File name: Pandora101s1_Izana_20231221_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T135146.1Z 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_20231221_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: 20231221 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 20231221T083407.2Z 8755.357028 101 1 3.48 2 83.04 121.39 144.70 5.99 0.00 1 0.00 1 0 25 5.027e-01 2.953e-02 3.645e-01 2.249e-02 8.040894e-01 1.249994e-02 8.664376e-03 -6.000000e+00 2.870895e-01 223.10 -2.00 3.19 -2.00 321.28 0.00e+00 3.554720e-03 5.561705e-03 3.831724e-03 -6.000000e+00 1.482609e-02 273.67 -2.00 20.00 -2.00 320.86 0.00e+00 7.599 0.004 302.00 328.00 3 4.1257e+00 4.0229e-02 7.0711e-02 -6.0000e+00 7.1115e-01 5.9200e-01 5.3466e-02 4.3702e-02 -6.0000e+00 7.7743e-01 -7.1192e-01 5.3664e-02 2.2936e-02 -6.0000e+00 4.5721e-01 2.9898e-01 2.6255e-02 7.1174e-03 -6.0000e+00 1.9983e-01 1.0792e-05 -2.1553e-03 5.9055e-04 1.1856e-04 -6.0000e+00 1.3788e-02 2.0299e-03 0.0000e+00 12 9 9 12 1 1 999.00 21.27 0.36 0.00203 -0.01417 2 10 1 5 0 1156.370 21.27 14.99 14.68 9.18 0.3 877.02 -188092 900000 -143021 900000 -207599 900000 -198180 900000 -138941 900000 -174025 900000 -88211 -48466 -33689 900000 103947 -75106 900000 -67319 122274 -36971 900000 -34395 900000 -2522 900000 -65704 900000 -31937 10219 113875 -20720 69016 -21077 900000 -14534 58722 12080 103134 1670 85136 7516 54383 -12068 -2278 18815 33006 49264 7967 82452 20806 63517 -7163 42300 2897 35687 6869 14431 5373 1557 9796 17461 7177 7000 31763 2434 22614 1132 13960 8268 15482 -6365 7280 -5748 -1702 -5981 9329 -4489 -1431 1399 -4213 65 -3342 4619 -3871 1078 -3882 3021 -6335 3146 -475 -868 -5428 -6158 -3721 -3298 2338 -4641 4023 -5311 1441 -1268 -705 -4371 45 -2797 674 -1185 1554 367 21 2851 -1464 -418 -2154 1257 -1980 2721 813 1639 1157 1032 2306 1740 677 -457 -119 17 2443 613 1171 -1754 1442 -1358 397 -110 1045 -1808 1018 -572 -2238 -6171 900000 -3406 900000 -7305 900000 -6743 900000 -3177 900000 -5921 900000 -2017 -1060 -737 900000 2274 -3322 900000 -2912 2674 -1166 900000 -1190 900000 -68 900000 -3005 900000 -1218 317 2491 -1174 1689 -1147 900000 -821 1957 745 3115 145 3547 669 3098 -1308 -228 1562 2552 3433 895 5075 2586 5751 -1354 5215 535 4896 1188 2245 892 275 1795 3429 1762 1741 6160 639 5155 357 4434 2984 5271 -2521 2350 -1875 -488 -1733 2485 -1588 -593 648 -2303 37 -2070 2808 -2647 731 -2797 1990 -4332 1857 -275 -503 -3587 -4692 -3202 -3238 2440 -5451 4310 -5683 1314 -1095 -627 -4258 44 -2988 741 -1472 2113 553 32 4412 -2279 -611 -3178 1839 -3094 4278 1293 2529 1727 1487 3233 2369 894 -600 -172 27 4316 1168 2321 -3731 3178 -3180 945 -266 2510 -4370 2280 -1220 -4572 SS 20231221T085526.6Z 8755.371835 109 1 5.73 2 79.09 124.32 143.81 14.50 0.00 1 0.00 1 0 25 2.586e-01 1.040e-02 1.505e-01 7.544e-03 5.957343e-01 3.833759e-03 6.334375e-03 -6.000000e+00 1.440889e-01 223.10 -2.00 3.19 -2.00 320.02 0.00e+00 2.230748e-03 1.231484e-03 3.053716e-04 -6.000000e+00 6.209429e-03 273.67 -2.00 20.00 -2.00 319.55 0.00e+00 5.105 0.001 302.00 328.00 3 5.0612e+00 1.0941e-02 4.7355e-02 -6.0000e+00 3.5564e-01 1.2275e-01 1.3403e-02 2.7959e-02 -6.0000e+00 3.8705e-01 -9.5532e-02 1.2635e-02 1.4635e-02 -6.0000e+00 2.2997e-01 3.3432e-02 6.6096e-03 5.2105e-03 -6.0000e+00 1.0017e-01 3.4208e-05 -8.2653e-04 1.9859e-04 5.0265e-05 -6.0000e+00 6.6922e-03 4.0475e-03 0.0000e+00 12 9 9 12 9 1 99.78 21.27 0.25 0.00405 -0.00216 4 11 1 5 0 1145.480 21.27 15.00 14.68 10.10 0.2 884.27 -118559 -81068 -110199 -75327 -106059 -75463 -43852 -44688 -62613 -106406 -61388 -53962 2630 -37180 -13154 -40990 8042 -16574 -1297 -30887 -23982 29511 -21623 11575 -22879 4515 -19988 -9069 -12340 18173 -12925 5008 -4597 1405 -16895 -4042 -4569 -4749 7675 -3407 1103 1922 2100 6333 2960 -845 5303 -4439 5930 -82 2818 -1793 3371 3966 4264 3593 937 1748 2728 2794 2457 3361 2728 4057 533 2111 -495 -404 1575 2257 322 -637 1519 1074 110 -1922 -692 -2820 -263 -2275 -922 -2755 -1817 -1769 -854 -533 -206 134 -190 164 359 923 -2214 -243 -1554 330 443 828 131 70 -548 23 548 -1087 -922 -948 -1134 -528 795 608 589 -126 886 -244 140 -769 -973 -7 285 -273 329 1067 27 551 509 316 217 807 67 1075 -81 143 -216 50 -438 -277 664 348 218 -694 -369 -882 -2507 -1366 -2483 -1144 -2013 -1074 -527 -625 -1129 -3131 -1209 -1165 43 -1103 -378 -1743 239 -688 -49 -1598 -1163 868 -1134 478 -1388 224 -1213 -489 -688 832 -939 358 -410 119 -1620 -349 -454 -576 1009 -566 192 352 398 1165 571 -172 1037 -988 1240 -19 712 -525 1020 1280 1393 1226 333 604 929 947 859 1307 1179 1902 261 970 -231 -197 836 1358 206 -420 947 642 60 -982 -333 -1449 -148 -1504 -676 -2247 -1571 -1574 -786 -518 -209 137 -191 156 322 786 -1890 -216 -1519 356 524 1073 176 93 -679 26 593 -1232 -1123 -1182 -1463 -709 1140 934 963 -212 1443 -386 212 -1160 -1476 -11 468 -452 538 1694 42 833 740 448 307 1202 107 1854 -146 269 -417 101 -912 -586 1412 750 464 -1434 -739 -1704 SS 20231221T091813.2Z 8755.387653 121 1 12.49 2 75.04 127.70 142.17 23.05 0.00 1 0.00 1 0 25 5.611e-02 5.049e-03 8.948e-03 7.604e-04 4.613437e-01 3.800283e-04 4.999312e-03 -6.000000e+00 3.126786e-02 223.10 -2.00 3.19 -2.00 319.14 0.00e+00 9.093607e-04 9.326886e-05 2.325702e-04 -6.000000e+00 1.347258e-03 273.67 -2.00 20.00 -2.00 318.63 0.00e+00 3.803 0.001 302.00 328.00 3 2.5900e+00 1.0397e-03 3.5707e-02 -6.0000e+00 7.7177e-02 1.7994e-02 1.2108e-03 2.1364e-02 -6.0000e+00 8.3980e-02 -4.7883e-03 9.8197e-04 1.0963e-02 -6.0000e+00 4.9895e-02 -4.2200e-03 5.2929e-04 3.4472e-03 -6.0000e+00 2.1745e-02 1.2561e-03 -2.6920e-04 2.0614e-05 3.3630e-05 -6.0000e+00 1.4513e-03 9.7465e-04 0.0000e+00 12 1 1 12 1 1 99.99 21.27 0.23 0.00097 -0.00105 449 469 1 5 0 25.950 21.27 15.00 14.69 10.71 0.2 888.86 -18992 -14908 -16784 -17984 -21872 -22119 -21460 -14320 -19057 -16794 -18076 -12888 -10590 -5047 -4126 -1993 -404 578 -132 -916 -512 -544 -529 -1192 -1599 -1854 -3428 -4469 -3655 -2234 -664 833 617 -2434 -2879 -3060 -1369 249 -30 257 -467 -382 -337 -48 -71 60 -10 -415 -329 752 1133 1343 1518 1377 908 924 476 263 118 545 963 1713 2010 1190 538 96 -123 401 962 573 455 -45 268 -175 -369 -773 -1280 -1184 -901 -1115 -1194 -1603 -1808 -1237 -819 -153 122 414 528 525 538 224 203 313 66 160 615 423 -36 -275 -539 -471 -54 -606 -949 -831 -598 -208 331 424 506 328 309 77 259 271 43 146 -32 -376 -265 166 98 339 149 54 620 640 174 176 -164 -84 -103 -210 -155 -176 268 95 -61 -143 -199 -124 -458 -380 -444 -443 -512 -528 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