File name: Pandora85s1_NewOrleansLA-XULA_20251010_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T093323.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v5d20250716.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20251010_L1_smca1c5d20250716p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20251010 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0150 305.1556 305.2961 305.4367 305.5772 305.7178 305.8583 305.9988 306.1393 306.2798 306.4203 306.5608 306.7012 306.8417 306.9821 307.1226 307.2630 307.4034 307.5438 307.6842 307.8245 307.9649 308.1052 308.2456 308.3859 308.5262 308.6665 308.8068 308.9471 309.0874 309.2276 309.3679 309.5081 309.6484 309.7886 309.9288 310.0690 310.2091 310.3493 310.4895 310.6296 310.7698 310.9099 311.0500 311.1901 311.3302 311.4703 311.6104 311.7504 311.8905 312.0305 312.1705 312.3105 312.4505 312.5905 312.7305 312.8705 313.0104 313.1504 313.2903 313.4302 313.5702 313.7101 313.8499 313.9898 314.1297 314.2695 314.4094 314.5492 314.6891 314.8289 314.9687 315.1085 315.2482 315.3880 315.5278 315.6675 315.8072 315.9469 316.0867 316.2264 316.3660 316.5057 316.6454 316.7850 316.9247 317.0643 317.2039 317.3435 317.4831 317.6227 317.7623 317.9019 318.0414 318.1809 318.3205 318.4600 318.5995 318.7390 318.8785 319.0179 319.1574 319.2969 319.4363 319.5757 319.7151 319.8545 319.9939 320.1333 320.2727 320.4120 320.5514 320.6907 320.8300 320.9694 321.1087 321.2479 321.3872 321.5265 321.6657 321.8050 321.9442 322.0834 322.2227 322.3619 322.5010 322.6402 322.7794 322.9185 323.0577 323.1968 323.3359 323.4750 323.6141 323.7532 323.8923 324.0313 324.1704 324.3094 324.4484 324.5875 324.7265 324.8655 --------------------------------------------------------------------------------------- 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 20251010T124120.1Z 9414.528705 250 1 54.40 2 81.90 102.79 51.60 280.55 0.00 1 0.00 1 0 25 5.067e-01 2.510e-02 3.457e-01 1.220e-02 6.668599e-01 6.982847e-03 1.171555e-02 -6.000000e+00 2.962059e-01 227.23 -2.00 3.24 -2.00 321.85 0.00e+00 1.697830e-02 4.048358e-03 2.061495e-02 -6.000000e+00 1.398624e-02 291.66 -2.00 20.00 -2.00 321.28 0.00e+00 6.635 0.003 302.00 328.00 3 1.8072e+00 2.7798e-02 1.2941e-01 -6.0000e+00 7.3541e-01 5.1207e-01 3.7307e-02 1.3721e-01 -6.0000e+00 7.9711e-01 -7.2851e-01 3.1727e-02 4.5147e-02 -6.0000e+00 4.7641e-01 2.8779e-01 1.4870e-02 5.5684e-03 -6.0000e+00 2.0769e-01 6.0050e-05 -8.2950e-04 3.7033e-04 3.0485e-04 -6.0000e+00 1.4287e-02 1.7437e-02 0.0000e+00 12 9 8 11 4 0 96.94 31.01 0.77 0.01744 0.01120 39 4 1 5 0 1394.790 39.25 20.00 31.01 26.25 4.2 1005.48 900000 900000 -118403 -60572 -65350 -210594 -52032 -132481 -51273 900000 -181955 -32674 -100886 -98633 900000 -63720 -13516 900000 -64280 -16926 -13344 69632 296493 -22077 -10110 29651 53525 -26797 50443 -41552 -12372 -16243 212673 -23161 61587 45773 20782 18297 66032 25631 6244 52980 45160 -6884 56963 5922 15134 16859 -23653 46929 31570 14046 49833 53886 24157 859 27291 19963 11061 13133 27335 11330 6508 9524 16350 18033 -211 11551 22699 21398 16499 12354 12403 -75 5135 3524 -3476 -11915 -8092 -11430 1687 5636 932 -1184 -1254 2221 -700 809 3543 6023 -3236 -3539 -6887 -1003 -6353 -436 -3292 -1728 -1113 -1448 -1475 -6679 -2931 -5134 -5878 -6597 -723 596 -1293 179 1771 486 1381 -431 -1341 -326 1946 -608 1063 3641 1700 2156 1349 2840 2647 -131 -1449 2056 -1708 456 -50 182 -118 -571 -1659 243 -388 1357 898 46 -581 -1465 -328 900000 900000 -2815 -780 -777 -9597 -619 -2863 -610 900000 -6489 -388 -2181 -2771 900000 -1997 -292 900000 -2709 -457 -346 828 3525 -573 -229 449 636 -695 600 -1347 -361 -597 2528 -1151 1265 1039 629 633 1641 1108 364 2061 2001 -536 2401 429 1030 1166 -2556 2637 2252 1321 3554 3960 2506 114 2802 2397 1407 1608 2989 1589 1091 1766 3071 3323 -46 2252 4209 4553 4119 3392 3406 -22 1325 830 -806 -2974 -2126 -3682 566 2097 406 -561 -632 1156 -396 469 2026 3301 -1835 -1876 -3594 -495 -3618 -272 -2477 -1494 -1077 -1459 -1432 -6280 -2393 -4107 -5003 -6062 -663 580 -1404 215 2350 712 2062 -645 -1938 -445 2575 -858 1568 5541 2679 3299 2009 4044 3632 -179 -1940 2677 -2548 759 -93 369 -254 -1308 -4107 629 -1048 3676 2476 124 -1507 -3619 -764 SS 20251010T125631.7Z 9414.539256 255 1 54.00 2 78.70 104.82 54.71 281.94 0.00 1 0.00 1 0 25 2.577e-01 9.885e-03 7.783e-02 2.053e-03 5.377082e-01 1.102446e-03 6.791832e-03 -6.000000e+00 1.494551e-01 227.23 -2.00 3.24 -2.00 320.85 0.00e+00 1.960048e-03 4.932956e-04 6.221371e-03 -6.000000e+00 6.836077e-03 291.66 -2.00 20.00 -2.00 320.15 0.00e+00 4.927 0.001 302.00 328.00 3 1.2448e+00 3.7196e-03 6.3835e-02 -6.0000e+00 3.6966e-01 -1.9045e-02 4.9034e-03 5.0135e-02 -6.0000e+00 3.9954e-01 -4.8902e-02 4.4560e-03 1.7494e-02 -6.0000e+00 2.3948e-01 9.0739e-03 2.1780e-03 4.8961e-03 -6.0000e+00 1.0365e-01 6.8144e-04 4.8798e-04 6.1540e-05 8.2833e-05 -6.0000e+00 7.1770e-03 1.6566e-02 0.0000e+00 12 9 8 11 4 0 56.59 31.09 0.49 0.01657 0.02023 181 20 1 5 0 298.320 39.25 20.00 31.09 26.90 4.2 1008.05 -86096 -99079 -86939 -62144 -70232 -120545 -68386 -35008 -86898 -93133 -93399 -48746 -15976 -53123 -4860 -8226 23462 -11915 -25959 -3086 -20626 -21883 -14440 -17703 -19635 -11704 -24701 -21151 -13282 -14050 -17263 -7324 -2595 -4312 -3180 -12737 -11780 -6261 -3600 -1442 3193 1567 -953 2639 3462 1426 -1733 1845 -2277 359 1516 3982 3449 3094 2334 2791 3621 2183 989 612 2098 1352 3051 4076 2914 1595 380 587 871 1131 2213 2963 1500 967 -635 -2308 -1685 -4084 -3394 -2310 -1841 -1544 -2034 -2328 -469 79 642 1508 1400 1830 191 -496 -1632 -2201 -1090 -1254 -673 759 847 -513 -1471 -1823 -2500 -1697 -1452 -1345 -1161 -373 438 1386 1822 1742 1578 639 -292 -917 -294 121 171 564 222 665 770 611 94 -410 -1204 -211 -147 -814 -569 -788 -573 -628 -166 58 -124 821 660 191 92 -291 -367 -642 -992 -838 -464 -524 -1448 -523 -217 -1028 -1288 -1360 -497 -142 -860 -60 -126 295 -234 -638 -64 -582 -631 -402 -553 -676 -396 -984 -796 -447 -495 -719 -323 -125 -231 -165 -714 -710 -417 -285 -135 327 176 -116 321 424 182 -232 243 -322 52 237 676 644 630 512 636 847 523 236 144 498 350 870 1289 992 540 126 196 310 458 996 1409 732 457 -284 -950 -631 -1527 -1344 -1048 -970 -928 -1361 -1667 -352 64 543 1315 1241 1582 158 -383 -1204 -1614 -849 -1111 -619 787 971 -611 -1693 -1941 -2449 -1611 -1467 -1453 -1319 -448 563 1939 2797 2857 2624 1041 -454 -1354 -426 181 269 940 380 1112 1250 963 143 -603 -1717 -298 -225 -1402 -1071 -1462 -1111 -1279 -359 132 -296 1986 1622 463 212 -643 -781 SS 20251010T130219.3Z 9414.543279 258 1 53.94 2 77.49 105.62 55.90 282.46 0.00 1 0.00 1 0 25 1.956e-01 9.703e-03 3.750e-02 1.394e-03 4.952889e-01 7.322217e-04 6.238278e-03 -6.000000e+00 1.134389e-01 227.23 -2.00 3.24 -2.00 320.49 0.00e+00 2.138817e-03 2.906478e-04 4.753413e-03 -6.000000e+00 5.188627e-03 291.66 -2.00 20.00 -2.00 319.74 0.00e+00 4.486 0.001 302.00 328.00 3 1.0995e+00 2.2991e-03 5.5162e-02 -6.0000e+00 2.8058e-01 -3.4472e-02 2.9363e-03 3.8663e-02 -6.0000e+00 3.0325e-01 -1.9012e-02 2.6024e-03 1.5011e-02 -6.0000e+00 1.8177e-01 -2.5713e-03 1.3111e-03 3.7408e-03 -6.0000e+00 7.8674e-02 1.2444e-03 4.1663e-04 4.1714e-05 6.1338e-05 -6.0000e+00 5.4473e-03 1.6378e-02 0.0000e+00 12 9 8 11 4 0 58.21 31.14 0.46 0.01638 0.01951 254 28 1 5 0 212.350 39.25 20.01 31.14 27.11 4.2 1008.81 -75969 -69090 -54354 -81606 -70460 -62188 -87393 -48457 -50747 -44617 -43177 -36122 -45902 -31111 -16950 -18370 -8562 -12031 -3702 -6464 -10666 -9139 -5967 -13346 -3961 -12624 -11159 -7621 -11679 -2444 -2650 -1003 -4866 -4949 -7466 -6753 -5803 -2855 -2677 -218 1245 345 2479 2298 2327 2530 893 325 -1372 953 2107 2080 1649 2626 1708 1862 1421 950 464 349 782 2351 3240 3940 2788 362 447 -940 126 1635 1273 1787 1021 1100 373 -1433 -2947 -3835 -2769 -3122 -2276 -1952 -1836 -1452 -1051 -179 868 1209 1589 1782 805 -229 -1773 -1870 -1190 -1174 -49 788 430 -466 -773 -1851 -2152 -1157 -1233 -1449 -811 1 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