File name: Pandora85s1_NewOrleansLA-XULA_20240821_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240822T060755.2Z 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_20240821_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: 20240821 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 20240821T121538.3Z 8999.510860 227 1 53.48 2 81.52 81.17 75.64 256.21 0.00 1 0.00 1 0 17 4.759e-01 3.285e-02 1.879e-01 5.314e-03 7.195794e-01 3.013303e-03 7.694170e-03 -6.000000e+00 2.805619e-01 229.35 -2.00 3.24 -2.00 321.34 0.00e+00 -7.497495e-03 1.606026e-03 5.486642e-03 -6.000000e+00 1.969591e-02 294.42 -2.00 20.00 -2.00 320.64 0.00e+00 6.377 0.003 302.00 328.00 3 2.1343e+00 1.1163e-02 8.0891e-02 -6.0000e+00 6.8963e-01 4.0366e-01 1.5052e-02 6.1320e-02 -6.0000e+00 7.4974e-01 -7.0885e-01 1.3150e-02 1.7340e-02 -6.0000e+00 4.5205e-01 3.0078e-01 6.2554e-03 1.3840e-02 -6.0000e+00 1.9695e-01 5.8114e-05 -1.3038e-03 1.5314e-04 6.6950e-05 -6.0000e+00 1.4051e-02 -2.1182e-02 12 8 8 10 0 0 39.02 26.95 0.85 -0.02118 -0.03098 32 4 1 5 0 1671.070 34.25 20.01 26.95 32.55 21.1 1015.22 900000 900000 -71515 21551 50318 900000 -179495 -134123 -156083 -168163 900000 900000 900000 900000 900000 900000 -25368 109680 33915 900000 120766 80991 40654 900000 73543 900000 900000 900000 900000 900000 -82640 900000 31163 -43477 -56397 1175 56 23341 55749 109946 201757 85703 900000 20503 17046 7657 900000 96892 11374 66702 34907 74639 -1037 -21307 73013 32461 8077 15001 35574 -3536 -3351 56082 -7794 14855 4861 35689 -12916 26655 7145 8778 18458 21472 -11093 5272 4841 1424 -1641 -1597 337 13730 -6928 633 -5957 -13231 3440 5899 1216 2708 3647 -3353 7752 -3746 -826 -6449 1618 -9740 -1282 -1434 -1840 -2596 -736 -3556 -872 -2720 -2808 -4766 -2679 1187 1004 1302 782 4598 2910 2427 -449 -1517 -1438 -3663 -2228 -927 3015 2081 4027 525 471 1063 -2718 -107 -2100 1055 263 591 42 725 -312 413 -382 1181 1008 82 954 -1582 -1569 -1229 900000 900000 -1041 121 260 900000 -6235 -3337 -5568 -7578 900000 900000 900000 900000 900000 900000 -643 772 541 900000 850 836 630 900000 1101 900000 900000 900000 900000 900000 -5508 900000 982 -3233 -4805 53 3 976 2044 2895 2500 3717 900000 1810 1531 743 900000 3852 1092 3857 3010 4856 -160 -4390 6371 4509 1501 2665 5033 -705 -647 6168 -1791 3083 1235 6800 -3541 5464 1885 2583 5661 6940 -4640 1819 1561 470 -502 -467 101 4140 -2777 275 -3154 -8211 1925 3464 796 1825 2486 -2427 4781 -2416 -491 -4002 989 -7630 -986 -1282 -1888 -2873 -787 -3642 -784 -2316 -2475 -4631 -2690 1220 1120 1486 1017 6395 4347 3655 -674 -2191 -2015 -5359 -3385 -1370 4755 3252 5934 777 674 1461 -3754 -141 -3033 1687 444 1097 78 1418 -659 873 -852 2647 2299 187 2048 -3481 -3251 -2477 SS 20240821T122856.0Z 8999.520092 232 1 53.95 2 78.67 82.76 78.33 258.03 0.00 1 0.00 1 0 25 2.837e-01 1.376e-02 4.500e-02 1.660e-03 5.631380e-01 8.535092e-04 6.646874e-03 -6.000000e+00 1.622397e-01 229.35 -2.00 3.24 -2.00 320.12 0.00e+00 1.978453e-03 3.095211e-04 4.077492e-03 -6.000000e+00 7.516826e-03 294.42 -2.00 20.00 -2.00 319.28 0.00e+00 4.914 0.001 302.00 328.00 3 1.6447e+00 2.6082e-03 5.8880e-02 -6.0000e+00 4.0289e-01 -1.8289e-02 3.2307e-03 3.7009e-02 -6.0000e+00 4.3680e-01 -5.8962e-02 2.7301e-03 1.4508e-02 -6.0000e+00 2.6172e-01 1.5771e-02 1.4051e-03 4.0297e-03 -6.0000e+00 1.1163e-01 4.5363e-04 -2.7687e-04 4.5531e-05 5.3826e-05 -6.0000e+00 7.7064e-03 -2.1874e-02 12 8 8 10 0 0 22.45 27.03 0.54 -0.02187 -0.02395 116 13 1 5 0 465.010 34.25 20.01 27.03 33.47 21.3 1015.43 900000 -101394 -105995 -83472 -103447 -915 -120539 -104927 -104490 -102170 -41193 -53446 6316 -12432 -2584 107934 -36022 -17744 -6526 4846 -8529 -12824 -15668 6590 -12933 10162 5489 11077 -13179 25452 -33100 17200 -12642 -15797 -19190 -15506 -10705 -12229 -6476 5389 9132 4091 11129 -921 -444 2824 12157 4778 -1237 322 2432 8032 -218 -1538 6431 3259 1453 834 1365 -2380 -614 4008 1253 2931 3655 3812 -1860 988 -313 2508 2854 3029 -155 1415 -651 -1335 -2855 -3805 -3745 -2261 -3580 -1493 -1994 -3131 -575 582 565 1568 1815 1120 2007 70 -765 -2471 -1688 -2550 -648 99 582 -204 -387 -1907 -2175 -2151 -1247 -1697 -1235 27 483 1322 1848 2437 2084 1424 60 -895 -507 -585 -113 477 756 564 1190 801 176 71 -1445 -1017 -372 -156 -292 -599 -671 -755 -460 20 -2 676 873 597 329 -335 -755 -299 900000 -1592 -1956 -1270 -1792 -5 -2420 -2021 -2300 -2464 -573 -891 69 -205 -49 821 -1335 -606 -219 155 -329 -523 -670 243 -634 424 252 481 -700 923 -2411 897 -1033 -1509 -1929 -1433 -984 -1310 -794 721 1381 651 1756 -171 -84 524 2102 906 -257 69 548 1912 -62 -486 2028 1115 483 285 459 -812 -225 1366 490 1275 1732 1820 -904 464 -156 1261 1639 1884 -102 900 -398 -748 -1467 -2031 -2064 -1292 -2443 -1070 -1619 -2587 -492 531 549 1482 1752 1081 1950 64 -665 -2114 -1499 -2412 -692 113 710 -266 -493 -2289 -2514 -2341 -1403 -2075 -1495 34 654 1842 2702 3855 3257 2203 93 -1334 -765 -857 -173 778 1215 901 1921 1260 268 103 -2177 -1486 -573 -256 -506 -1077 -1218 -1435 -887 41 -5 1419 1867 1272 674 -684 -1474 -595 SS 20240821T123453.6Z 8999.524232 235 1 53.88 2 77.39 83.47 79.54 258.83 0.00 1 0.00 1 0 17 1.753e-01 1.253e-02 1.930e-02 1.164e-03 5.148452e-01 5.941377e-04 5.999098e-03 -6.000000e+00 1.002713e-01 229.35 -2.00 3.24 -2.00 319.66 0.00e+00 2.028272e-03 1.810983e-04 3.002432e-03 -6.000000e+00 4.645464e-03 294.42 -2.00 20.00 -2.00 318.76 0.00e+00 4.452 0.001 302.00 328.00 3 1.4907e+00 1.7358e-03 5.2296e-02 -6.0000e+00 2.4901e-01 -4.2151e-02 2.0841e-03 3.0382e-02 -6.0000e+00 2.6995e-01 -2.2820e-02 1.6413e-03 1.3037e-02 -6.0000e+00 1.6174e-01 1.6879e-03 8.6133e-04 3.2564e-03 -6.0000e+00 6.9001e-02 8.6074e-04 -2.8268e-04 3.2212e-05 4.3324e-05 -6.0000e+00 4.7619e-03 -2.2818e-02 12 8 8 10 0 0 46.41 27.08 0.43 -0.02282 -0.02494 173 19 1 5 0 311.430 34.25 20.01 27.08 33.85 21.3 1015.46 900000 -64526 -38853 -59358 -58949 -38542 -74119 -77973 -76635 -71418 -20544 -33524 -14452 -17932 -10756 25057 -23499 -7900 -7611 -4389 -2761 -12571 -10622 -2773 -6844 870 -773 3971 -9888 -1003 -16498 3170 -7384 -7240 -10056 -11350 -9184 -9422 -2691 2506 3795 2453 5424 281 1819 2047 5777 2001 -679 -164 2170 3669 36 591 3562 2151 1397 611 1040 -594 -254 2355 2101 2849 3441 2293 -622 60 -569 1290 2075 2050 885 1137 31 -970 -2910 -3874 -4497 -2302 -2907 -1776 -1882 -2797 -1191 11 710 1335 2132 1501 1466 356 -1002 -2545 -1716 -1910 -902 238 670 105 -524 -1525 -2478 -2085 -1178 -1620 -757 -182 326 1197 1777 2394 2052 1380 67 -709 -514 -318 76 606 757 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