File name: Pandora85s1_NewOrleansLA-XULA_20260402_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260403T063300.4Z 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_20260402_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: 20260402 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 20260402T123150.1Z 9588.522107 231 1 54.12 2 81.46 89.07 98.99 263.05 0.00 1 0.00 1 0 25 5.754e-01 1.661e-02 4.172e-01 9.366e-03 7.516600e-01 5.375635e-03 1.063352e-02 -6.000000e+00 3.377887e-01 228.44 -2.00 3.24 -2.00 321.89 0.00e+00 6.529571e-03 3.219684e-03 1.600756e-02 -6.000000e+00 1.502758e-02 286.99 -2.00 20.00 -2.00 321.38 0.00e+00 6.344 0.003 302.00 328.00 3 1.7866e+00 2.1471e-02 1.1117e-01 -6.0000e+00 8.4008e-01 2.8552e-01 3.1947e-02 1.1481e-01 -6.0000e+00 9.0864e-01 -4.4723e-01 3.2325e-02 4.5116e-02 -6.0000e+00 5.4247e-01 1.7806e-01 1.4569e-02 6.9160e-03 -6.0000e+00 2.3418e-01 7.6580e-05 3.9115e-04 2.7211e-04 2.7735e-04 -6.0000e+00 1.6207e-02 -1.3595e-03 0.0000e+00 12 8 8 10 0 0 91.69 25.12 0.53 -0.00136 0.00158 42 5 1 5 0 1288.540 33.00 20.00 25.12 26.63 4.5 1006.00 900000 -185921 -115571 -115758 -202192 -200136 -156704 -290471 -151175 -194715 -98515 -139342 45169 -128326 900000 11024 900000 55878 64955 -57791 -92180 -89353 54732 -16313 -2417 71339 -76305 -70090 -27436 -95907 26624 75991 -27454 -2010 1071 35803 -41476 44312 52808 29562 37563 24929 7630 -13260 1109 17923 -1263 19432 -3273 16964 10207 36556 11480 2235 19861 25183 17977 14227 4214 15093 -3371 4357 25910 11220 12155 -1896 15074 5222 7838 8645 7189 5589 1251 8736 2249 9213 -2921 -3445 -8010 960 -181 -3161 617 -3806 1164 -3402 -244 1093 2531 1776 1821 43 -2579 -3383 -4482 -1865 -3269 304 380 -88 -2219 -4440 -2058 -858 -1522 -1710 -1928 -2160 -133 1321 1452 1906 475 596 -659 -1003 -1397 -183 1361 2011 321 2619 1577 1636 132 -1866 -817 -263 -72 -607 441 -1052 -395 -907 299 60 583 -76 885 211 -321 281 -1140 900000 -1697 -1055 -1057 -2181 -1993 -1431 -7955 -1380 -2424 -899 -1272 412 -1597 900000 101 900000 510 593 -863 -1989 -1854 500 -176 -24 651 -1710 -1454 -364 -2706 265 694 -684 -43 22 505 -1342 699 920 785 1060 869 336 -748 55 773 -75 976 -218 991 708 2203 985 231 1849 2322 1838 1520 485 1516 -412 533 2909 1680 1986 -362 2408 949 1495 1871 1785 1505 355 2201 556 1909 -627 -736 -1960 255 -58 -1221 259 -1800 558 -1829 -134 617 1428 992 961 22 -1274 -1702 -2504 -1181 -2471 260 367 -90 -2224 -4187 -1701 -664 -1241 -1496 -1783 -2151 -143 1566 1948 2803 738 918 -990 -1446 -1996 -267 2067 3198 525 4061 2374 2384 188 -2620 -1100 -354 -107 -1041 843 -2236 -891 -2182 761 149 1492 -198 2327 546 -866 709 -2757 SS 20260402T124449.6Z 9588.531130 236 1 54.18 2 78.65 90.69 101.72 264.54 0.00 1 0.00 1 0 25 3.407e-01 1.085e-02 2.715e-01 4.630e-03 6.190908e-01 2.529313e-03 8.082825e-03 -6.000000e+00 1.988839e-01 228.44 -2.00 3.24 -2.00 321.15 0.00e+00 3.033222e-03 1.223074e-03 8.090947e-03 -6.000000e+00 8.864861e-03 286.99 -2.00 20.00 -2.00 320.56 0.00e+00 4.907 0.001 302.00 328.00 3 2.3190e+00 8.6281e-03 6.9743e-02 -6.0000e+00 4.9420e-01 8.6860e-02 1.1919e-02 6.1006e-02 -6.0000e+00 5.3368e-01 -1.2553e-01 1.1851e-02 2.4314e-02 -6.0000e+00 3.1863e-01 4.1125e-02 5.6723e-03 4.8729e-03 -6.0000e+00 1.3729e-01 2.0026e-04 8.9240e-05 1.3494e-04 1.0807e-04 -6.0000e+00 9.4888e-03 -1.3766e-03 0.0000e+00 12 8 8 10 0 0 96.79 25.18 0.56 -0.00138 -0.00071 57 6 1 5 0 950.480 33.00 20.00 25.18 27.17 4.5 1007.66 18394 -54413 -21933 -142641 -40447 -32912 -175118 -155027 204019 19348 -74921 -97437 -50871 -15671 -12307 -29786 -52052 -49796 28605 10183 -30521 -7550 -22933 -46910 -7234 -14701 -37748 10283 -23816 -12896 32814 -24783 -1019 4914 9432 -16115 -9629 5010 2792 4726 -1411 4557 1777 -6295 10357 554 -12875 7231 5399 -2425 8191 3011 4962 -1039 1190 1593 2565 1551 1708 1351 1948 -926 5659 3467 1032 1661 2083 2476 1850 1755 2701 1116 1794 1573 735 570 -3337 -3496 -2999 -2828 -1289 -739 -2453 -1091 -927 28 1498 854 1041 1509 640 -700 -2994 -2677 -3380 -1032 -763 922 491 391 -836 -1573 -2698 -1850 -787 -1667 -555 -407 292 734 1670 2474 1787 180 -354 -681 -657 -96 242 937 918 257 1085 652 592 -214 -1585 -1055 108 -815 -458 -670 -620 -1029 -452 35 -163 949 1057 -25 91 -111 -472 83 -246 -99 -1581 -183 -149 -2516 -2037 921 87 -584 -1040 -418 -116 -111 -391 -983 -1022 294 134 -626 -124 -452 -1271 -143 -332 -1116 186 -587 -296 552 -885 -33 186 341 -728 -435 226 156 316 -116 385 164 -654 926 56 -1517 715 566 -290 965 419 746 -181 218 304 503 311 336 261 378 -199 1278 906 300 480 584 700 560 604 1042 468 759 644 282 198 -1097 -1118 -1016 -1110 -587 -386 -1459 -687 -619 20 1111 663 819 1163 470 -484 -2001 -1762 -2403 -817 -697 953 572 473 -989 -1731 -2714 -1762 -779 -1786 -618 -483 371 1026 2576 3728 2783 280 -525 -961 -996 -150 396 1460 1462 403 1794 1048 912 -320 -2316 -1521 167 -1432 -807 -1280 -1250 -2189 -1020 85 -405 2383 2689 -62 219 -252 -1026 SS 20260402T125017.4Z 9588.534924 239 1 54.10 2 77.46 91.38 102.87 265.16 0.00 1 0.00 1 0 25 2.776e-01 1.046e-02 5.327e-02 1.513e-03 5.677025e-01 8.099345e-04 7.355790e-03 -6.000000e+00 1.620671e-01 228.44 -2.00 3.24 -2.00 320.70 0.00e+00 2.701718e-03 3.397726e-04 6.137389e-03 -6.000000e+00 7.223827e-03 286.99 -2.00 20.00 -2.00 320.06 0.00e+00 4.477 0.001 302.00 328.00 3 1.1359e+00 2.5620e-03 5.9490e-02 -6.0000e+00 4.0272e-01 1.9652e-02 3.3558e-03 4.6803e-02 -6.0000e+00 4.3489e-01 -4.6713e-02 3.1956e-03 1.9527e-02 -6.0000e+00 2.5964e-01 6.8775e-03 1.5812e-03 4.2181e-03 -6.0000e+00 1.1188e-01 1.0547e-03 3.8100e-04 4.3984e-05 9.5150e-05 -6.0000e+00 7.7322e-03 -1.3749e-03 0.0000e+00 12 8 8 10 0 0 91.87 25.22 0.34 -0.00137 0.00149 221 25 1 5 0 244.760 33.00 20.00 25.22 27.32 4.5 1008.53 -105998 -59966 -76080 -86094 -92151 -122208 -108072 -100204 -68901 -61708 -59073 -77104 -60850 -47880 -43752 -25302 -22708 -18542 -17067 -14244 -11217 -22542 -21954 -13086 -15127 -16639 -16753 -12282 -18523 -15950 -13652 -7487 -3117 -5753 -6870 -13019 -8483 -6348 -2415 -2497 -466 2145 399 3702 1820 3526 970 2096 1537 -628 1571 2869 2221 3958 3562 2673 2580 725 800 517 557 2641 3896 4301 3205 1668 1158 -459 -67 1843 1573 1896 1373 1430 158 -1547 -2817 -3826 -4247 -2915 -2295 -1372 -2000 -2060 -1220 276 839 1142 1581 1903 457 -134 -1437 -2066 -2038 -1542 -926 872 1057 -27 -742 -1705 -2446 -1534 -1063 -1329 -739 -293 449 1199 1720 1839 1360 750 -233 -1036 -607 28 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