File name: Pandora85s1_NewOrleansLA-XULA_20240804_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240805T061451.1Z 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_20240804_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: 20240804 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 20240804T120555.6Z 8982.504116 52 1 53.25 2 81.72 75.08 82.17 70.86 0.00 1 0.00 1 0 25 7.300e-01 3.890e-02 2.585e-01 6.620e-03 7.573891e-01 3.831528e-03 7.832134e-03 -6.000000e+00 4.346767e-01 229.77 -2.00 3.24 -2.00 321.56 0.00e+00 -6.865319e-03 2.197894e-03 4.869046e-03 -6.000000e+00 2.887008e-02 294.51 -2.00 20.00 -2.00 320.90 0.00e+00 6.510 0.003 302.00 328.00 3 2.2676e+00 1.4893e-02 8.1156e-02 -6.0000e+00 1.0801e+00 4.6610e-01 2.0727e-02 5.8222e-02 -6.0000e+00 1.1786e+00 -7.5281e-01 1.8843e-02 1.8831e-02 -6.0000e+00 7.0981e-01 3.1085e-01 8.7789e-03 1.1851e-02 -6.0000e+00 3.0738e-01 4.1671e-05 -8.8785e-05 1.9050e-04 6.9627e-05 -6.0000e+00 2.0988e-02 -2.2041e-02 12 9 8 11 32 0 49.71 27.20 1.00 -0.02204 -0.02271 26 3 1 5 0 2047.770 34.50 20.00 27.20 33.91 23.8 1010.99 900000 900000 900000 -129469 -77983 900000 -59028 216843 -195728 -164712 900000 900000 900000 900000 900000 900000 31951 900000 900000 900000 900000 34461 26636 900000 900000 900000 900000 -9812 900000 900000 -82077 900000 294356 -32331 -75084 -5181 -707 -10511 150184 104520 141540 270868 315745 -9412 13222 112300 900000 73178 8659 282425 30588 131724 19803 -14376 72961 44329 8861 34595 50810 34254 28714 57433 35508 -25703 31658 41408 -26188 25514 18857 20907 29193 24129 -12953 9084 201 -6132 -16838 7712 -7346 31063 -1645 454 428 -11245 8169 14043 -2691 -877 7696 -6081 7233 -6771 3745 -5318 -1550 -11678 2158 1069 -1051 -3289 -979 -3691 84 -1252 -4139 -3825 1716 -854 -108 3087 -4286 4775 4340 2256 -1393 130 -4029 -2718 -1816 -2899 1775 2635 5109 2412 1709 -223 -3377 1160 -2562 618 1511 -168 76 2772 -1138 311 -740 -917 1738 1885 1196 -3320 -1517 -182 900000 900000 900000 -2572 -820 900000 -483 1394 -8119 -5582 900000 900000 900000 900000 900000 900000 373 900000 900000 900000 900000 463 389 900000 900000 900000 900000 -269 900000 900000 -4556 900000 1892 -1829 -6515 -210 -28 -527 1834 2485 2729 1741 2029 -950 1045 3248 900000 3151 735 1815 2398 4233 2164 -2421 5580 4786 1429 4402 5355 4051 3488 5426 4633 -7037 5412 6547 -7961 4706 3963 4904 7223 6792 -4912 2937 66 -1915 -5270 1819 -2129 7127 -625 179 193 -6209 3957 6892 -1657 -553 4532 -4058 4010 -4027 1910 -2955 -895 -8597 1618 943 -992 -3387 -966 -3471 75 -1049 -3700 -3679 1646 -822 -112 3468 -5897 6683 5946 3168 -1967 172 -5432 -3705 -2586 -4420 2647 3802 7473 3513 2422 -312 -4715 1525 -3788 940 2577 -299 145 5433 -2486 670 -1686 -2135 3994 4267 2765 -7507 -3167 -367 SS 20240804T122019.3Z 8982.514113 57 1 53.84 2 78.70 76.75 79.32 72.47 0.00 1 0.00 1 0 25 2.943e-01 1.384e-02 1.045e-01 1.929e-03 5.831976e-01 1.006085e-03 6.811834e-03 -6.000000e+00 1.688000e-01 229.77 -2.00 3.24 -2.00 320.32 0.00e+00 8.079204e-04 3.883508e-04 4.359529e-03 -6.000000e+00 7.899584e-03 294.51 -2.00 20.00 -2.00 319.49 0.00e+00 4.924 0.001 302.00 328.00 3 1.9027e+00 3.1541e-03 6.0351e-02 -6.0000e+00 4.1967e-01 -3.7572e-02 4.0045e-03 4.0519e-02 -6.0000e+00 4.5498e-01 -4.4516e-02 3.5099e-03 1.5053e-02 -6.0000e+00 2.7283e-01 1.0049e-02 1.7780e-03 4.8116e-03 -6.0000e+00 1.1671e-01 3.4124e-04 -1.3312e-04 5.3384e-05 5.6003e-05 -6.0000e+00 8.0032e-03 -2.2829e-02 12 8 8 10 0 0 28.36 27.27 0.58 -0.02283 -0.02383 94 10 1 5 0 572.650 34.50 20.01 27.27 34.73 23.8 1011.03 900000 -48767 900000 -109483 -68938 92582 -103286 -74656 -149115 -124648 -92086 -1663 -68574 54689 -27452 900000 -31556 -8942 19962 14133 70208 -37496 -7179 26259 7480 -2291 23996 60333 -2176 -3114 -30475 27403 -5830 -10259 -24607 -20638 -9888 -22328 -25 1583 6026 9342 10272 -3918 -628 -9735 15047 2420 -1116 2605 1236 7150 1214 -1444 6346 3796 1566 3455 1350 1580 1928 3080 116 157 2287 3963 -4527 478 1956 2103 3767 3387 -540 1435 -387 -2402 -4564 -4051 -3480 -908 -1773 -1429 -1376 -3300 -531 1038 155 1848 2216 1297 1585 -384 -1001 -2590 -1936 -2891 -221 435 -10 145 -329 -1898 -1889 -2005 -1409 -1604 -155 -354 440 1285 1293 2520 2336 1390 90 -974 -1120 -607 108 261 910 652 1049 1030 124 39 -1562 -810 -430 -458 -341 -798 -735 -504 -580 21 -142 300 1099 855 228 -429 -477 -201 900000 -330 900000 -1585 -622 174 -1301 -800 -3898 -2883 -1645 -13 -1225 360 -516 900000 -878 -220 405 327 977 -1558 -225 642 243 -89 754 1316 -85 -124 -1782 1067 -369 -772 -2179 -1680 -757 -2230 -2 187 802 1328 1541 -644 -101 -1754 2380 403 -199 468 244 1493 298 -399 1756 1136 500 1110 438 500 609 1019 44 62 973 1678 -2013 202 852 1035 2091 1892 -323 823 -213 -1326 -2327 -1957 -1731 -503 -1079 -1003 -1012 -2672 -444 922 138 1698 2076 1217 1412 -347 -856 -2182 -1700 -2700 -232 489 -11 184 -410 -2236 -2141 -2141 -1559 -1924 -181 -442 584 1751 1858 3900 3751 2222 138 -1432 -1685 -926 163 420 1510 1072 1664 1586 185 59 -2320 -1165 -654 -743 -583 -1416 -1378 -942 -1154 43 -301 650 2308 1867 479 -860 -954 -393 SS 20240804T122618.4Z 8982.518268 60 1 54.12 2 77.44 77.43 78.12 73.13 0.00 1 0.00 1 0 25 1.962e-01 1.228e-02 2.747e-02 1.253e-03 5.345494e-01 6.435504e-04 6.176740e-03 -6.000000e+00 1.123762e-01 229.77 -2.00 3.24 -2.00 319.79 0.00e+00 9.718081e-04 2.061645e-04 3.196354e-03 -6.000000e+00 5.200276e-03 294.51 -2.00 20.00 -2.00 318.91 0.00e+00 4.466 0.001 302.00 328.00 3 1.5940e+00 1.9036e-03 5.3350e-02 -6.0000e+00 2.7934e-01 -4.9868e-02 2.3086e-03 3.2690e-02 -6.0000e+00 3.0272e-01 -2.3117e-02 1.8668e-03 1.3320e-02 -6.0000e+00 1.8133e-01 1.9478e-03 9.7362e-04 3.8245e-03 -6.0000e+00 7.7302e-02 7.5089e-04 -2.0293e-04 3.4626e-05 4.1662e-05 -6.0000e+00 5.3285e-03 -2.3416e-02 12 8 8 10 0 0 1.38 27.32 0.49 -0.02342 -0.02494 159 18 1 5 0 340.320 34.50 20.01 27.32 35.02 23.8 1011.03 900000 -69959 31343 -70171 -73082 -51178 -71636 -58964 -92780 -66825 -60181 -45500 -43813 -15475 -29759 24579 -17950 -5946 -2679 -2344 8664 -24399 -10962 -176 -2388 4878 -1849 6063 -10342 -7739 -15077 3452 -4065 -4816 -12679 -13970 -8545 -10802 -4303 269 2832 3610 4057 -808 1618 -1699 5665 2529 -135 1631 1310 2941 1279 683 3369 2878 1029 1946 223 78 1401 2583 1341 2817 2981 2329 -1283 -725 -421 1840 2752 1956 773 1434 -12 -1177 -2861 -3684 -4160 -2101 -2110 -1845 -1616 -2809 -1042 272 349 1539 2041 1536 1370 -170 -909 -2231 -1481 -2266 -664 351 525 -10 -525 -1674 -2506 -1959 -1114 -1475 -696 -57 240 1153 1592 2317 2154 1340 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