File name: Pandora85s1_NewOrleansLA-XULA_20250823_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T091651.2Z 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_20250823_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: 20250823 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 20250823T121623.8Z 9366.511387 52 1 54.24 2 81.55 81.84 85.37 80.05 0.00 1 0.00 1 0 17 5.343e-01 2.749e-02 3.824e-01 1.388e-02 6.971306e-01 8.152386e-03 9.092778e-03 -6.000000e+00 3.165806e-01 229.32 -2.00 3.24 -2.00 321.90 0.00e+00 1.265259e-02 4.891379e-03 1.127648e-02 -6.000000e+00 1.682285e-02 294.38 -2.00 20.00 -2.00 321.33 0.00e+00 6.396 0.003 302.00 328.00 3 2.1578e+00 3.3672e-02 9.0649e-02 -6.0000e+00 7.8557e-01 6.4483e-01 4.5063e-02 7.5365e-02 -6.0000e+00 8.5063e-01 -9.8482e-01 3.5447e-02 3.1600e-02 -6.0000e+00 5.0743e-01 4.0563e-01 1.6394e-02 6.2833e-03 -6.0000e+00 2.2139e-01 5.0918e-05 4.0892e-05 4.2616e-04 2.4934e-04 -6.0000e+00 1.5608e-02 1.6845e-02 0.0000e+00 12 9 8 11 4 0 42.28 33.24 0.79 0.01684 0.01715 30 3 1 5 0 1807.760 41.00 20.00 33.24 32.25 4.1 1030.91 900000 900000 -104739 -60327 -104254 900000 -109263 -182708 -95306 103712 900000 -91279 -1247 -50175 900000 54454 36199 100824 47964 900000 75597 98600 66305 -61514 74003 -45528 900000 900000 -775 900000 49437 54993 900000 144480 95226 122548 823 110697 72931 33045 35478 62537 72701 85402 199697 201185 128153 17160 20600 12744 2127 48807 51375 22863 37477 66126 35891 34367 33120 52089 38981 10311 32818 -13247 41795 33729 16852 13289 8882 -1636 9659 15741 4939 9958 7471 -4819 889 -23046 -8106 2242 -10072 -3258 -4115 7105 -6355 2699 1352 5682 3117 34 -11493 5875 -1807 -6418 -6326 2595 -4918 388 -4034 -2638 260 -524 -2883 2266 -4105 -685 -1274 -1505 -2596 738 1415 2924 -175 -1475 -2336 -1218 966 -2648 19 1763 1659 2434 661 2932 1678 1615 493 -174 287 90 -1686 578 476 493 45 121 63 546 1028 -718 451 -1913 -1294 900000 900000 -4126 -1426 -3286 900000 -3074 -10693 -2574 1401 900000 -2466 -17 -1417 900000 802 711 1362 942 900000 1114 1332 977 -3248 1000 -2012 900000 900000 -20 900000 971 1215 900000 1951 1637 1655 35 1767 1970 1542 1786 2534 2767 2936 2697 2717 2990 1243 1492 1048 212 3356 3722 2358 3497 4709 3481 3334 3131 4362 3791 1448 4166 -3024 5927 5148 2982 2477 1847 -429 2518 4061 1414 2569 1806 -1178 189 -6163 -2047 605 -3646 -1272 -1806 2975 -3236 1342 717 2993 1705 19 -6706 2690 -854 -3207 -3477 1518 -3640 318 -3879 -2590 239 -445 -2259 1622 -3316 -572 -1134 -1447 -2767 855 1837 4075 -260 -2183 -3345 -1650 1272 -3766 28 2691 2566 3632 968 4076 2271 2115 633 -227 414 149 -3167 1156 1012 1109 109 311 169 1474 2793 -1935 1132 -4627 -2958 SS 20250823T122952.0Z 9366.520741 57 1 54.20 2 78.66 83.46 82.59 81.67 0.00 1 0.00 1 0 25 2.772e-01 1.049e-02 1.701e-01 2.860e-03 5.757191e-01 1.556848e-03 7.265755e-03 -6.000000e+00 1.620182e-01 229.32 -2.00 3.24 -2.00 321.02 0.00e+00 9.739781e-04 7.410379e-04 7.094725e-03 -6.000000e+00 7.439713e-03 294.38 -2.00 20.00 -2.00 320.30 0.00e+00 4.909 0.001 302.00 328.00 3 1.6905e+00 5.4375e-03 6.7991e-02 -6.0000e+00 4.0233e-01 -1.6676e-02 7.3237e-03 5.8681e-02 -6.0000e+00 4.3399e-01 -4.9847e-02 6.7455e-03 1.7848e-02 -6.0000e+00 2.6014e-01 6.3566e-03 3.2737e-03 7.4573e-03 -6.0000e+00 1.1242e-01 4.2351e-04 6.1370e-04 8.4873e-05 6.5345e-05 -6.0000e+00 7.7251e-03 1.7130e-02 0.0000e+00 12 9 8 11 4 0 47.50 33.33 0.53 0.01713 0.02174 119 13 1 5 0 455.380 41.25 20.01 33.33 33.49 4.0 1035.77 21225 -93190 -35831 -72717 -71272 -135070 -116285 -80772 -116694 -41504 11147 -84218 -83039 9333 -61975 1492 -42604 -29895 -25305 -16341 -27614 -19110 -31888 -34725 -27036 -35878 -20422 -18840 -26635 7747 -22053 -8088 12569 -6167 -7222 -2004 -9180 -12398 -4712 -3721 1918 3125 -191 4247 156 -130 526 -3608 -2297 -999 6126 1124 2413 1226 4244 5581 2427 2243 383 801 4089 2793 3620 5081 4683 395 842 -311 1877 178 2835 1671 1580 2891 215 -2095 -4324 -4162 -5013 -535 -1682 -1659 -2738 -2004 -1332 356 531 1994 3019 1423 -507 363 -1109 -2258 -1012 -1612 -692 459 795 -763 -1526 -2790 -1465 -1243 -1346 -1987 -576 -831 475 1655 2200 1556 1523 973 -429 -395 -396 185 552 537 -29 572 655 856 169 -656 -1676 -411 -28 -455 -555 -801 -435 -613 -172 38 -141 809 636 182 100 -145 -326 59 -614 -145 -424 -380 -1336 -1032 -573 -1361 -253 42 -918 -1095 62 -1037 16 -799 -546 -481 -302 -595 -383 -760 -933 -734 -1137 -575 -562 -832 179 -793 -298 435 -282 -328 -85 -456 -747 -322 -306 171 299 -20 439 17 -15 60 -436 -284 -129 808 174 406 228 820 1114 519 486 83 170 858 642 928 1443 1425 124 256 -97 614 68 1182 750 717 1247 88 -797 -1544 -1452 -1893 -225 -837 -946 -1753 -1360 -960 271 428 1644 2496 1170 -399 264 -775 -1586 -758 -1385 -678 464 887 -886 -1709 -2913 -1513 -1250 -1444 -2295 -628 -970 591 2244 3282 2503 2486 1554 -658 -574 -568 272 860 885 -49 940 1043 1318 251 -946 -2357 -571 -42 -775 -1040 -1619 -919 -1365 -372 87 -338 1965 1568 441 231 -319 -753 SS 20250823T123547.8Z 9366.524859 60 1 54.06 2 77.38 84.17 81.37 82.38 0.00 1 0.00 1 0 25 2.052e-01 9.719e-03 7.264e-02 1.863e-03 5.280875e-01 9.965052e-04 6.519715e-03 -6.000000e+00 1.199555e-01 229.32 -2.00 3.24 -2.00 320.74 0.00e+00 1.246035e-03 4.268452e-04 5.534402e-03 -6.000000e+00 5.507993e-03 294.38 -2.00 20.00 -2.00 319.98 0.00e+00 4.449 0.001 302.00 328.00 3 1.5830e+00 3.3034e-03 5.8512e-02 -6.0000e+00 2.9788e-01 -2.8338e-02 4.3042e-03 4.6586e-02 -6.0000e+00 3.2131e-01 -3.3284e-02 3.8182e-03 1.5514e-02 -6.0000e+00 1.9259e-01 2.3748e-03 1.8936e-03 5.4499e-03 -6.0000e+00 8.3238e-02 7.6273e-04 6.1945e-04 5.5580e-05 6.7362e-05 -6.0000e+00 5.7188e-03 1.6431e-02 0.0000e+00 12 9 8 11 4 0 33.52 33.41 0.45 0.01643 0.02109 168 19 1 5 0 321.760 41.25 20.01 33.41 33.88 4.0 1037.21 -77171 -26627 -58946 -91634 -62001 -83438 -10215 -83732 -73289 -67756 -10516 -41620 -41770 -21138 -27896 -42083 -18983 -19203 -27567 -18651 1451 2414 -12209 -15906 -22401 -556 -8690 -12442 -18909 -15030 -2977 -10300 413 1397 -13038 -4950 -10205 -5174 -1530 -450 -404 3299 1523 1907 1083 -111 -499 -90 872 115 899 3232 115 2598 2763 2707 1857 1211 -160 -703 1027 3897 4559 2837 2138 812 1709 -730 905 2410 1915 2364 864 1420 481 -1258 -3283 -4104 -3900 -2401 -2647 -1596 -2208 -1654 -635 154 1358 1444 1724 1371 778 -174 -1501 -1557 -1188 -1269 -679 1147 338 -592 -1242 -1647 -2477 -1520 -1411 -1470 -629 -486 213 1297 1806 1766 1210 947 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