File name: Pandora88s1_SanAntonioTX_20250405_L2Fit_fout2c2d20240901p1-8.txt File generation date: 20250504T102131.2Z 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_20250405_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: 20250405 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 20250405T132219.8Z 9226.557174 118 1 53.04 2 76.98 90.07 124.90 1.99 0.00 1 0.00 1 0 17 5.812e-01 3.353e-02 2.633e-01 7.955e-03 5.122140e-01 4.216858e-03 9.153181e-03 -6.000000e+00 3.326152e-01 228.54 -2.00 3.23 -2.00 320.31 0.00e+00 7.221125e-03 1.553505e-03 9.891917e-03 -6.000000e+00 1.798000e-02 286.32 -2.00 20.00 -2.00 319.62 0.00e+00 4.323 0.001 302.00 328.00 3 4.8354e+00 1.2815e-02 6.5055e-02 -6.0000e+00 8.2464e-01 2.4800e-01 1.5972e-02 6.3368e-02 -6.0000e+00 8.9613e-01 -2.6636e-01 1.3865e-02 2.7164e-02 -6.0000e+00 5.3042e-01 1.0429e-01 7.0651e-03 4.5383e-03 -6.0000e+00 2.3125e-01 3.2708e-05 -3.2754e-04 2.2091e-04 1.4292e-04 -6.0000e+00 1.5301e-02 1.6620e-02 0.0000e+00 12 8 8 10 0 0 99.94 24.33 0.89 0.01662 0.01416 17 2 1 5 0 3119.720 33.00 20.00 24.33 21.54 0.0 962.72 -71010 900000 117409 900000 900000 900000 900000 -130476 112633 -93692 900000 900000 -66026 -79267 27918 900000 95098 208721 128226 -13988 233406 147277 231100 8997 72406 25714 900000 225735 99598 134785 -3776 233880 33274 50576 -37423 -24915 48513 62057 -11791 26601 8908 34904 4351 -42573 -5413 -32994 6670 7247 7833 35347 24046 -3182 11319 130 6692 13015 703 15089 14258 6386 15923 13054 2026 4476 10116 8245 17922 9183 -4982 -1427 1469 -3232 -745 11024 2990 -8220 5050 -2837 2668 13460 -3317 -1120 1557 2303 4956 -900 -4629 -3463 -6024 1695 1943 -1276 -5893 -2066 -3049 5028 1261 -2962 -2309 -2858 -2902 -553 -2539 -4680 -974 -2994 1407 1241 -911 2148 1123 -3101 -468 2035 -2246 2478 -205 2632 1542 5109 -1261 699 2578 4137 3831 2545 -368 -1564 -2318 -2762 -1068 -543 -1828 75 -753 1593 1153 1131 410 -572 -1207 -1586 -230 -1900 900000 909 900000 900000 900000 900000 -6706 872 -3826 900000 900000 -2696 -4632 688 900000 1694 1616 1887 -888 1808 1825 1790 474 2075 1215 900000 1748 2083 2088 -275 1811 2190 3016 -4956 -2779 2855 3653 -1744 3193 1414 4487 799 -12826 -1132 -9301 1276 1392 1529 5393 4488 -860 2831 39 1975 3659 229 4218 3887 1854 4328 3993 777 1879 4207 3295 6246 3492 -2319 -743 826 -1990 -446 5567 1507 -4125 2026 -1202 1155 6171 -2080 -781 1159 1772 3972 -748 -4195 -3208 -5789 1463 1546 -1065 -4824 -1602 -2600 4120 1226 -3451 -2947 -3669 -3508 -597 -2511 -4689 -1034 -3426 1613 1521 -1224 3073 1792 -4991 -729 3226 -3474 3423 -289 3766 2382 8093 -1979 1134 4002 6093 5370 3486 -495 -2121 -3523 -4684 -1775 -953 -3371 141 -1532 3358 2500 2497 929 -1261 -2533 -3181 -435 SS 20250405T132755.0Z 9226.561053 121 1 14.94 2 75.76 90.75 124.86 3.44 0.00 1 0.00 1 0 17 2.834e-01 1.631e-02 1.850e-01 7.055e-03 4.810143e-01 3.557228e-03 5.677051e-03 -6.000000e+00 1.588036e-01 228.54 -2.00 3.23 -2.00 319.72 0.00e+00 6.347218e-03 1.080476e-03 2.938738e-03 -6.000000e+00 7.075355e-03 286.32 -2.00 20.00 -2.00 319.01 0.00e+00 3.977 0.001 302.00 328.00 3 4.0512e+00 1.0257e-02 4.5871e-02 -6.0000e+00 3.9519e-01 1.0042e-01 1.2217e-02 2.5343e-02 -6.0000e+00 4.2827e-01 -1.2219e-01 9.9039e-03 1.4914e-02 -6.0000e+00 2.5536e-01 4.6332e-02 5.2111e-03 6.1608e-03 -6.0000e+00 1.1031e-01 1.0781e-04 5.0696e-04 1.8625e-04 7.1482e-05 -6.0000e+00 7.0287e-03 1.0828e-02 0.0000e+00 12 9 9 12 33 1 99.87 24.34 -0.05 0.01083 0.01464 6 3 1 5 0 2132.980 33.00 19.99 24.34 21.69 0.0 963.07 -14501 160184 -40765 14666 46441 -92228 132877 -103858 53820 -83080 79990 14331 -10123 -45965 16095 -41983 -58520 44433 35650 -13417 -12992 76161 45590 -3435 11084 7192 54021 5203 12144 11856 -2454 43058 3830 3256 -974 -13474 7026 10362 2039 13708 3239 5738 5792 -16379 842 -13352 2282 -1324 546 10028 6577 -1545 4620 259 1474 4956 -6014 3647 3511 1340 6014 7317 1729 3951 4386 1496 -2013 682 1599 -1003 574 -8 -1859 2951 1180 -345 -529 -2258 -1230 2831 131 -2281 -1564 -1263 723 -1866 -559 -828 -603 -285 97 -807 -2365 -1366 -2639 1342 1570 218 808 -900 -1664 -35 -1356 -2122 -973 -1536 584 -81 -1031 529 1122 -101 700 273 -184 391 -2 207 494 1886 213 758 946 2069 1687 -74 -634 213 -815 -1050 656 -1260 86 -948 -691 788 176 130 851 -199 -332 -711 -359 -227 1102 -1020 202 447 -3115 914 -4547 592 -3830 715 266 -299 -2435 565 -3120 -5597 1651 1545 -997 -983 2306 1913 -251 724 510 2453 369 769 791 -221 2814 424 392 -113 -1706 802 1319 341 2443 713 1299 1383 -4569 220 -3741 607 -369 152 2622 1946 -498 1500 95 559 1848 -2569 1410 1320 509 2250 2957 829 2073 2398 793 -1059 349 860 -642 370 -6 -1284 2019 760 -201 -282 -1192 -691 1795 90 -1829 -1363 -1145 688 -1812 -564 -868 -638 -292 92 -768 -2137 -1198 -2542 1309 1741 261 1058 -1197 -2101 -43 -1518 -2381 -1187 -1995 721 -108 -1477 815 1766 -170 1155 431 -272 577 -3 316 752 3014 351 1207 1469 3280 2546 -109 -898 298 -1278 -1703 1135 -2206 154 -1777 -1386 1556 357 270 1789 -409 -687 -1411 -680 SS 20250405T133830.1Z 9226.568404 124 1 54.16 2 73.45 92.07 124.69 6.18 0.00 1 0.00 1 0 17 6.150e-02 6.353e-03 1.648e-02 1.515e-03 4.256069e-01 7.562663e-04 4.611160e-03 -6.000000e+00 3.444577e-02 228.54 -2.00 3.23 -2.00 318.85 0.00e+00 1.541378e-03 1.736402e-04 5.138551e-04 -6.000000e+00 1.535582e-03 286.32 -2.00 20.00 -2.00 318.08 0.00e+00 3.455 0.000 302.00 328.00 3 3.2664e+00 2.0906e-03 3.9297e-02 -6.0000e+00 8.5717e-02 8.7411e-03 2.4148e-03 2.0429e-02 -6.0000e+00 9.2907e-02 -1.6620e-02 1.7604e-03 1.0195e-02 -6.0000e+00 5.5399e-02 1.7441e-03 9.4086e-04 3.1506e-03 -6.0000e+00 2.3917e-02 4.2443e-04 -5.8195e-05 4.0103e-05 2.9826e-05 -6.0000e+00 1.5255e-03 1.4637e-02 0.0000e+00 10 0 0 10 0 0 99.98 24.35 0.43 0.01464 0.01420 102 11 1 5 0 530.950 33.00 20.00 24.35 22.08 0.0 965.16 -23683 -7548 -17314 5888 -22154 43940 -10895 -21050 -772 -21689 -5937 -5690 -15547 -9515 -5842 2631 -4063 3330 -572 -4374 4601 3723 2349 1715 1645 -2070 1412 1211 -1126 2309 339 6395 235 265 -5068 -6139 -778 -202 -1708 130 -456 919 157 -4051 -816 -2903 211 155 -573 -60 894 128 1278 264 784 1269 729 1163 659 -156 1137 1409 1753 2466 2193 398 321 -779 -245 70 633 232 277 1374 164 -659 -1259 -1782 -1265 -786 -1037 -668 -1811 -1176 -844 -385 134 131 571 616 780 503 -287 -508 -216 425 -96 525 587 -295 -306 -847 -1066 -821 -685 -893 -606 -439 -235 485 569 254 263 255 -94 -24 -144 271 362 516 -119 24 476 514 768 148 -105 160 138 -38 181 -384 -179 -344 -270 298 -95 673 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