File name: Pandora85s1_NewOrleansLA-XULA_20250826_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T091742.9Z 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_20250826_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: 20250826 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 20250826T121706.7Z 9369.511883 49 1 54.21 2 81.72 82.94 120.23 79.76 0.00 1 0.00 1 0 17 5.955e-01 2.551e-02 3.845e-01 1.309e-02 6.647790e-01 7.697458e-03 9.469442e-03 -6.000000e+00 3.515456e-01 229.22 -2.00 3.24 -2.00 321.92 0.00e+00 1.479112e-02 4.603460e-03 1.385073e-02 -6.000000e+00 1.861009e-02 294.27 -2.00 20.00 -2.00 321.35 0.00e+00 6.512 0.003 302.00 328.00 3 2.0967e+00 3.1781e-02 1.0072e-01 -6.0000e+00 8.7710e-01 4.5796e-01 4.3329e-02 9.2989e-02 -6.0000e+00 9.5192e-01 -7.6163e-01 3.6290e-02 3.4650e-02 -6.0000e+00 5.6506e-01 3.1246e-01 1.6758e-02 5.2002e-03 -6.0000e+00 2.4615e-01 5.3005e-05 -3.2033e-04 4.1091e-04 2.4634e-04 -6.0000e+00 1.7150e-02 1.9597e-02 0.0000e+00 12 9 8 11 4 0 -28.12 32.72 0.87 0.01960 0.01719 36 4 1 5 0 1505.720 40.75 20.01 32.72 31.16 4.2 1026.77 -75579 -167411 900000 -143781 -156994 -42106 -86252 -114490 164995 -183915 900000 900000 900000 152567 -48265 -60748 -36412 29249 72232 294546 900000 900000 900000 -2415 91491 175944 -92948 42779 3857 178984 87046 7270 68572 900000 21082 900000 -24429 900000 50825 113032 30652 86944 58846 56535 58595 70473 73099 48138 36276 54819 15302 76009 18572 6220 10029 16036 29541 36069 -15166 11058 39490 21687 32433 23807 -2446 16762 6275 9885 15096 3390 12342 14126 4150 2880 7951 -3858 -292 -4558 -10893 6683 3457 -1043 -11065 -894 -6620 -2233 10088 3932 2834 750 -2801 -10132 -2833 2950 -793 -1248 -3646 -2022 3727 -2506 -740 -3628 -2079 -5323 -5012 -1674 -1317 -4568 1462 289 696 1645 582 -785 1129 -258 -1462 1764 -2772 1736 -33 2223 5072 1418 1357 785 -2613 3384 -781 942 -1148 -31 -877 -470 -221 1235 31 -4 894 -135 144 -1562 -754 -963 -6220 900000 -4274 -4667 -536 -1099 -2122 2102 -7029 900000 900000 900000 1944 -1062 -1829 -970 440 920 3752 900000 900000 900000 -50 1166 2241 -4736 545 71 2280 1109 202 1191 900000 610 900000 -1103 900000 1413 1964 1349 2316 2181 2226 2307 2530 2624 2286 2017 2666 1205 3609 1699 692 1127 1727 2805 3175 -2160 1310 3622 2597 3966 3609 -520 2926 1191 1839 2846 816 3035 3599 1168 782 1884 -924 -62 -1005 -2803 1711 1083 -395 -5159 -402 -3356 -1161 4897 2109 1560 414 -1509 -5486 -1360 1345 -412 -757 -2657 -1690 3305 -2449 -684 -3171 -1619 -4129 -4112 -1425 -1183 -4569 1506 338 912 2321 852 -1147 1548 -343 -1955 2382 -4167 2641 -51 3334 7147 2013 1853 1044 -3481 4290 -1142 1542 -2139 -63 -1880 -1062 -533 3129 83 -10 2435 -363 364 -3810 -1740 SS 20250826T123116.5Z 9369.521719 54 1 54.08 2 78.67 84.66 117.34 81.79 0.00 1 0.00 1 0 25 2.926e-01 1.004e-02 1.154e-01 2.783e-03 5.592347e-01 1.510559e-03 7.269919e-03 -6.000000e+00 1.708969e-01 229.22 -2.00 3.24 -2.00 321.03 0.00e+00 2.335004e-03 7.150884e-04 7.457025e-03 -6.000000e+00 7.847540e-03 294.27 -2.00 20.00 -2.00 320.29 0.00e+00 4.915 0.001 302.00 328.00 3 1.6609e+00 5.2779e-03 6.8306e-02 -6.0000e+00 4.2430e-01 -2.4258e-02 7.0400e-03 5.9163e-02 -6.0000e+00 4.5778e-01 -7.4331e-02 6.4026e-03 1.8529e-02 -6.0000e+00 2.7439e-01 2.2664e-02 3.1164e-03 6.4199e-03 -6.0000e+00 1.1855e-01 4.4698e-04 6.2152e-04 8.3848e-05 7.5657e-05 -6.0000e+00 8.1539e-03 1.9084e-02 0.0000e+00 12 9 8 11 4 0 25.09 32.80 0.53 0.01908 0.02375 129 14 1 5 0 419.170 40.75 20.01 32.80 32.14 4.2 1030.71 -95696 -124469 -93164 -131858 -133874 -110295 -75362 -59575 -46849 -33862 -72047 -33644 -64577 -47344 -41276 -46220 8491 -19041 2315 -42466 -14880 22425 -13513 -15989 -8272 923 -1969 -23832 -11032 -4472 -20181 -22502 6436 8549 -10728 -10973 -15025 -15879 -7771 802 4027 -2074 911 -3701 7216 -5270 1650 2014 -398 -8 2251 2564 5170 7225 2125 3198 2295 2361 -1441 238 669 4724 4433 5800 2402 -524 1098 350 656 1337 3244 2713 1804 690 170 -227 -2405 -4215 -4964 -2199 -2030 -1301 -2064 -2154 -464 62 1243 1582 2670 1020 -47 -168 -2322 -1496 -883 -1407 -547 53 129 -772 -1192 -2161 -1895 -1511 -1288 -1390 -762 -421 205 1472 1893 1510 1487 682 -290 -876 2 -66 635 987 356 912 1032 145 78 -902 -1490 -311 -79 -433 -582 -831 -524 -479 -204 -22 -67 839 517 198 64 -111 -295 -661 -1351 -805 -1659 -1586 -1007 -521 -397 -312 -217 -711 -249 -797 -619 -631 -890 107 -348 37 -1132 -312 326 -293 -387 -200 22 -54 -796 -314 -125 -761 -1020 252 357 -533 -536 -832 -1039 -572 66 364 -216 97 -428 760 -642 191 238 -50 -1 317 402 864 1288 426 662 497 515 -321 51 147 1082 1145 1659 757 -167 335 109 218 505 1351 1208 818 305 70 -85 -845 -1476 -1880 -942 -1015 -739 -1311 -1461 -331 47 993 1309 2216 842 -37 -123 -1641 -1041 -659 -1203 -534 53 144 -892 -1323 -2231 -1959 -1523 -1382 -1599 -835 -490 256 2003 2833 2425 2420 1086 -442 -1270 2 -97 985 1616 598 1494 1639 226 116 -1306 -2093 -433 -120 -736 -1088 -1673 -1103 -1059 -441 -51 -160 2021 1269 476 146 -265 -679 SS 20250826T123711.3Z 9369.525825 57 1 53.94 2 77.40 85.37 116.13 82.61 0.00 1 0.00 1 0 25 2.116e-01 9.756e-03 5.926e-02 1.732e-03 5.173081e-01 9.174416e-04 6.522054e-03 -6.000000e+00 1.236040e-01 229.22 -2.00 3.24 -2.00 320.68 0.00e+00 1.896201e-03 3.889709e-04 5.685553e-03 -6.000000e+00 5.675742e-03 294.27 -2.00 20.00 -2.00 319.92 0.00e+00 4.454 0.001 302.00 328.00 3 1.4564e+00 3.0134e-03 5.8372e-02 -6.0000e+00 3.0688e-01 -3.9159e-02 3.9075e-03 4.6295e-02 -6.0000e+00 3.3109e-01 -2.8749e-02 3.4613e-03 1.5626e-02 -6.0000e+00 1.9846e-01 1.1293e-03 1.7252e-03 4.9732e-03 -6.0000e+00 8.5746e-02 8.7730e-04 5.2933e-04 5.1535e-05 6.7100e-05 -6.0000e+00 5.8971e-03 1.8714e-02 0.0000e+00 12 9 8 11 4 0 16.93 32.87 0.46 0.01871 0.02269 194 22 1 5 0 278.010 40.75 20.01 32.87 32.59 4.2 1032.60 -110968 -96279 -65506 -39457 -24266 -78992 -68779 -58100 -38673 -59905 -55347 -31889 -60529 -23044 -38127 -20881 -21756 -17707 -15625 -14812 -5986 -349 -24428 -10118 3082 -9265 -6935 -7977 -14095 -7921 2918 -9377 -9504 -4590 -4280 -14110 -10313 -5386 1247 -138 516 2880 -386 4272 -1221 3935 810 -910 594 -950 2110 2986 656 2956 2154 2105 2008 881 1033 1549 2045 1264 3258 4818 2097 1714 -1297 -947 484 1997 1543 1587 1095 1825 -667 -1237 -2468 -3743 -3536 -1870 -1590 -1562 -1901 -1952 -586 119 787 1823 1748 1765 391 -263 -1355 -1650 -1805 -1196 -724 1007 358 -550 -1024 -1908 -2057 -1650 -1106 -1784 -906 -253 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