File name: Pandora85s1_NewOrleansLA-XULA_20240616_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240709T182354.8Z 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_20240616_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: 20240616 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 20240616T113135.8Z 8933.480276 96 1 53.08 2 84.53 66.13 144.79 300.43 0.00 1 0.00 1 0 33 6.498e-01 7.889e-02 2.071e-01 1.430e-02 1.000582e+00 1.012446e-02 1.463997e-02 -6.000000e+00 4.327733e-01 230.97 -2.00 3.24 -2.00 322.28 0.00e+00 -3.138462e-02 6.778179e-03 3.405712e-02 -6.000000e+00 5.623748e-02 292.70 -2.00 20.00 -2.00 321.80 0.00e+00 9.154 0.009 302.00 328.00 3 4.0119e-01 4.5298e-02 2.1661e-01 -6.0000e+00 1.0485e+00 1.8220e+00 5.6259e-02 2.3238e-01 -6.0000e+00 1.1410e+00 -2.2082e+00 3.9751e-02 5.3623e-02 -6.0000e+00 6.7474e-01 8.1781e-01 1.9868e-02 2.0989e-02 -6.0000e+00 3.2363e-01 1.2238e-05 -2.4008e-03 4.4527e-04 4.8244e-04 -6.0000e+00 2.1639e-02 1.2694e-02 12 8 8 10 0 0 22.65 27.15 1.72 0.01269 -0.00535 22 2 1 5 0 2412.260 34.50 20.01 27.15 33.51 11.9 1011.87 900000 900000 900000 900000 900000 900000 900000 12520 900000 900000 900000 900000 900000 900000 900000 900000 -2668 50493 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 2785 900000 34 17926 261710 95475 900000 -14457 900000 900000 900000 900000 900000 900000 900000 -55447 900000 900000 58342 900000 900000 900000 129913 93527 900000 900000 84639 41932 117499 212670 -30257 900000 122860 -43353 192263 900000 -14891 900000 75638 144855 109859 151919 41917 -3679 91183 549 -7291 31520 -10081 195913 -18334 53669 41605 -20679 12916 97080 2298 -2330 29860 -27726 78896 -4685 17495 26468 73049 -22284 -920 3038 -7399 1317 13422 3520 3691 -710 -2672 -13109 6654 -665 6921 21961 -11908 14483 11020 7304 -7596 3602 -7502 -11561 -6288 -6788 6553 -1236 19618 2533 -3552 -893 -11589 11123 -3378 5002 -467 -1017 1359 5400 -4702 798 727 587 971 2998 6529 -9212 -685 900000 900000 900000 900000 900000 900000 900000 900000 721 900000 900000 900000 900000 900000 900000 900000 900000 -257 2782 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 160 900000 2 1100 3605 2272 900000 -1177 900000 900000 900000 900000 900000 900000 900000 -8958 900000 900000 2974 900000 900000 900000 4474 5025 900000 900000 6063 4621 5665 3516 -5127 900000 4739 -9854 4503 900000 -2728 900000 6356 6984 8475 8162 6756 -877 7537 98 -1246 3561 -1861 5398 -5127 8576 8597 -8660 4110 14176 905 -985 9132 -14590 13368 -1710 4989 7147 13887 -12924 -507 1879 -5273 911 8802 2342 2177 -407 -1623 -9481 4152 -479 5101 15974 -12900 13712 11620 8187 -9760 4010 -9207 -15217 -8261 -9394 7961 -1552 18992 2820 -4088 -978 -13788 10642 -4206 6784 -774 -1902 2484 10253 -10731 1859 1764 1447 2403 7070 13836 -21023 -1333 900000 SS 20240616T114448.7Z 8933.489453 99 1 53.88 2 81.90 67.64 147.15 304.13 0.00 1 0.00 1 0 17 5.192e-01 1.797e-02 1.396e-01 2.571e-03 7.584249e-01 1.455696e-03 9.978438e-03 -6.000000e+00 3.087928e-01 230.97 -2.00 3.24 -2.00 321.19 0.00e+00 -6.757029e-04 7.440450e-04 1.103627e-02 -6.000000e+00 1.551716e-02 292.70 -2.00 20.00 -2.00 320.55 0.00e+00 6.634 0.003 302.00 328.00 3 5.6219e-01 5.1627e-03 9.6438e-02 -6.0000e+00 7.7057e-01 1.4584e-01 7.2918e-03 8.7362e-02 -6.0000e+00 8.3328e-01 -2.7413e-01 7.2123e-03 2.2489e-02 -6.0000e+00 4.9460e-01 1.0560e-01 3.4257e-03 1.4008e-02 -6.0000e+00 2.1401e-01 2.0969e-04 2.0131e-04 6.9217e-05 1.0115e-04 -6.0000e+00 1.4581e-02 1.1568e-02 12 8 8 10 0 0 13.23 27.20 0.59 0.01157 0.01308 115 13 1 5 0 468.470 34.50 20.00 27.20 34.11 12.0 1011.79 900000 -215065 900000 -113775 -212426 900000 900000 -226805 -117731 -243555 900000 -57490 -50762 -103366 -87348 900000 -157517 -111876 900000 -27187 24601 -82460 -11951 50901 -25654 59194 112404 900000 -42715 40437 -69685 1750 -53164 -35330 -19277 -35771 -28006 -50369 -12113 25112 28916 43662 26003 4942 16494 -12842 47312 8821 -953 7243 4100 29238 4945 4097 18143 19231 3786 2797 300 5173 -4875 8954 1387 -487 7172 10370 -2518 10189 2280 7180 7692 6915 4371 305 1289 -4145 -5937 -6683 -7400 -1186 -3912 269 -896 -3311 -1232 3181 304 960 2332 -296 2789 -1704 -1715 -2749 -1048 -3938 -1931 308 -943 -537 -715 -2739 -3004 -2427 -1446 -2147 -990 -800 942 2572 1556 3110 2234 1202 -874 -850 -933 -832 232 430 1072 1155 2173 1120 426 -272 -2408 -251 -795 -119 -261 -901 -739 -437 -593 58 200 1068 924 557 195 -1096 -753 900000 900000 -2056 900000 -440 -2031 900000 900000 -3046 -616 -5045 900000 -222 -254 -1139 -1050 900000 -4984 -2773 900000 -340 191 -1879 -141 357 -430 459 535 900000 -909 395 -2443 37 -2303 -1442 -666 -1415 -1108 -2938 -597 1056 1368 1957 1478 359 1078 -1148 2381 678 -86 647 424 2687 647 599 2512 2793 673 511 55 873 -915 1578 300 -113 1693 2396 -657 2668 640 2223 2694 2614 1716 119 461 -1406 -1881 -2117 -2587 -464 -1881 145 -507 -2070 -806 2143 223 728 1769 -226 1949 -1166 -1127 -1850 -766 -3187 -1797 304 -1065 -631 -811 -2906 -3087 -2365 -1476 -2199 -1056 -915 1158 3270 2269 4606 3469 1871 -1337 -1242 -1347 -1245 363 709 1773 1849 3303 1670 617 -409 -3580 -366 -1217 -196 -484 -1742 -1521 -904 -1322 130 467 2515 2206 1305 431 -2429 -1577 900000 SS 20240616T120004.2Z 8933.500049 104 1 7.90 2 78.82 69.34 149.73 308.97 0.00 1 0.00 1 0 25 3.770e-01 2.018e-02 2.246e-01 7.902e-03 5.999041e-01 4.308591e-03 7.205895e-03 -6.000000e+00 2.221555e-01 230.97 -2.00 3.24 -2.00 320.30 0.00e+00 3.704536e-04 1.626422e-03 4.532519e-03 -6.000000e+00 1.111525e-02 292.70 -2.00 20.00 -2.00 319.54 0.00e+00 4.975 0.001 302.00 328.00 3 2.4484e+00 1.3246e-02 6.1665e-02 -6.0000e+00 5.5528e-01 4.5385e-02 1.6642e-02 4.1746e-02 -6.0000e+00 6.0021e-01 -8.7851e-02 1.4788e-02 1.5011e-02 -6.0000e+00 3.5812e-01 3.1396e-02 7.5712e-03 6.3715e-03 -6.0000e+00 1.5625e-01 1.7217e-04 -6.8130e-04 2.2051e-04 5.1597e-05 -6.0000e+00 1.0461e-02 1.5982e-02 12 9 9 12 1 1 99.97 27.27 0.61 0.01598 0.01086 5 5 1 5 0 1315.760 34.50 20.01 27.27 35.08 11.9 1012.17 900000 -64358 900000 900000 -144720 900000 -96661 -158650 -55604 -179689 900000 -103798 57851 19262 -68383 900000 -90418 -23725 900000 -70973 119808 -38474 27251 40146 4280 26023 99384 121099 557 81398 7262 15246 -29034 -16389 -632 -12896 -10758 -28005 -867 20255 19825 15823 23890 1472 1650 -9130 -2268 7386 9601 826 -482 9703 7566 1974 14646 9186 4886 -3670 3088 4268 -4250 4824 2348 725 3935 1992 424 7261 -480 1847 1417 7035 1222 -595 2268 -2816 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