00 1 0 25 4.968e-02 1.024e-02 4.957e-02 8.595e-03 3.763971e-01 4.273752e-03 4.152680e-03 -6.000000e+00 2.774121e-02 223.61 -2.00 3.19 -2.00 318.04 0.00e+00 -4.991309e-04 7.556473e-04 1.829735e-04 -6.000000e+00 1.200086e-03 275.13 -2.00 20.00 -2.00 317.48 0.00e+00 3.247 0.000 302.00 328.00 3 5.6474e+00 1.1342e-02 3.0040e-02 -6.0000e+00 6.8516e-02 2.1863e-02 1.2844e-02 1.7438e-02 -6.0000e+00 7.4511e-02 1.7913e-02 8.6605e-03 8.7368e-03 -6.0000e+00 4.4290e-02 -1.1910e-02 4.6126e-03 2.5811e-03 -6.0000e+00 1.9303e-02 9.8319e-05 -3.5108e-04 2.3404e-04 2.6286e-05 -6.0000e+00 1.2853e-03 1.2410e-03 0.0000e+00 12 9 9 12 1 1 999.00 20.96 0.29 0.00124 -0.00140 1 12 1 5 0 1005.870 20.96 15.00 14.51 17.26 1.5 720.25 15920 -19732 10903 -20890 4881 -19393 807 -27340 5004 -7641 -2890 14824 -5190 7320 -9660 7604 -7904 5930 -2098 1214 -2833 2762 -7319 -1787 -2448 -534 -4030 -1110 -1691 -577 1899 2284 3371 -2394 -6118 -3785 751 1043 660 2425 1536 308 -436 4352 -1483 -1273 -1139 2061 2394 2279 -926 687 -2400 3466 135 1163 512 482 -662 -1779 731 1316 2766 1048 940 -306 -482 -161 773 191 2559 -986 1798 -392 -107 -2704 -2603 -843 -2866 -1154 -1150 -547 -2299 -877 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