File name: Pandora85s1_NewOrleansLA-XULA_20240801_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240802T231341.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v2d20240315.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20240801_L1_smca1c2d20230315p1-8.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: 20240801 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: 196 339 Nominal wavelengths inside fitting window [nm]: 305.0087 305.1493 305.2899 305.4305 305.5710 305.7116 305.8522 305.9927 306.1332 306.2737 306.4143 306.5547 306.6952 306.8357 306.9762 307.1166 307.2571 307.3975 307.5379 307.6783 307.8187 307.9591 308.0994 308.2398 308.3801 308.5205 308.6608 308.8011 308.9414 309.0817 309.2220 309.3623 309.5025 309.6428 309.7830 309.9232 310.0634 310.2036 310.3438 310.4840 310.6242 310.7643 310.9045 311.0446 311.1847 311.3248 311.4649 311.6050 311.7451 311.8851 312.0252 312.1652 312.3053 312.4453 312.5853 312.7253 312.8653 313.0052 313.1452 313.2851 313.4251 313.5650 313.7049 313.8448 313.9847 314.1246 314.2644 314.4043 314.5442 314.6840 314.8238 314.9636 315.1034 315.2432 315.3830 315.5227 315.6625 315.8022 315.9420 316.0817 316.2214 316.3611 316.5008 316.6404 316.7801 316.9198 317.0594 317.1990 317.3386 317.4782 317.6178 317.7574 317.8970 318.0365 318.1761 318.3156 318.4551 318.5947 318.7342 318.8736 319.0131 319.1526 319.2920 319.4315 319.5709 319.7103 319.8497 319.9891 320.1285 320.2679 320.4073 320.5466 320.6859 320.8253 320.9646 321.1039 321.2432 321.3825 321.5217 321.6610 321.8002 321.9395 322.0787 322.2179 322.3571 322.4963 322.6355 322.7746 322.9138 323.0529 323.1921 323.3312 323.4703 323.6094 323.7485 323.8875 324.0266 324.1656 324.3047 324.4437 324.5827 324.7217 324.8607 324.9997 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Temperature at electronics board [°C], 999=no temperature signal Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Humidity in head sensor [%], -9=no humidity signal Column 98: Pressure in head sensor [hPa], -9=no pressure signal Columns 99-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-386: 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 20240801T120401.8Z 8979.502799 144 1 32.65 2 81.79 74.13 47.34 77.80 0.00 1 0.00 1 0 25 5.747e-01 3.510e-02 2.192e-01 7.620e-03 7.169162e-01 4.405985e-03 8.118244e-03 -6.000000e+00 3.431613e-01 229.83 -2.00 3.24 -2.00 321.40 0.00e+00 -1.345045e-03 2.428642e-03 7.503098e-03 -6.000000e+00 2.408529e-02 294.47 -2.00 20.00 -2.00 320.73 0.00e+00 6.557 0.003 302.00 328.00 3 2.0812e+00 1.6720e-02 8.5887e-02 -6.0000e+00 8.5071e-01 3.7519e-01 2.2672e-02 6.7444e-02 -6.0000e+00 9.2817e-01 -6.3127e-01 2.0245e-02 1.8753e-02 -6.0000e+00 5.5448e-01 2.6726e-01 9.6247e-03 1.1223e-02 -6.0000e+00 2.3910e-01 5.0503e-05 -1.5420e-03 2.2115e-04 7.5043e-05 -6.0000e+00 1.6812e-02 -2.2765e-02 12 9 9 12 33 1 87.74 27.32 1.00 -0.02276 -0.03435 15 3 1 5 0 2040.280 34.50 20.01 27.32 34.76 23.8 1018.95 900000 -195638 900000 -159178 900000 900000 -167325 900000 -187710 -70116 900000 900000 900000 900000 900000 900000 150732 210399 900000 900000 900000 -74828 222531 900000 900000 900000 900000 900000 84772 900000 -79526 52922 900000 17302 -39376 16716 77403 -1265 135320 81157 157012 104069 106799 31153 -18562 -49826 900000 44589 1137 65966 12089 63523 27736 -3233 53566 53031 5913 14200 33023 11793 25310 29979 5137 33441 11122 23370 -17835 26571 19582 16130 26319 12938 -3208 1216 7823 -16032 -13515 1573 -5187 15305 -5321 -7986 282 -9470 4984 7632 -7869 1005 4467 -7186 2494 -7367 -606 -5812 -2674 4365 -143 -2895 2169 -1754 -1087 -5868 1626 -1642 -4545 -4255 2537 1712 467 1002 -3347 4198 5030 2170 2543 -40 -4174 -4144 -721 -1521 496 1687 4732 2976 744 394 -2612 399 -2001 -1145 941 268 1170 1299 -1649 -166 -1310 -7 1405 2039 959 -3129 -459 -328 900000 -6447 900000 -3961 900000 900000 -3714 900000 -6312 -802 900000 900000 900000 900000 900000 900000 1115 1556 900000 900000 900000 -2969 1646 900000 900000 900000 900000 900000 878 900000 -4648 979 900000 602 -2447 556 1432 -58 1902 2402 2555 3157 3318 2120 -2073 -7593 900000 2705 110 3514 1198 4229 2934 -510 5191 5453 1015 2290 4324 1832 3370 3970 969 5418 2509 4789 -4894 5189 4331 4176 7068 3924 -1176 415 2558 -5456 -4439 425 -1569 4359 -2022 -3647 135 -5464 2648 4245 -5440 665 2920 -5239 1575 -4786 -348 -3467 -1647 2871 -115 -2555 2087 -1885 -1144 -6037 1399 -1352 -3971 -4005 2357 1707 511 1213 -4426 5729 7193 3203 3623 -56 -5879 -5960 -1056 -2385 787 2598 6797 4218 1042 534 -3531 513 -2821 -1830 1547 488 2261 2475 -3458 -368 -2890 -15 3129 4477 2160 -6886 -925 -644 SS 20240801T121850.3Z 8979.513083 149 1 54.09 2 78.69 75.84 44.29 78.97 0.00 1 0.00 1 0 17 3.815e-01 1.420e-02 1.096e-01 2.072e-03 5.712391e-01 1.080818e-03 6.611111e-03 -6.000000e+00 2.189164e-01 229.82 -2.00 3.24 -2.00 320.18 0.00e+00 4.098967e-04 3.967775e-04 3.844043e-03 -6.000000e+00 1.023903e-02 294.47 -2.00 20.00 -2.00 319.34 0.00e+00 4.922 0.001 302.00 328.00 3 2.0262e+00 3.3302e-03 5.9230e-02 -6.0000e+00 5.4435e-01 -9.1382e-04 4.1703e-03 3.7840e-02 -6.0000e+00 5.9008e-01 -4.3858e-02 3.5929e-03 1.4340e-02 -6.0000e+00 3.5382e-01 7.3970e-03 1.8389e-03 4.7836e-03 -6.0000e+00 1.5138e-01 2.9861e-04 -2.3430e-04 5.7567e-05 4.8931e-05 -6.0000e+00 1.0375e-02 -2.4579e-02 12 8 8 10 0 0 58.34 27.41 0.61 -0.02458 -0.02634 77 9 1 5 0 702.360 34.50 20.00 27.41 35.65 23.8 1019.17 900000 -16799 900000 -86949 -74311 322073 -126525 -4232 -124015 -115825 -27826 -47394 -40414 92241 -9610 900000 -27581 -12082 -3413 10779 77453 -43937 -17959 29587 -892 11954 3879 71196 -9539 12572 -26505 35793 -329 -8548 -24939 -14499 -7563 -18246 -5788 2961 8348 7714 7751 -3790 -4540 -8580 14265 1743 -2465 2086 -299 7092 1499 -2551 4965 6702 117 3558 352 934 466 5060 1412 -761 4300 2885 -4499 2515 911 1384 4866 3293 981 346 -218 -2760 -4256 -3203 -4042 -1221 -1663 -2422 -1836 -2865 -722 1150 -422 1264 2631 335 1595 -483 -692 -2622 -1726 -2998 181 261 -128 235 40 -1840 -1793 -2020 -1062 -1455 -146 40 71 1356 1386 2634 2519 1711 -126 -370 -1570 -842 174 0 401 638 1425 889 129 -197 -1297 -1094 -742 -423 -50 -462 -884 -588 -597 -10 -266 392 1094 734 352 -328 -406 -295 900000 -98 900000 -1194 -840 650 -2376 -26 -2981 -2901 -309 -680 -637 484 -175 900000 -847 -351 -100 294 1142 -2218 -715 795 -36 456 169 1582 -455 480 -1665 1424 -22 -699 -2453 -1227 -623 -1924 -655 379 1192 1223 1307 -681 -834 -1667 2475 317 -482 406 -64 1589 393 -761 1489 2081 41 1219 123 317 159 1743 562 -321 1892 1302 -2103 1090 419 715 2783 1918 603 210 -125 -1598 -2258 -1595 -2092 -699 -1040 -1763 -1392 -2369 -621 1045 -388 1196 2514 326 1456 -448 -602 -2250 -1534 -2834 191 296 -155 300 50 -2182 -2047 -2173 -1178 -1752 -183 50 94 1847 2095 4057 4022 2712 -194 -537 -2350 -1275 260 0 662 1040 2232 1359 191 -297 -1900 -1558 -1115 -674 -83 -840 -1623 -1126 -1159 -21 -553 828 2338 1567 723 -672 -792 -564 SS 20240801T122455.6Z 8979.517310 152 1 54.11 2 77.41 76.53 43.03 79.45 0.00 1 0.00 1 0 17 2.146e-01 1.300e-02 6.118e-02 1.654e-03 5.215990e-01 8.496593e-04 5.929313e-03 -6.000000e+00 1.230052e-01 229.82 -2.00 3.24 -2.00 319.71 0.00e+00 1.052027e-03 2.657029e-04 2.678980e-03 -6.000000e+00 5.757810e-03 294.47 -2.00 20.00 -2.00 318.82 0.00e+00 4.459 0.001 302.00 328.00 3 2.1211e+00 2.4947e-03 5.2365e-02 -6.0000e+00 3.0580e-01 -1.4869e-02 3.0148e-03 3.0147e-02 -6.0000e+00 3.3136e-01 -1.7751e-02 2.4205e-03 1.2855e-02 -6.0000e+00 1.9858e-01 -3.8782e-03 1.2671e-03 3.4926e-03 -6.0000e+00 8.5050e-02 4.4167e-04 -3.7960e-04 4.5991e-05 3.9904e-05 -6.0000e+00 5.8298e-03 -2.5245e-02 12 8 8 10 0 0 57.03 27.46 0.43 -0.02525 -0.02810 81 9 1 5 0 667.960 34.50 20.01 27.46 35.88 23.8 1019.27 900000 -18760 900000 -81707 -39024 123595 -73199 -70370 -94183 -75327 -26165 -37309 -48192 16406 1448 72151 -13266 -5047 2639 7921 17080 -17296 -7289 -2403 5222 7226 7839 23659 -6865 -4375 -15260 23197 -4791 -6150 -17241 -10942 -8549 -13518 -2713 968 3201 4863 3847 -2737 -2669 -2622 8993 1530 -1067 2575 -269 4204 1270 -746 3815 4092 1388 2416 -122 435 726 3014 1186 851 3288 2203 -2748 457 -748 1567 3649 2156 859 663 71 -2030 -3279 -3496 -3951 -1402 -2276 -2231 -1523 -3095 -735 599 126 1397 1934 951 1734 -107 -674 -2529 -1400 -2992 -281 477 452 386 -289 -1443 -1893 -1663 -1257 -1469 -273 -18 189 1406 1558 2340 2087 1579 -111 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