File name: Pandora85s1_NewOrleansLA-XULA_20240807_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240809T000050.9Z 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_20240807_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: 20240807 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 20240807T120730.6Z 8985.505216 51 1 52.87 2 81.72 76.04 115.40 67.14 0.00 1 0.00 1 0 25 6.670e-01 6.081e-02 2.428e-01 9.563e-03 7.556174e-01 5.654170e-03 8.248195e-03 -6.000000e+00 3.981881e-01 229.71 -2.00 3.24 -2.00 321.51 0.00e+00 1.414469e-02 3.057052e-03 1.271916e-03 -6.000000e+00 2.649166e-02 294.55 -2.00 20.00 -2.00 320.84 0.00e+00 6.508 0.003 302.00 328.00 3 2.5289e+00 2.0981e-02 7.4511e-02 -6.0000e+00 9.8013e-01 1.1592e+00 2.6695e-02 3.9785e-02 -6.0000e+00 1.0692e+00 -1.4217e+00 2.0171e-02 2.0795e-02 -6.0000e+00 6.4314e-01 5.5418e-01 9.8907e-03 1.5785e-02 -6.0000e+00 2.8088e-01 2.4015e-05 -1.0686e-03 2.7751e-04 1.8066e-04 -6.0000e+00 1.9879e-02 -2.0714e-02 12 8 8 10 0 0 60.53 27.29 1.39 -0.02071 -0.02874 15 2 1 5 0 3524.180 34.50 20.01 27.29 34.21 21.1 1011.27 900000 900000 900000 900000 175860 900000 -54865 140507 -66756 -33322 128852 900000 12514 900000 118533 900000 103769 162452 900000 900000 900000 74790 900000 900000 900000 900000 900000 900000 900000 900000 -655 900000 42718 75062 -56737 132314 81513 64854 900000 257185 303122 900000 900000 83428 25930 -36535 900000 136016 30171 900000 73574 900000 68368 -19032 202761 90792 12156 71347 122692 54512 34963 135578 10484 -40068 -829 92200 -21552 86989 26017 42231 39722 58944 -23264 16493 22135 -10943 -18759 7657 -5609 42866 11433 12455 3850 -18084 16442 25647 -1697 -757 10893 -10014 18533 -8190 2639 -2659 3804 -20463 1979 2084 -3077 -1936 2084 -6400 1168 1306 -8155 -5080 1764 -1468 270 2704 -5448 6691 8194 4223 -2645 -90 -7238 -5558 -5799 -5096 4073 5190 7047 3141 2594 -488 -5399 3049 -5040 -364 2556 1608 2151 6332 -2047 928 -2373 216 1391 1502 922 -5007 -1568 284 900000 900000 900000 900000 1631 900000 -3794 1303 -4785 -1658 1195 900000 422 900000 2199 900000 2975 2740 900000 900000 900000 2775 900000 900000 900000 900000 900000 900000 900000 900000 -41 900000 2413 3690 -9186 3191 3175 3188 900000 2385 2812 900000 900000 5339 2934 -6993 900000 5173 3386 900000 5869 900000 6785 -4802 5830 8084 2368 7544 7397 6169 4735 7042 2120 -13886 -236 10519 -7416 10086 5767 8853 9616 12520 -10279 5125 5934 -3624 -6003 1804 -1597 8787 3839 4817 1836 -10506 7824 11823 -985 -452 5869 -6561 9523 -4634 1390 -1455 2093 -15063 1372 1693 -3025 -2016 2046 -6325 954 980 -6897 -4480 1532 -1406 277 3030 -6914 8383 10678 5738 -3728 -118 -9930 -7698 -8508 -7870 5887 7237 9227 4135 3310 -675 -6961 3874 -6880 -546 4228 2964 4224 11642 -4369 2059 -5675 513 3300 3511 2053 -11028 -3125 540 SS 20240807T122152.2Z 8985.515188 56 1 53.90 2 78.69 77.71 112.64 69.42 0.00 1 0.00 1 0 17 3.771e-01 1.565e-02 1.368e-01 2.242e-03 5.714213e-01 1.177088e-03 6.958353e-03 -6.000000e+00 2.167854e-01 229.71 -2.00 3.24 -2.00 320.32 0.00e+00 3.567315e-03 4.551750e-04 4.731714e-03 -6.000000e+00 1.040190e-02 294.55 -2.00 20.00 -2.00 319.49 0.00e+00 4.921 0.001 302.00 328.00 3 2.1818e+00 3.6840e-03 6.0095e-02 -6.0000e+00 5.3805e-01 -5.6144e-03 4.6534e-03 3.9763e-02 -6.0000e+00 5.8317e-01 -7.7691e-02 4.0286e-03 1.6073e-02 -6.0000e+00 3.4910e-01 2.3828e-02 2.0486e-03 3.7688e-03 -6.0000e+00 1.4961e-01 2.5834e-04 -2.4750e-04 6.2346e-05 7.1123e-05 -6.0000e+00 1.0286e-02 -2.4598e-02 12 8 8 10 0 0 32.24 27.37 0.67 -0.02460 -0.02646 71 8 1 5 0 759.090 34.50 20.01 27.37 35.02 21.2 1011.23 900000 1836 900000 -81305 -97885 900000 -141479 -60626 -140166 -138767 -75797 141903 -63133 900000 -44569 227437 -35622 -20270 11009 31494 89629 -34613 -7760 54621 10605 20457 41658 53745 -3839 409 -26327 43144 -15897 -10507 -27354 -23500 -13884 -19620 -3244 4513 9302 11663 16244 -5077 -654 -8989 16791 5878 -1046 8387 1833 11449 1629 -5434 8780 7218 172 3015 2598 133 311 8598 -1389 -2191 1856 5892 -4767 2684 1114 2409 3616 3316 -1997 1427 -104 -2531 -4007 -3531 -5017 -457 -2400 -1479 -1096 -3486 -13 1429 260 865 2821 756 2362 -804 -1018 -2871 -1770 -3143 -515 328 -65 250 -86 -1982 -2643 -2123 -1907 -1630 -80 -315 318 1605 1094 2482 2495 1610 -81 -953 -954 -528 -304 -123 1296 518 1378 864 425 209 -1661 -852 -960 -261 -230 -160 -587 -250 -759 -93 -273 466 977 569 242 -436 -424 -259 900000 9 900000 -1048 -1390 900000 -2998 -636 -3706 -4033 -1242 310 -1145 900000 -1081 497 -1129 -611 267 667 1116 -1513 -263 1062 348 648 1120 1280 -157 16 -1530 1489 -1157 -822 -2582 -2033 -1135 -1942 -329 519 1195 1611 2282 -841 -117 -1614 2627 1047 -187 1570 360 2281 396 -1546 2340 2050 54 947 811 42 98 2637 -526 -869 778 2402 -2082 1082 476 1144 1944 1941 -1172 857 -60 -1353 -1966 -1638 -2442 -243 -1532 -999 -832 -2715 -10 1211 237 824 2701 734 2152 -702 -835 -2320 -1480 -3003 -516 375 -80 322 -109 -2376 -3082 -2314 -2160 -1866 -95 -398 403 2202 1584 3863 4021 2579 -127 -1406 -1361 -765 -464 -199 2040 813 2195 1342 638 302 -2493 -1236 -1395 -422 -392 -280 -1093 -485 -1498 -186 -575 996 2121 1233 505 -908 -842 -505 SS 20240807T122755.9Z 8985.519397 59 1 54.24 2 77.41 78.41 111.46 70.35 0.00 1 0.00 1 0 17 1.815e-01 1.279e-02 3.640e-02 1.497e-03 5.250081e-01 7.688525e-04 6.071088e-03 -6.000000e+00 1.039806e-01 229.71 -2.00 3.24 -2.00 319.81 0.00e+00 1.523265e-03 2.487195e-04 3.137841e-03 -6.000000e+00 4.870995e-03 294.55 -2.00 20.00 -2.00 318.92 0.00e+00 4.457 0.001 302.00 328.00 3 1.9490e+00 2.2785e-03 5.2891e-02 -6.0000e+00 2.5842e-01 -4.4852e-02 2.7643e-03 3.1759e-02 -6.0000e+00 2.8004e-01 -2.3199e-02 2.2369e-03 1.3243e-02 -6.0000e+00 1.6786e-01 9.3900e-04 1.1679e-03 3.5425e-03 -6.0000e+00 7.1913e-02 5.3541e-04 -3.0394e-04 4.1493e-05 4.2306e-05 -6.0000e+00 4.9300e-03 -2.5258e-02 12 8 8 10 0 0 10.97 27.42 0.53 -0.02526 -0.02754 110 12 1 5 0 493.060 34.50 20.01 27.42 35.40 21.1 1011.29 900000 -19515 900000 -58399 -55429 44905 -93382 -46919 -87997 -85327 -42774 -3566 -53882 7955 -23442 12021 -22691 -14198 1562 5569 26287 -20661 -6019 -633 -2039 5227 5774 14859 -9528 -10632 -16955 14259 -6341 -4108 -18339 -11453 -8556 -14927 -2521 999 3453 3952 7492 -468 -575 -2987 8311 1500 -1034 1936 935 4164 2246 -2247 4566 3282 1095 780 906 238 650 3178 1466 1257 2755 2547 -1882 263 132 1946 2888 2355 -275 1452 81 -1286 -3108 -3493 -4283 -2314 -1820 -1412 -1572 -3163 -832 649 217 1375 2156 1755 1703 -61 -1297 -2617 -1253 -2397 -705 510 341 127 -444 -1512 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