File name: Pandora88s1_SanAntonioTX_20250418_L2Fit_fout2c2d20240901p1-8.txt File generation date: 20250504T102634.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 88 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora88_OF_v2d20240227.txt Instrument calibration file used: Pandora88s1_CF_v2d20240901.txt Level 1 file used: Pandora88s1_SanAntonioTX_20250418_L1_smca1c2d20240901p1-8.txt Full location name: University of Texas San Antonio Downtown Campus Short location name: SanAntonioTX Country of location: USA Location latitude [deg]: 29.4229 Location longitude [deg]: -98.5025 Location altitude [m]: 230 Local noon date: 20250418 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 1 First and last pixel inside fitting window: 198 340 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1841 305.3247 305.4653 305.6059 305.7464 305.8870 306.0275 306.1680 306.3086 306.4491 306.5895 306.7300 306.8705 307.0110 307.1514 307.2918 307.4323 307.5727 307.7131 307.8535 307.9939 308.1342 308.2746 308.4150 308.5553 308.6956 308.8359 308.9762 309.1165 309.2568 309.3971 309.5373 309.6776 309.8178 309.9581 310.0983 310.2385 310.3787 310.5189 310.6590 310.7992 310.9393 311.0795 311.2196 311.3597 311.4998 311.6399 311.7800 311.9201 312.0601 312.2002 312.3402 312.4803 312.6203 312.7603 312.9003 313.0403 313.1802 313.3202 313.4601 313.6001 313.7400 313.8799 314.0198 314.1597 314.2996 314.4395 314.5793 314.7192 314.8590 314.9988 315.1386 315.2785 315.4182 315.5580 315.6978 315.8376 315.9773 316.1170 316.2568 316.3965 316.5362 316.6759 316.8155 316.9552 317.0949 317.2345 317.3741 317.5138 317.6534 317.7930 317.9326 318.0721 318.2117 318.3513 318.4908 318.6303 318.7699 318.9094 319.0489 319.1884 319.3278 319.4673 319.6067 319.7462 319.8856 320.0250 320.1644 320.3038 320.4432 320.5826 320.7220 320.8613 321.0006 321.1400 321.2793 321.4186 321.5579 321.6972 321.8364 321.9757 322.1149 322.2542 322.3934 322.5326 322.6718 322.8110 322.9502 323.0893 323.2285 323.3676 323.5068 323.6459 323.7850 323.9241 324.0632 324.2023 324.3413 324.4804 324.6194 324.7585 324.8975 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250418T130416.1Z 9239.544631 235 1 53.49 2 77.93 84.03 67.91 213.22 0.00 1 0.00 1 0 17 5.044e-01 1.554e-02 1.771e-01 4.533e-03 5.434877e-01 2.364564e-03 6.984798e-03 -6.000000e+00 2.874109e-01 229.44 -2.00 3.23 -2.00 320.44 0.00e+00 5.743626e-03 9.147942e-04 5.307744e-03 -6.000000e+00 1.415003e-02 287.19 -2.00 20.00 -2.00 319.76 0.00e+00 4.639 0.001 302.00 328.00 3 3.8168e+00 7.3132e-03 5.6651e-02 -6.0000e+00 7.1625e-01 5.7835e-02 9.2448e-03 3.8898e-02 -6.0000e+00 7.7650e-01 -9.2037e-02 8.5845e-03 1.8670e-02 -6.0000e+00 4.5956e-01 2.7821e-02 4.3638e-03 4.7489e-03 -6.0000e+00 1.9811e-01 7.0539e-05 -4.0248e-04 1.2245e-04 9.0948e-05 -6.0000e+00 1.2776e-02 1.3820e-02 0.0000e+00 12 9 8 11 32 0 99.92 24.87 0.54 0.01382 0.01080 25 3 1 5 0 2139.140 33.25 20.00 24.87 26.75 0.0 984.48 -128480 -23599 -66096 -92518 -40580 900000 900000 -129107 -24267 -153818 900000 900000 -37228 -64988 -21586 392398 13672 54384 23543 -48213 129757 233017 -8740 -3372 37394 31136 108402 38866 55495 8916 -11865 46929 3909 9593 -26978 -26038 11274 31944 -790 18753 8014 8382 -3696 8008 -6439 -27173 -9277 -1433 -21 9354 3523 1098 8533 3659 -1815 2918 1208 2194 7314 -5955 4770 5681 441 7434 5679 1616 12972 -869 350 -790 1383 -4154 559 4331 1721 -2864 -356 -3925 1271 4480 -1132 -211 501 53 914 -1142 -3627 -550 -1129 1220 473 -220 -1416 -522 -2176 1540 231 -165 212 -1397 -1611 -559 -2416 -2129 -261 -1798 -257 -454 -202 1255 780 -97 112 1605 -219 -33 -256 666 1385 726 -489 1468 1048 1108 1184 429 -173 -76 -1249 -1042 -181 -487 -833 -427 -467 621 122 786 674 -655 -535 -315 46 -2270 -171 -796 -1412 -326 900000 900000 -2903 -214 -5374 900000 900000 -625 -1837 -496 1733 296 865 551 -2449 1146 1029 -313 -124 958 894 1484 1030 1201 327 -639 1638 243 619 -2348 -2162 717 1919 -80 1897 1016 1126 -594 1185 -1115 -5966 -1733 -253 -4 1595 703 251 1956 958 -531 836 364 655 2016 -1849 1372 1777 164 2923 2408 680 4716 -366 156 -377 723 -2411 310 2202 830 -1290 -157 -1767 589 2168 -674 -143 371 41 755 -952 -3266 -498 -1042 1070 423 -183 -1124 -406 -1881 1353 236 -195 256 -1719 -2031 -639 -2523 -2190 -289 -2146 -316 -599 -264 1785 1238 -153 176 2573 -335 -48 -367 986 2173 1220 -783 2398 1676 1710 1736 613 -238 -104 -1932 -1798 -315 -904 -1617 -862 -946 1324 268 1752 1534 -1459 -1127 -631 95 SS 20250418T130847.8Z 9239.547775 238 1 10.50 2 76.95 84.56 68.44 214.09 0.00 1 0.00 1 0 17 4.928e-01 2.484e-02 2.782e-01 1.380e-02 5.041014e-01 7.068646e-03 6.075098e-03 -6.000000e+00 2.773486e-01 229.44 -2.00 3.23 -2.00 320.26 0.00e+00 6.662991e-03 2.474199e-03 3.433344e-03 -6.000000e+00 1.264324e-02 287.19 -2.00 20.00 -2.00 319.52 0.00e+00 4.314 0.001 302.00 328.00 3 4.3408e+00 2.1305e-02 5.0361e-02 -6.0000e+00 6.9061e-01 1.5636e-01 2.6013e-02 3.0060e-02 -6.0000e+00 7.4980e-01 -2.5223e-01 2.1590e-02 1.4906e-02 -6.0000e+00 4.4585e-01 1.1023e-01 1.1126e-02 4.1405e-03 -6.0000e+00 1.9135e-01 5.7766e-05 -6.6119e-03 3.7450e-04 6.3854e-05 -6.0000e+00 1.2305e-02 5.8044e-02 0.0000e+00 12 9 9 12 9 1 99.99 24.88 0.61 0.05804 0.00836 3 2 1 5 0 2624.470 33.25 20.00 24.88 26.87 0.0 984.97 -97821 900000 -67141 93098 -97065 900000 238562 -120050 -84747 -60809 -23794 71269 -45810 -33630 25919 278022 161272 2701 150294 -50601 26330 50945 24293 -24689 69068 33487 193520 19836 84329 22049 25126 59891 36626 44716 -31185 -21891 13175 61394 -8253 21122 16919 -4548 2601 -22802 -4827 -26266 1554 16638 3405 20899 14293 -2550 13236 7757 6062 2436 1023 9571 10729 783 9396 902 -2940 81 5290 4959 18358 98 -261 2157 1846 -3450 553 1008 -217 -4123 4772 856 4130 2469 -1689 -784 -2798 1382 -1120 -2074 1193 -3193 -2981 917 15 -2332 -2959 2678 -2216 -275 -280 -1160 -694 -808 -3401 1854 -1064 -2414 -538 -2407 -1490 496 1311 2384 -162 -713 914 2437 -667 -1653 -1697 908 266 2622 23 2418 1797 3414 153 -525 -1189 1707 -544 -2475 -599 186 -1208 -1153 -540 1559 861 698 1637 537 -2580 -1166 -384 -3469 900000 -2135 1252 -3442 900000 3209 -5726 -3109 -1859 -495 959 -1569 -1402 732 3740 2169 134 2022 -4765 1169 1713 1078 -1893 2137 1532 2603 1014 2155 1097 1420 2739 2414 2948 -4069 -2474 1152 3799 -1232 2813 2617 -918 514 -5982 -1065 -7349 332 3089 737 3908 3115 -727 3454 2306 1925 816 356 3051 3276 260 2945 336 -1277 35 2505 2228 6915 44 -126 1066 1023 -2114 326 563 -113 -2202 2125 386 1933 1385 -1041 -545 -2183 1080 -961 -1936 1135 -3018 -2851 896 13 -2014 -2410 2020 -1905 -266 -284 -1361 -898 -1052 -4289 2035 -1082 -2457 -591 -2857 -1836 640 1799 3550 -252 -1182 1486 3735 -987 -2504 -2556 1387 404 4141 38 3776 2757 5388 236 -790 -1717 2376 -859 -4090 -1057 346 -2366 -2177 -1087 3265 1863 1541 3653 1171 -5502 -2337 -784 SS 20250418T131346.3Z 9239.551230 241 1 54.11 2 75.87 85.15 69.04 215.03 0.00 1 0.00 1 0 17 2.838e-01 8.197e-03 9.848e-02 2.267e-03 4.801080e-01 1.145955e-03 5.253442e-03 -6.000000e+00 1.595162e-01 229.44 -2.00 3.23 -2.00 319.66 0.00e+00 2.248469e-03 3.452036e-04 1.373323e-03 -6.000000e+00 7.112596e-03 287.19 -2.00 20.00 -2.00 318.92 0.00e+00 4.006 0.001 302.00 328.00 3 3.4111e+00 3.3066e-03 4.5548e-02 -6.0000e+00 3.9769e-01 -2.6901e-02 3.9722e-03 2.3992e-02 -6.0000e+00 4.3068e-01 -1.1936e-02 3.3030e-03 1.2242e-02 -6.0000e+00 2.5675e-01 -5.9710e-04 1.7347e-03 3.7695e-03 -6.0000e+00 1.1074e-01 2.1064e-04 -2.3475e-05 6.0278e-05 4.1458e-05 -6.0000e+00 7.0412e-03 1.3868e-02 0.0000e+00 11 8 0 10 0 0 99.53 24.88 0.39 0.01387 0.01369 52 6 1 5 0 1040.540 33.25 20.00 24.88 27.06 0.0 985.96 -42080 -4964 -54862 4401 -29048 281427 -24983 -63989 -995 -72801 88331 -2915 -38268 -37924 -6345 44690 -4557 7544 4097 -23322 5481 17414 -919 681 -696 -698 13922 -2342 4461 -2487 3770 10523 1746 4890 -10540 -15003 -5068 3236 -349 3028 856 -579 -1658 2174 -2253 -7803 -1302 531 194 398 459 -193 3629 769 -36 1649 -114 1393 2381 -1591 1087 1029 939 3395 2724 1570 3382 159 -730 -51 387 -645 192 1957 496 -877 -701 -2263 -576 103 -1932 -732 -1569 -1188 -437 -631 160 -36 676 940 464 -51 -442 -684 -848 25 447 701 192 -511 -368 -814 -1516 -921 -289 -1171 -886 -235 -374 836 797 351 457 468 -349 -127 -274 76 835 348 -21 88 752 588 705 240 -370 342 -128 -379 -11 -553 -407 -483 -230 439 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