File name: Pandora85s1_NewOrleansLA-XULA_20251211_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T095351.5Z 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_20251211_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: 20251211 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 20251211T131820.4Z 9476.554402 269 1 53.70 2 84.73 120.46 33.34 225.51 0.00 1 0.00 1 0 17 7.146e-01 4.974e-02 5.411e-01 4.171e-02 9.148978e-01 2.638236e-02 1.016151e-02 -6.000000e+00 4.345527e-01 224.37 -2.00 3.24 -2.00 322.42 0.00e+00 3.932133e-03 1.479500e-02 1.160273e-02 -6.000000e+00 2.272076e-02 286.50 -2.00 20.00 -2.00 321.97 0.00e+00 9.436 0.010 302.00 328.00 3 2.4144e-01 1.0692e-01 1.2145e-01 -6.0000e+00 1.0847e+00 1.6560e+00 1.3609e-01 9.2791e-02 -6.0000e+00 1.1900e+00 -1.9449e+00 9.8877e-02 4.0865e-02 -6.0000e+00 6.9156e-01 7.0812e-01 4.8848e-02 8.5635e-03 -6.0000e+00 2.9512e-01 1.2751e-05 1.9474e-03 1.2697e-03 2.1617e-04 -6.0000e+00 2.1622e-02 -1.9555e-03 0.0000e+00 12 8 8 10 0 0 26.17 23.84 1.71 -0.00196 0.01268 26 3 1 5 0 2065.060 32.25 20.01 23.84 14.77 4.3 958.58 2347 32438 900000 15248 900000 900000 900000 900000 46159 900000 900000 -90717 900000 -8078 900000 900000 47304 900000 101167 900000 199042 900000 12491 900000 21617 54496 64642 95431 115234 -125340 173178 -40901 900000 900000 -21990 900000 -41667 900000 60841 900000 20039 50237 128095 -41219 -28161 900000 -31923 298657 301931 -61826 154588 145955 263168 61629 900000 55956 11871 28370 174087 71516 85763 66957 112180 61038 92979 75008 -42658 -2110 85290 37041 78859 13473 61915 -14967 -1048 57292 -25600 -527 5200 -1754 16243 11402 6397 56611 20150 -9869 15341 19026 10720 -24 45255 -4122 -4379 -5104 -9387 3039 -2354 1840 1354 -11014 6429 -7492 488 1716 -13851 -7939 -7516 -2677 4981 -2794 640 -3596 4903 6444 -8610 324 2262 1733 -215 -1062 -2422 667 7518 2228 -860 3717 542 1569 689 -767 745 864 -389 145 -2111 76 2662 -304 853 -264 -1591 767 -1649 111 1313 900000 617 900000 900000 900000 900000 1869 900000 900000 -5816 900000 -327 900000 900000 1915 900000 4096 900000 8059 900000 506 900000 875 2207 2617 3864 4666 -15687 7012 -3011 900000 900000 -1457 900000 -3067 900000 2464 900000 1254 2404 5187 -4855 -2799 900000 -3173 12093 12225 -9103 6259 5910 10656 3630 900000 3708 1224 2402 7049 3422 3473 3451 4542 4269 5134 4970 -9107 -311 5651 4500 6967 2381 6609 -3195 -174 4640 -4335 -77 800 -348 3223 2770 1839 10544 5711 -3996 5031 6163 3776 -9 10262 -1435 -1489 -1819 -3953 1341 -1306 1155 970 -9321 4400 -5370 287 938 -9254 -5336 -5326 -1962 3771 -2636 676 -4441 5877 7671 -11644 388 2656 2133 -286 -1488 -3432 878 8828 2679 -1034 4168 614 1810 915 -1217 1337 1725 -853 339 -5471 207 7275 -871 2431 -737 -4207 1838 -3813 SS 20251211T133110.9Z 9476.563321 272 1 54.08 2 82.36 122.22 35.40 229.73 0.00 1 0.00 1 0 25 5.564e-01 1.800e-02 2.618e-01 5.804e-03 7.646941e-01 3.261187e-03 1.129462e-02 -6.000000e+00 3.199792e-01 224.37 -2.00 3.24 -2.00 321.90 0.00e+00 4.728070e-03 1.968113e-03 1.938002e-02 -6.000000e+00 1.507890e-02 286.50 -2.00 20.00 -2.00 321.42 0.00e+00 6.983 0.004 302.00 328.00 3 4.4827e-01 1.3193e-02 1.3188e-01 -6.0000e+00 7.8773e-01 3.9341e-01 1.9634e-02 1.4633e-01 -6.0000e+00 8.5327e-01 -6.0358e-01 1.9409e-02 5.5899e-02 -6.0000e+00 5.1088e-01 2.4120e-01 8.7060e-03 7.0159e-03 -6.0000e+00 2.2251e-01 1.6141e-04 3.9429e-04 1.6490e-04 3.1912e-04 -6.0000e+00 1.5525e-02 -2.1899e-03 0.0000e+00 12 8 8 10 0 0 4.41 23.90 0.58 -0.00219 0.00077 110 12 1 5 0 491.580 32.25 20.01 23.90 15.34 4.3 961.12 -72130 -143408 -177817 -175630 -225362 -135221 -152347 -91683 -239554 -228223 -196950 900000 -127696 -82979 -36043 -75021 11907 -13465 -64318 27419 -40611 -55137 34455 -50879 -91871 -54012 -46760 -43849 -57635 -46853 8488 -12196 -3278 19971 -17335 25595 30726 10930 958 33723 14208 26502 26398 36533 13497 37789 24668 9582 30003 5255 19825 35493 11704 21383 22961 18390 19779 11121 7078 4746 13850 8083 14249 15056 20093 12475 3098 1546 11903 12832 8019 10524 8003 9394 4370 -2939 -6083 -6146 -3410 -6488 -3338 198 -117 -1819 -1320 624 1997 478 2854 1478 -1890 -2983 -5730 -6308 -3933 -3769 -1226 -75 896 -1105 -2546 -3429 -4132 -2716 -847 -2173 -2500 -622 -109 777 1986 2027 1813 518 -909 -1608 -305 -312 952 1181 822 1578 2066 1834 1752 -147 -1384 -1542 -9 -392 -530 -450 -739 -805 -474 55 -27 932 1096 508 -91 -791 -1205 -408 -1254 -2379 -2259 -4290 -974 -1332 -519 -5916 -5401 -3546 900000 -1577 -854 -297 -1119 86 -139 -1191 212 -627 -964 248 -916 -2647 -1112 -914 -812 -1186 -916 114 -245 -71 380 -473 435 522 259 30 920 541 968 1120 1447 680 1518 1159 542 1460 351 1268 2189 1013 1839 2092 1832 2004 1234 793 526 1411 938 1766 2130 2979 2026 549 287 2149 2622 1942 2650 2083 2302 1034 -670 -1312 -1315 -778 -1814 -1082 72 -49 -828 -636 316 1053 266 1570 810 -1012 -1511 -2867 -3220 -2161 -2412 -901 -64 856 -1128 -2553 -3193 -3472 -2129 -682 -1900 -2316 -609 -116 929 2670 3010 2818 812 -1397 -2384 -441 -466 1484 1935 1367 2523 3156 2723 2510 -207 -1926 -2165 -13 -694 -1062 -991 -1588 -1839 -1158 143 -72 2533 3011 1371 -233 -1912 -2766 SS 20251211T134152.9Z 9476.570751 275 1 53.97 2 80.41 123.75 37.22 232.93 0.00 1 0.00 1 0 25 4.704e-01 1.123e-02 1.193e-01 2.199e-03 6.597508e-01 1.205630e-03 8.959032e-03 -6.000000e+00 2.704597e-01 224.37 -2.00 3.24 -2.00 321.32 0.00e+00 4.390125e-03 6.250658e-04 1.042910e-02 -6.000000e+00 1.221320e-02 286.50 -2.00 20.00 -2.00 320.77 0.00e+00 5.723 0.002 302.00 328.00 3 3.7554e-01 4.3338e-03 8.3606e-02 -6.0000e+00 6.6586e-01 8.4259e-02 6.1236e-03 7.5508e-02 -6.0000e+00 7.2114e-01 -1.4653e-01 6.1926e-03 2.9741e-02 -6.0000e+00 4.3181e-01 4.8378e-02 2.9118e-03 5.4844e-03 -6.0000e+00 1.8761e-01 6.4492e-04 5.0770e-04 6.3372e-05 1.7953e-04 -6.0000e+00 1.3087e-02 -2.3357e-03 0.0000e+00 12 8 8 10 0 0 -2.93 23.97 0.52 -0.00234 0.00148 244 27 1 5 0 221.180 32.25 20.00 23.97 15.95 4.3 963.64 -78471 -138185 -157736 -179717 -126808 -183267 -162554 -154147 -124262 -156833 -128533 -131059 -81189 -87726 -82965 -58502 -18242 -47933 -12159 -29067 -26589 -56515 -21742 -24374 -35930 -36782 -43663 -37288 -30679 -41688 -7475 -16547 -25759 -6986 -20344 -16348 -22119 -1916 -11175 6858 -1648 -4434 5476 3929 6601 8355 3125 4508 3661 -976 2587 3343 4633 6400 3212 2837 5102 1566 2235 829 1236 4259 5681 4875 5612 3113 3010 -541 696 4101 2463 3056 2111 2298 888 -651 -4754 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