File name: Pandora85s1_NewOrleansLA-XULA_20260106_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T100157.9Z 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_20260106_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: 20260106 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 20260106T134212.4Z 9502.570976 275 1 54.30 2 82.27 121.54 67.94 272.34 0.00 1 0.00 1 0 25 3.989e-01 2.841e-02 4.096e-01 2.129e-02 6.302652e-01 1.212001e-02 8.839804e-03 -6.000000e+00 2.335287e-01 224.32 -2.00 3.24 -2.00 321.72 0.00e+00 1.400321e-02 6.481919e-03 1.005576e-02 -6.000000e+00 1.084654e-02 285.24 -2.00 20.00 -2.00 321.20 0.00e+00 6.917 0.004 302.00 328.00 3 2.2033e+00 4.4685e-02 8.7036e-02 -6.0000e+00 5.7686e-01 5.5065e-01 5.7492e-02 5.8428e-02 -6.0000e+00 6.2770e-01 -7.7696e-01 4.8509e-02 2.8529e-02 -6.0000e+00 3.7312e-01 3.1744e-01 2.3182e-02 8.8754e-03 -6.0000e+00 1.6000e-01 3.1995e-05 -2.1755e-03 6.5679e-04 2.8850e-04 -6.0000e+00 1.1433e-02 -1.1519e-03 0.0000e+00 12 8 8 10 0 0 99.47 24.73 0.84 -0.00115 -0.01750 22 2 1 5 0 2468.110 32.75 20.01 24.73 23.09 4.4 992.43 -76065 -150758 35448 900000 -89587 -51079 -31610 900000 -66475 -124408 -85670 -122868 -92488 900000 900000 34561 72371 35352 900000 76175 75981 -63822 -33727 95452 -55721 900000 133929 -959 -32845 -28787 -14074 -54844 13378 -22382 -18079 900000 30733 121495 39064 54338 52476 39974 37932 2328 73531 20251 82305 454 23022 9567 20712 9708 42768 6191 26618 22183 45294 27004 13291 24660 24289 29682 16019 26318 27089 27757 18115 -13929 8934 1106 7155 2850 10005 10956 -4298 -4288 -4845 3890 2919 -7154 8651 1685 -7459 -5779 -2788 3311 -7694 3671 -3382 5099 12399 1988 -5643 -15622 -2042 -1070 -3347 -2075 -1145 -1946 3280 -6824 -666 -4784 -3423 1265 -2147 -4341 4974 -270 2391 702 2078 1710 -1897 -4171 104 -831 182 3580 2632 2468 387 526 952 1371 -735 -281 564 -1591 -835 -279 955 -149 -1412 438 1013 -303 763 663 523 -382 -2687 -1577 -7814 735 900000 -2322 -1059 -655 900000 -1378 -3869 -1776 -3821 -2557 900000 900000 717 1500 733 900000 1579 1575 -3729 -1398 1979 -2836 900000 2777 -27 -1238 -1085 -531 -3721 529 -1392 -1056 900000 1043 2519 1546 2151 2374 2185 2216 202 3187 1527 3413 44 1822 902 1874 1080 3708 828 3060 2718 4439 3155 1729 2789 2793 3468 2415 4067 4544 4656 3243 -3439 1835 303 2077 922 3049 3180 -1346 -1209 -1246 887 714 -2254 2762 667 -3634 -2971 -1474 1764 -4849 2154 -2174 2981 6401 1059 -3065 -9230 -1126 -670 -2505 -1786 -1109 -2005 3128 -6678 -554 -3907 -2874 1091 -2025 -4482 5084 -323 3127 1023 3102 2535 -2796 -5976 139 -1161 267 5396 4120 3806 590 777 1350 1868 -991 -373 803 -2629 -1531 -554 1992 -330 -3382 1099 2638 -817 2070 1778 1336 -931 -6362 SS 20260106T140050.9Z 9502.583922 280 1 53.91 2 78.88 124.23 71.90 274.43 0.00 1 0.00 1 0 25 2.383e-01 1.057e-02 7.756e-02 2.464e-03 5.055716e-01 1.309724e-03 6.516740e-03 -6.000000e+00 1.369915e-01 224.32 -2.00 3.24 -2.00 320.68 0.00e+00 3.393811e-03 5.450554e-04 5.416855e-03 -6.000000e+00 6.155607e-03 285.24 -2.00 20.00 -2.00 320.06 0.00e+00 5.001 0.001 302.00 328.00 3 1.5360e+00 4.1948e-03 6.0603e-02 -6.0000e+00 3.3738e-01 -3.7492e-04 5.4107e-03 4.1059e-02 -6.0000e+00 3.6551e-01 -4.0447e-02 5.0101e-03 1.8444e-02 -6.0000e+00 2.1870e-01 4.7490e-03 2.4815e-03 4.1241e-03 -6.0000e+00 9.4889e-02 4.8384e-04 4.2310e-04 7.4317e-05 1.0329e-04 -6.0000e+00 6.6309e-03 -1.1745e-03 0.0000e+00 12 8 8 10 0 0 29.17 24.85 0.52 -0.00117 0.00200 123 14 1 5 0 438.250 32.75 20.00 24.85 24.74 4.3 999.02 -101697 -25897 -58378 -72895 -40429 -96706 -113744 -77473 -57849 -66512 -77242 -65808 -63939 -33633 -12143 -5401 -26483 -24727 -5503 4996 14675 -12917 -14053 -14636 -7591 -3865 -10767 -19592 -7864 -11987 -10523 -4949 -10617 -881 -6977 -20782 -6761 -6126 -3884 446 259 -51 659 2782 1407 1409 924 -875 2322 4930 2061 6224 1636 2306 4257 3473 1048 1440 -1010 863 -1373 1233 5511 5243 3359 2045 11 489 -472 1438 2057 2018 1482 1033 179 235 -2739 -4747 -4476 -2861 -2466 -1655 -1864 -2334 -1193 226 442 1024 2178 1535 541 -220 -1609 -2167 -1574 -1929 -503 913 561 -169 -608 -1591 -2607 -1916 -1068 -1451 -1190 59 194 1427 1719 1895 1591 730 -276 -851 -794 -153 251 725 394 386 792 681 147 -177 -1524 -835 -65 -369 -464 -507 -645 -821 -352 -111 240 782 719 347 134 -374 -547 -1155 -164 -561 -812 -300 -1204 -1764 -931 -644 -886 -1198 -978 -1117 -544 -196 -98 -671 -675 -135 117 356 -416 -469 -528 -274 -142 -440 -862 -297 -484 -473 -245 -638 -53 -441 -1458 -440 -458 -343 46 30 -7 88 380 198 203 136 -133 351 757 352 1131 340 516 997 853 272 377 -267 220 -366 344 1645 1757 1229 748 4 174 -179 605 971 1020 766 520 85 102 -1108 -1884 -1860 -1341 -1342 -1022 -1282 -1722 -927 186 386 928 1985 1387 466 -177 -1233 -1630 -1245 -1726 -508 945 649 -203 -708 -1735 -2619 -2032 -1082 -1585 -1365 71 251 1991 2631 3099 2652 1192 -430 -1256 -1143 -226 389 1193 669 649 1288 1078 223 -260 -2185 -1176 -98 -617 -852 -1001 -1334 -1630 -739 -249 556 1844 1728 825 305 -819 -1150 SS 20260106T140645.4Z 9502.588026 283 1 53.87 2 77.82 125.12 73.15 275.09 0.00 1 0.00 1 0 25 1.463e-01 9.951e-03 5.450e-02 1.816e-03 4.709136e-01 9.489262e-04 5.898256e-03 -6.000000e+00 8.406983e-02 224.32 -2.00 3.24 -2.00 320.46 0.00e+00 1.695001e-03 3.648415e-04 4.485970e-03 -6.000000e+00 3.777448e-03 285.24 -2.00 20.00 -2.00 319.81 0.00e+00 4.601 0.001 302.00 328.00 3 1.5013e+00 2.9435e-03 5.5017e-02 -6.0000e+00 2.0705e-01 -3.8861e-02 3.7207e-03 3.6195e-02 -6.0000e+00 2.2431e-01 7.2374e-03 3.3711e-03 1.5243e-02 -6.0000e+00 1.3421e-01 -1.3058e-02 1.6958e-03 3.3893e-03 -6.0000e+00 5.8235e-02 7.6530e-04 3.2341e-04 5.4924e-05 7.6264e-05 -6.0000e+00 4.0691e-03 -1.5716e-03 0.0000e+00 12 8 8 10 0 0 66.87 24.90 0.49 -0.00157 0.00086 164 18 1 5 0 328.430 33.00 20.01 24.90 25.21 4.3 1000.80 -75946 -33709 -19298 -48925 -43238 -42603 -67969 -8561 -40815 -32246 -30186 -51010 -27487 -37861 -18432 -18164 -4630 -14052 -14829 -9438 3791 -3880 -8081 -7129 -10705 -6061 -9161 -9448 -18640 -12413 -1012 -3069 -2399 -4144 -5435 -11390 -4536 -5365 1379 543 1164 929 -1931 2650 2015 307 1479 431 1680 -25 692 1505 2079 3151 1248 1713 2952 -862 -352 876 552 1294 3384 3681 3312 286 532 348 -574 1370 2083 1655 1157 1219 298 -1334 -2783 -3530 -3171 -2648 -2794 -1250 -1815 -2263 -819 186 672 1186 1890 1838 966 -398 -1819 -1847 -1938 -1060 -602 838 976 -214 -694 -1478 -2456 -1609 -1036 -1295 -1207 -295 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