File name: Pandora85s1_NewOrleansLA-XULA_20240802_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240803T061038.9Z 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_20240802_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: 20240802 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 20240802T120437.0Z 8980.503206 108 1 54.08 2 81.78 74.43 59.11 74.64 0.00 1 0.00 1 0 25 6.839e-01 4.287e-02 2.305e-01 7.062e-03 7.648146e-01 4.165870e-03 8.182325e-03 -6.000000e+00 4.102325e-01 229.81 -2.00 3.24 -2.00 321.50 0.00e+00 -1.877642e-02 2.369970e-03 9.749285e-04 -6.000000e+00 3.236033e-02 294.49 -2.00 20.00 -2.00 320.84 0.00e+00 6.548 0.003 302.00 328.00 3 2.3686e+00 1.6233e-02 7.5373e-02 -6.0000e+00 1.0058e+00 5.2419e-01 2.2057e-02 4.0713e-02 -6.0000e+00 1.0969e+00 -8.2080e-01 1.9777e-02 2.2885e-02 -6.0000e+00 6.6310e-01 3.4042e-01 9.3502e-03 1.7217e-02 -6.0000e+00 2.8962e-01 3.6121e-05 -7.7273e-04 2.0888e-04 1.9964e-04 -6.0000e+00 2.0555e-02 -2.2971e-02 12 8 8 10 0 0 56.72 27.35 0.96 -0.02297 -0.02878 22 2 1 5 0 2457.840 34.50 20.01 27.35 34.71 23.8 1018.13 900000 900000 900000 65169 900000 900000 -158791 -37625 -165737 -57112 900000 900000 900000 900000 900000 900000 23021 900000 163861 900000 900000 -53758 900000 900000 900000 900000 900000 900000 900000 900000 -63221 900000 154514 78091 -63464 6038 40016 28156 453696 236988 900000 157496 900000 56953 16641 -42186 900000 80763 781 172071 40149 135047 27278 -13373 88101 92531 16608 31199 72417 26827 22162 63682 2600 -16579 5682 39157 -30199 28353 23261 23873 35202 26416 -12434 11919 10067 -17625 -20850 1330 -2831 27031 -1688 -6861 -2656 -7618 3837 16080 -6464 -190 8239 -7077 8920 -4437 5026 -5136 -770 -13701 4299 -1596 -3520 -647 1206 -3924 3097 -1975 -4649 -2540 3472 2450 -1555 2525 -3668 5635 5513 2502 -1601 942 -8065 -4034 -1405 -2209 1524 2930 4665 1865 224 533 -3038 370 -3143 161 1606 234 135 2214 -792 918 -796 -249 1238 1863 1568 -4561 -720 -257 900000 900000 900000 446 900000 900000 -4746 -398 -7636 -1031 900000 900000 900000 900000 900000 900000 373 900000 1122 900000 900000 -2109 900000 900000 900000 900000 900000 900000 900000 900000 -3503 900000 1376 1658 -5058 248 1206 1099 3107 1785 900000 3452 900000 3511 1470 -6443 900000 3485 76 3182 3025 4440 2933 -2372 6215 6718 2741 4594 6894 3785 3112 5975 490 -4258 1288 6463 -8837 5165 4763 5543 8390 7472 -4846 3886 3103 -6422 -7026 343 -793 6443 -636 -2892 -1229 -4046 1940 7739 -4141 -119 4827 -4763 4854 -2572 2525 -2840 -438 -10151 3092 -1409 -3311 -631 1135 -3617 2615 -1632 -4082 -2358 3197 2423 -1588 2757 -4840 7558 7844 3410 -2208 1309 -10997 -5832 -2078 -3217 2194 4405 6608 2634 312 712 -4080 472 -4470 235 2610 425 264 4168 -1647 2018 -1862 -552 2737 4327 3458 -9983 -1423 -494 SS 20240802T121917.5Z 8980.513397 113 1 54.26 2 78.70 76.13 56.13 75.92 0.00 1 0.00 1 0 25 2.613e-01 1.399e-02 4.706e-02 1.864e-03 5.744512e-01 9.745505e-04 6.726280e-03 -6.000000e+00 1.504059e-01 229.81 -2.00 3.24 -2.00 320.19 0.00e+00 4.039678e-04 3.596976e-04 4.177120e-03 -6.000000e+00 7.169199e-03 294.49 -2.00 20.00 -2.00 319.35 0.00e+00 4.926 0.001 302.00 328.00 3 1.8524e+00 2.9980e-03 5.9834e-02 -6.0000e+00 3.7351e-01 -2.6533e-02 3.7701e-03 3.9468e-02 -6.0000e+00 4.0494e-01 -4.3365e-02 3.2588e-03 1.4574e-02 -6.0000e+00 2.4244e-01 8.5434e-03 1.6627e-03 4.9636e-03 -6.0000e+00 1.0369e-01 3.5926e-04 -1.6032e-04 5.1669e-05 4.9671e-05 -6.0000e+00 7.1165e-03 -2.4761e-02 12 8 8 10 0 0 10.13 27.43 0.52 -0.02476 -0.02597 94 10 1 5 0 577.170 34.50 20.01 27.43 35.43 23.8 1018.28 900000 -55730 900000 -60601 -69126 900000 -120054 -83023 -122582 -133170 -79901 -42973 -67892 25277 -14893 900000 -26261 -4133 19677 4311 30422 -41060 -20749 9693 785 9024 24949 52193 -11532 -12274 -24846 23363 -3693 -9601 -25065 -15369 -8348 -23132 -3565 1829 7708 5792 6484 -1252 85 -6993 13279 4524 -1280 1800 467 4910 2008 -2016 5835 6090 1685 2851 653 263 1750 3827 722 -107 3643 3320 -3906 971 845 2176 3463 3113 753 1648 348 -2130 -4384 -4383 -3963 -1581 -2629 -1666 -1490 -2898 -769 1125 138 1857 2489 792 1900 -9 -830 -2849 -2073 -3091 -360 273 101 -36 -470 -1342 -2226 -1938 -1301 -1514 -304 -139 206 1199 1583 2721 2333 1385 -136 -704 -952 -350 89 335 632 609 1262 906 148 -88 -1384 -1029 -683 -250 -351 -666 -833 -608 -433 2 -244 620 944 599 307 -363 -540 -139 900000 -456 900000 -606 -703 900000 -2007 -1086 -2762 -3774 -1423 -562 -1345 248 -273 900000 -763 -107 440 121 691 -1940 -818 306 30 343 852 1356 -543 -582 -1490 1023 -247 -773 -2404 -1279 -676 -2501 -385 231 1084 917 986 -215 15 -1312 2285 786 -243 346 98 1110 518 -591 1716 1883 568 975 226 89 585 1325 263 -44 1606 1485 -1810 426 389 1115 1854 1818 464 986 198 -1227 -2334 -2216 -2059 -914 -1671 -1213 -1135 -2417 -667 963 127 1764 2406 773 1748 -8 -733 -2483 -1875 -2970 -363 314 124 -46 -602 -1613 -2600 -2122 -1475 -1751 -366 -177 265 1672 2315 4288 3632 2145 -214 -1052 -1378 -513 137 520 1017 971 1935 1425 226 -129 -1980 -1509 -1002 -390 -608 -1195 -1508 -1151 -832 5 -503 1297 2009 1272 627 -737 -1045 -276 SS 20240802T122516.9Z 8980.517557 116 1 54.07 2 77.44 76.82 54.91 76.44 0.00 1 0.00 1 0 17 1.823e-01 1.248e-02 2.665e-02 1.253e-03 5.265550e-01 6.422072e-04 6.124032e-03 -6.000000e+00 1.044652e-01 229.81 -2.00 3.24 -2.00 319.71 0.00e+00 1.380398e-03 1.985543e-04 3.100515e-03 -6.000000e+00 4.832472e-03 294.49 -2.00 20.00 -2.00 318.81 0.00e+00 4.468 0.001 302.00 328.00 3 1.5839e+00 1.8830e-03 5.2991e-02 -6.0000e+00 2.5970e-01 -3.4591e-02 2.2710e-03 3.1735e-02 -6.0000e+00 2.8141e-01 -2.3682e-02 1.8135e-03 1.3263e-02 -6.0000e+00 1.6856e-01 1.9439e-04 9.4869e-04 3.5234e-03 -6.0000e+00 7.1865e-02 7.5631e-04 -2.4932e-04 3.4751e-05 4.1145e-05 -6.0000e+00 4.9517e-03 -2.4761e-02 12 8 8 10 0 0 -8.51 27.48 0.47 -0.02476 -0.02663 151 17 1 5 0 358.000 34.50 20.01 27.48 35.75 23.9 1018.34 900000 -48100 21750 -79068 -65301 6637 -70740 -70426 -79567 -64113 -63847 -41219 -45212 -9614 -15409 22518 -20670 -10388 -4162 -996 10350 -18178 -15642 1299 -6119 -746 209 10241 -11394 -7599 -16033 5586 -3039 -2482 -12996 -14158 -9645 -10465 -3843 1952 3673 2123 4308 375 638 -1610 6015 2005 -1661 679 -19 3071 1656 625 3567 3036 1258 1740 1203 643 751 2239 2453 2858 3239 1975 -1344 -272 300 1552 2634 2194 814 1452 226 -1494 -3589 -3953 -4311 -2387 -2628 -1834 -1520 -2556 -1299 152 464 1749 1892 1432 1336 56 -1195 -2242 -2133 -2299 -491 246 392 188 -557 -1511 -2132 -1819 -1197 -1413 -581 -140 42 1364 1540 2294 2179 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