File name: Pandora101s1_Izana_20231115_L2Fit_fout2c12d20230620p1-8.txt File generation date: 20231116T005812.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v12d20230620.txt Level 1 file used: Pandora101s1_Izana_20231115_L1_smca1c12d20230620p1-8.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: 20231115 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: OOB session based on clearance session 11 First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1333 305.2742 305.4151 305.5559 305.6968 305.8376 305.9784 306.1192 306.2600 306.4008 306.5416 306.6823 306.8231 306.9638 307.1045 307.2452 307.3859 307.5266 307.6673 307.8080 307.9486 308.0893 308.2299 308.3706 308.5112 308.6518 308.7924 308.9329 309.0735 309.2141 309.3546 309.4951 309.6357 309.7762 309.9167 310.0572 310.1976 310.3381 310.4786 310.6190 310.7594 310.8998 311.0403 311.1807 311.3210 311.4614 311.6018 311.7421 311.8825 312.0228 312.1631 312.3034 312.4437 312.5840 312.7243 312.8645 313.0048 313.1450 313.2852 313.4254 313.5656 313.7058 313.8460 313.9862 314.1263 314.2665 314.4066 314.5467 314.6869 314.8270 314.9670 315.1071 315.2472 315.3872 315.5273 315.6673 315.8073 315.9473 316.0873 316.2273 316.3673 316.5073 316.6472 316.7871 316.9271 317.0670 317.2069 317.3468 317.4867 317.6265 317.7664 317.9062 318.0461 318.1859 318.3257 318.4655 318.6053 318.7451 318.8848 319.0246 319.1643 319.3041 319.4438 319.5835 319.7232 319.8629 320.0025 320.1422 320.2819 320.4215 320.5611 320.7007 320.8403 320.9799 321.1195 321.2591 321.3986 321.5382 321.6777 321.8172 321.9568 322.0962 322.2357 322.3752 322.5147 322.6541 322.7936 322.9330 323.0724 323.2118 323.3512 323.4906 323.6300 323.7693 323.9087 324.0480 324.1873 324.3266 324.4659 324.6052 324.7445 324.8838 --------------------------------------------------------------------------------------- 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 20231115T075809.0Z 8719.332049 45 1 3.65 2 84.68 114.27 109.57 111.07 0.00 1 0.00 1 0 25 5.010e-01 3.645e-02 4.214e-01 3.065e-02 8.564603e-01 1.688036e-02 9.479440e-03 -6.000000e+00 2.877030e-01 223.95 -2.00 3.19 -2.00 321.53 0.00e+00 2.273942e-03 7.287224e-03 6.401802e-03 -6.000000e+00 1.309890e-02 275.94 -2.00 20.00 -2.00 321.07 0.00e+00 9.438 0.009 302.00 328.00 3 2.8964e+00 5.5011e-02 8.7569e-02 -6.0000e+00 7.1317e-01 1.0994e+00 6.8040e-02 5.6473e-02 -6.0000e+00 7.7663e-01 -1.3151e+00 5.6119e-02 2.5777e-02 -6.0000e+00 4.5822e-01 5.2631e-01 2.8245e-02 6.7582e-03 -6.0000e+00 1.9766e-01 8.7297e-06 -3.2407e-04 7.8622e-04 1.4131e-04 -6.0000e+00 1.3484e-02 -2.3866e-02 0.0000e+00 12 9 9 12 5 1 999.00 20.96 0.33 -0.02387 -0.02630 2 10 1 5 0 1214.040 20.96 15.01 14.41 17.59 0.0 946.14 35871 -99312 275407 -84443 -64858 900000 -24441 -129992 900000 -106630 47630 900000 -87890 29081 14934 2568 45296 900000 -31360 157352 -17151 162355 94350 94618 -66506 4808 -12782 175526 -83597 -10255 49082 -7667 31447 -53470 -12401 8414 49469 -20486 128205 5501 37363 29203 79636 88400 11559 61545 17951 59949 23240 39421 29134 93315 -6831 48056 18026 60798 693 15599 12427 25231 1589 6555 34188 6077 33006 9417 25866 5024 11649 -4196 36033 9258 10199 -7015 17803 2235 -17009 -5176 -12568 8829 -6372 7667 -4214 4201 -3114 8152 -6170 -480 934 8068 -5998 -1342 -7630 -2692 -3405 -8662 2509 -2728 374 -698 -4238 -6823 2422 -8389 -122 -6101 -1839 -1732 -626 -968 -357 3029 -73 4181 -1090 810 -3032 1673 -1544 3129 73 3724 -770 3693 -354 1806 3362 618 3238 888 1472 -2784 596 -275 1216 -1110 1156 -1056 -666 -378 478 -2064 1071 -6139 8225 -3783 -2079 900000 -730 -7857 900000 -5360 1423 900000 -5314 869 491 107 1353 900000 -2010 4700 -896 4849 2818 2826 -5717 210 -626 5242 -7186 -495 1620 -498 1565 -5843 -864 464 2022 -1881 3829 526 2861 2505 4256 4238 1142 3773 1677 3911 2242 3502 3190 6087 -1244 5520 2827 6518 131 2497 1922 3304 273 1165 5420 1389 6092 2102 5071 1260 3105 -1446 9067 2988 3168 -2347 4199 551 -4813 -1403 -4335 2967 -2855 3396 -2223 2203 -1816 4572 -4045 -300 561 4367 -3482 -709 -4313 -1594 -2327 -7225 2194 -2814 400 -739 -4225 -6274 1923 -7481 -108 -6018 -1852 -1863 -758 -1327 -534 4636 -116 6176 -1623 1159 -4637 2577 -2530 5037 116 5522 -1152 5132 -497 2439 4448 911 5344 1682 2996 -6191 1339 -656 3052 -2892 2976 -2791 -1744 -924 1108 -4544 SS 20231115T080750.8Z 8719.338782 48 1 47.98 2 82.74 115.52 107.67 111.95 0.00 1 0.00 1 0 25 4.721e-01 1.369e-02 1.929e-01 6.451e-03 7.423193e-01 3.500557e-03 7.766046e-03 -6.000000e+00 2.672170e-01 223.95 -2.00 3.19 -2.00 321.29 0.00e+00 4.897788e-03 1.597949e-03 1.744793e-03 -6.000000e+00 1.199593e-02 275.94 -2.00 20.00 -2.00 320.84 0.00e+00 7.335 0.004 302.00 328.00 3 4.1597e+00 1.1444e-02 6.5847e-02 -6.0000e+00 6.5989e-01 3.6696e-01 1.5691e-02 3.6765e-02 -6.0000e+00 7.1702e-01 -3.5322e-01 1.6439e-02 2.1388e-02 -6.0000e+00 4.2684e-01 1.3622e-01 7.9646e-03 8.5588e-03 -6.0000e+00 1.8707e-01 1.3730e-05 -8.0780e-04 1.7254e-04 1.0738e-04 -6.0000e+00 1.2854e-02 -1.6790e-02 0.0000e+00 12 9 8 11 4 0 99.97 20.96 0.17 -0.01679 -0.02286 119 30 1 5 0 402.270 20.96 14.99 14.41 17.88 0.0 950.28 -201171 900000 -180028 900000 -227429 -6531 -167164 -123211 -149198 -140073 -143109 -80946 -107620 -97060 -52748 -79626 2985 -50481 40312 -52411 11230 -71970 -28772 -24078 -42898 -13908 -55349 26096 -41680 36609 -33201 17537 -24104 35530 -30763 5314 -11978 -1735 9824 9194 12830 4566 13251 12302 15565 -7425 9505 2789 12959 1819 18091 1564 15625 6918 11283 7495 6265 -284 6216 3823 -1723 10695 6854 9452 1277 9525 2716 6752 2371 5238 2758 4845 2528 2143 -999 -3516 1312 -3715 1270 -3364 -54 -2184 -582 -3722 43 -1456 -757 -368 -284 348 -111 -490 -2821 -1575 -2525 -130 -1125 812 -248 -98 -1021 -578 -588 -1866 -2774 -1135 -1144 -1091 661 45 1270 591 854 -337 1113 -1297 -170 -574 204 -42 476 1185 121 990 604 414 760 1211 428 965 -237 144 -702 365 -283 -178 226 -166 93 -121 -59 -923 -3646 900000 -3096 900000 -5384 -41 -2421 -1332 -2217 -2002 -2263 -859 -1907 -2034 -894 -2094 40 -1231 450 -1438 168 -2386 -652 -582 -1291 -333 -1930 418 -1271 624 -1322 524 -1172 1033 -1553 195 -591 -94 558 612 909 374 1037 987 1229 -736 847 280 1249 208 1986 226 2153 1121 1836 1313 1123 -53 1047 654 -330 2044 1525 2290 346 2327 715 1817 761 1811 1050 1836 942 759 -327 -1063 376 -1165 445 -1442 -26 -1224 -347 -2357 28 -1015 -546 -268 -202 240 -71 -299 -1746 -1043 -1905 -112 -1112 895 -293 -113 -1077 -551 -524 -1747 -2814 -1191 -1240 -1280 856 65 1994 951 1393 -533 1645 -1913 -254 -908 338 -70 769 1806 180 1445 853 562 1015 1765 708 1750 -475 296 -1542 849 -688 -449 573 -426 234 -288 -132 -2008 SS 20231115T081843.0Z 8719.346332 51 1 48.90 2 80.60 116.97 105.57 112.96 0.00 1 0.00 1 0 25 2.957e-01 6.954e-03 6.629e-02 2.076e-03 6.210325e-01 1.091184e-03 6.563430e-03 -6.000000e+00 1.674182e-01 223.95 -2.00 3.19 -2.00 320.66 0.00e+00 3.257895e-03 4.263113e-04 1.333164e-03 -6.000000e+00 7.281436e-03 275.94 -2.00 20.00 -2.00 320.18 0.00e+00 5.842 0.002 302.00 328.00 3 3.6730e+00 3.3051e-03 5.2922e-02 -6.0000e+00 4.1352e-01 9.0190e-02 4.3376e-03 2.9991e-02 -6.0000e+00 4.4925e-01 -6.1057e-02 4.4495e-03 1.7408e-02 -6.0000e+00 2.6713e-01 1.8259e-02 2.2319e-03 6.9502e-03 -6.0000e+00 1.1605e-01 7.9431e-05 -3.7515e-06 5.6966e-05 7.5036e-05 -6.0000e+00 7.9307e-03 -1.9294e-02 0.0000e+00 11 9 0 11 12 0 99.96 20.96 0.22 -0.01929 -0.01932 310 79 1 5 0 154.230 20.96 14.99 14.41 18.33 0.0 952.74 -98857 -94442 -90398 -78194 -96587 -133988 -79512 -106040 -39988 -106939 -60111 -95457 -51742 -62714 -40011 -28596 -20832 -10145 -24802 -4837 -17859 -6318 -27729 -8635 -29413 -9200 -28389 -12659 -24800 -2662 -8693 -2367 -6814 -4661 -10611 -6710 -1296 -4182 4093 -509 3068 333 1836 1785 4268 -1053 2605 243 2560 2346 2739 3240 3374 4721 2599 3806 354 1138 421 2231 1130 2864 2882 2283 1376 1608 1688 759 1809 271 1529 45 714 -291 380 -2135 -1157 -1628 -874 -1455 -876 -1568 -2035 -1139 -1162 86 -409 506 1 611 -328 -279 -1395 -107 -780 211 646 408 98 -133 -727 -760 -234 -1306 -885 -828 -521 -241 799 602 872 648 723 53 123 -22 -180 -1 -233 -281 -98 569 44 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