File name: Pandora85s1_NewOrleansLA-XULA_20240806_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240807T061405.3Z 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_20240806_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: 20240806 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 20240806T120700.4Z 8984.504866 51 1 55.16 2 81.71 75.71 104.50 68.34 0.00 1 0.00 1 0 25 6.037e-01 4.662e-02 2.131e-01 7.441e-03 7.577065e-01 4.380152e-03 7.971868e-03 -6.000000e+00 3.633271e-01 229.73 -2.00 3.24 -2.00 321.52 0.00e+00 -1.075484e-02 2.469873e-03 1.158919e-03 -6.000000e+00 2.551672e-02 294.54 -2.00 20.00 -2.00 320.85 0.00e+00 6.505 0.003 302.00 328.00 3 2.4453e+00 1.7003e-02 7.4286e-02 -6.0000e+00 8.9813e-01 7.4536e-01 2.2744e-02 3.7097e-02 -6.0000e+00 9.8286e-01 -1.0874e+00 1.8400e-02 1.9850e-02 -6.0000e+00 5.9216e-01 4.4735e-01 8.6279e-03 9.8428e-03 -6.0000e+00 2.5697e-01 3.2546e-05 -7.5715e-04 2.2001e-04 1.2661e-04 -6.0000e+00 1.7422e-02 -2.2871e-02 12 8 8 10 0 0 47.71 27.28 1.27 -0.02287 -0.02856 20 2 1 5 0 2757.870 34.50 20.00 27.28 34.31 23.9 1014.46 900000 900000 900000 900000 101348 900000 -93312 140668 -143854 -57122 900000 900000 -1702 900000 900000 900000 900000 92679 900000 900000 900000 22640 900000 900000 900000 900000 900000 900000 256305 900000 -10104 900000 900000 38332 -60165 63398 51588 59314 101467 143400 329202 900000 900000 50271 4041 -28362 900000 78776 19657 900000 53458 170486 52882 -17301 144402 80528 11941 57895 71062 52095 35738 94823 -2110 -30036 9157 60745 -22953 40438 13607 35009 40494 27852 -12470 13401 196 -6515 -17701 1076 -4895 43653 2456 4741 656 -15563 10131 15160 -2485 845 8588 -6590 11402 -4967 -129 -8494 4148 -16259 3332 -265 -3503 -3637 734 -5419 1355 482 -4457 -4101 163 -458 -827 784 -4119 4931 4721 2987 -819 -171 -4658 -3422 -3290 -4275 2699 2891 5050 3481 691 469 -2337 2966 -2278 734 1397 666 1187 4845 -1572 309 -1147 -872 1496 1214 511 -3623 -1354 -587 900000 900000 900000 900000 731 900000 -3427 1015 -11040 -2023 900000 900000 -40 900000 900000 900000 900000 1459 900000 900000 900000 713 900000 900000 900000 900000 900000 900000 1849 900000 -471 900000 900000 1559 -6472 2013 1861 2225 3002 3414 2375 900000 900000 3917 481 -4093 900000 4149 1900 900000 4127 4551 5036 -3607 6459 7205 2214 6892 7178 5976 4616 6910 -443 -8530 2127 8546 -6579 6827 3181 7477 9349 7877 -4899 4312 66 -2110 -5734 276 -1392 8787 886 1773 291 -8840 4731 7219 -1496 512 4895 -4309 5908 -2821 -66 -4708 2174 -11987 2354 -226 -3220 -3577 678 -5403 1135 378 -3794 -3755 151 -454 -817 850 -5329 6499 6600 4272 -1181 -234 -6475 -4798 -4848 -6218 4074 4258 6977 4734 934 613 -3047 3603 -3142 1128 2228 1179 2240 9345 -3211 665 -2620 -2022 3434 2756 1106 -7624 -2812 -1178 SS 20240806T122122.3Z 8984.514842 56 1 54.05 2 78.69 77.39 101.71 70.36 0.00 1 0.00 1 0 25 3.277e-01 1.418e-02 1.186e-01 2.036e-03 5.719918e-01 1.063887e-03 6.688085e-03 -6.000000e+00 1.883940e-01 229.73 -2.00 3.24 -2.00 320.27 0.00e+00 1.416641e-03 4.032608e-04 4.125724e-03 -6.000000e+00 9.375399e-03 294.54 -2.00 20.00 -2.00 319.43 0.00e+00 4.921 0.001 302.00 328.00 3 2.0145e+00 3.3130e-03 5.9516e-02 -6.0000e+00 4.6768e-01 -2.6236e-02 4.1879e-03 3.8590e-02 -6.0000e+00 5.0707e-01 -3.7759e-02 3.6556e-03 1.4994e-02 -6.0000e+00 3.0333e-01 5.2398e-03 1.8595e-03 4.2567e-03 -6.0000e+00 1.3024e-01 3.0678e-04 -3.1304e-04 5.6564e-05 5.5024e-05 -6.0000e+00 8.9609e-03 -2.3354e-02 12 8 8 10 0 0 11.70 27.34 0.71 -0.02335 -0.02571 81 9 1 5 0 667.240 34.50 20.01 27.34 34.94 23.9 1014.53 900000 117959 900000 -76221 -61432 900000 -142744 -14795 -124836 -144269 -61612 900000 -64570 64445 -12698 183503 -13011 -11898 6896 20737 69605 -33078 -19585 40372 1593 12356 9968 56437 -7281 274 -29196 27552 -643 -8690 -23995 -15935 -13316 -17179 -1160 3580 7345 9582 10640 -3452 -4462 -8245 16554 1941 -3183 6213 1902 8482 1195 -3592 7171 4728 -112 2151 1790 1350 1372 6013 -646 -1400 3018 3891 -4268 954 544 1851 3368 2207 -125 1341 -685 -1696 -3963 -3668 -4771 -598 -2185 -1325 -1662 -3266 -648 1779 666 1324 2248 1124 1996 -302 -1055 -2347 -1456 -3245 -632 608 438 20 -305 -1793 -2002 -2159 -1428 -1510 -378 -125 274 1271 1305 2428 2428 1638 91 -1027 -853 -536 -141 261 828 706 1138 932 187 -114 -1816 -828 -495 -475 -361 -485 -641 -509 -565 -217 -167 450 1072 662 243 -370 -360 -198 900000 234 900000 -862 -561 900000 -2889 -94 -2750 -4352 -868 900000 -1179 409 -219 546 -320 -321 170 477 1036 -1398 -738 905 58 434 378 1344 -315 11 -1767 1121 -40 -673 -2210 -1293 -1099 -1694 -118 429 999 1405 1645 -584 -777 -1517 2674 336 -599 1112 384 1796 302 -1039 2017 1435 -37 715 591 438 446 1975 -253 -574 1301 1682 -1929 407 244 923 1897 1261 -75 779 -382 -942 -2036 -1785 -2424 -332 -1342 -933 -1230 -2652 -545 1571 592 1226 2111 1060 1779 -274 -904 -1971 -1268 -3025 -661 677 520 25 -378 -2228 -2260 -2295 -1570 -1797 -468 -154 362 1715 1957 3717 3848 2577 139 -1572 -1259 -805 -210 413 1354 1144 1780 1418 290 -170 -2666 -1173 -740 -756 -606 -883 -1175 -974 -1098 -450 -347 951 2298 1417 501 -759 -705 -380 SS 20240806T122725.5Z 8984.519045 59 1 53.93 2 77.41 78.08 100.52 71.19 0.00 1 0.00 1 0 25 2.024e-01 1.236e-02 4.812e-02 1.384e-03 5.231117e-01 7.091603e-04 6.048134e-03 -6.000000e+00 1.159235e-01 229.73 -2.00 3.24 -2.00 319.73 0.00e+00 1.452736e-03 2.236946e-04 3.031285e-03 -6.000000e+00 5.365735e-03 294.54 -2.00 20.00 -2.00 318.84 0.00e+00 4.458 0.001 302.00 328.00 3 1.7922e+00 2.0903e-03 5.2731e-02 -6.0000e+00 2.8813e-01 -3.5239e-02 2.5269e-03 3.1318e-02 -6.0000e+00 3.1225e-01 -2.2323e-02 2.0259e-03 1.3143e-02 -6.0000e+00 1.8705e-01 -8.3028e-04 1.0581e-03 3.4661e-03 -6.0000e+00 7.9750e-02 6.2360e-04 -2.7788e-04 3.8413e-05 4.4287e-05 -6.0000e+00 5.4973e-03 -2.3558e-02 12 8 8 10 0 0 11.21 27.38 0.50 -0.02356 -0.02565 127 14 1 5 0 424.560 34.50 20.01 27.38 35.22 23.9 1014.57 900000 -50670 117733 -56866 -55133 21042 -87450 -42002 -87707 -80420 -41374 -12421 -55944 -3947 -16763 29301 -17414 -6430 6934 5451 18721 -21045 -10411 1883 -5232 3057 654 10715 -7300 -4739 -14150 10104 -5998 -4525 -15625 -9934 -9655 -11588 -3320 1936 3735 3199 4596 -867 82 -2380 6062 909 -1614 1166 528 3480 1298 -926 4662 3147 1716 1828 631 257 743 3695 1168 1764 3185 2664 -1721 184 23 903 2400 2130 276 1054 -298 -788 -3013 -3952 -4296 -2010 -2442 -1276 -1615 -3003 -933 545 416 1305 2219 1450 1712 -156 -1173 -2369 -1798 -1985 -714 399 487 12 -354 -1736 -2009 -1905 -1199 -1480 -562 -378 171 1319 1679 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