File name: Pandora143s1_LibertyTX_20241027_L2Fit_fout2c9d20230920p1-8.txt File generation date: 20250114T011858.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Yuxuan Wang Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 143 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora143_OF_v1d20230920.txt Instrument calibration file used: Pandora143s1_CF_v9d20230920.txt Level 1 file used: Pandora143s1_LibertyTX_20241027_L1_smca1c9d20230920p1-8.txt Full location name: Sam Houston Regional Library and Research Center Short location name: LibertyTX Country of location: United States Location latitude [deg]: 30.0965 Location longitude [deg]: -94.7635 Location altitude [m]: 3 Local noon date: 20241027 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: None First and last pixel inside fitting window: 242 384 Nominal wavelengths inside fitting window [nm]: 305.0307 305.1715 305.3123 305.4532 305.5940 305.7348 305.8756 306.0164 306.1572 306.2979 306.4387 306.5794 306.7201 306.8609 307.0016 307.1423 307.2829 307.4236 307.5643 307.7049 307.8456 307.9862 308.1268 308.2674 308.4080 308.5486 308.6892 308.8297 308.9703 309.1108 309.2513 309.3919 309.5324 309.6729 309.8133 309.9538 310.0943 310.2347 310.3752 310.5156 310.6560 310.7964 310.9368 311.0772 311.2175 311.3579 311.4982 311.6386 311.7789 311.9192 312.0595 312.1998 312.3401 312.4804 312.6206 312.7609 312.9011 313.0413 313.1815 313.3217 313.4619 313.6021 313.7423 313.8824 314.0226 314.1627 314.3028 314.4429 314.5830 314.7231 314.8632 315.0033 315.1433 315.2834 315.4234 315.5634 315.7034 315.8434 315.9834 316.1234 316.2633 316.4033 316.5432 316.6831 316.8231 316.9630 317.1029 317.2427 317.3826 317.5225 317.6623 317.8022 317.9420 318.0818 318.2216 318.3614 318.5012 318.6409 318.7807 318.9204 319.0602 319.1999 319.3396 319.4793 319.6190 319.7587 319.8983 320.0380 320.1776 320.3173 320.4569 320.5965 320.7361 320.8757 321.0153 321.1548 321.2944 321.4339 321.5734 321.7129 321.8524 321.9919 322.1314 322.2709 322.4104 322.5498 322.6892 322.8287 322.9681 323.1075 323.2469 323.3862 323.5256 323.6650 323.8043 323.9436 324.0829 324.2223 324.3616 324.5008 324.6401 324.7794 324.9186 --------------------------------------------------------------------------------------- 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: 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: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20241027T125405.6Z 9066.537565 153 1 24.01 2 85.79 107.73 33.45 122.36 0.00 1 0.00 1 0 145 1.590e+00 5.366e-01 6.037e-01 2.390e-01 1.878076e-01 1.304229e-01 2.213223e-02 -6.000000e+00 9.921442e-01 226.16 -2.00 3.25 -2.00 314.63 0.00e+00 -1.029922e-01 1.551516e-02 3.173051e-03 -6.000000e+00 5.138509e-02 290.09 -2.00 20.00 -2.00 313.96 0.00e+00 11.053 0.016 302.00 328.00 3 2.4636e+00 3.4715e-01 1.2917e-01 -6.0000e+00 2.4714e+00 6.9667e-01 4.0631e-01 8.2797e-02 -6.0000e+00 2.6835e+00 7.8005e-02 2.3099e-01 3.1119e-02 -6.0000e+00 1.5942e+00 -9.5660e-02 9.0081e-02 1.4716e-02 -6.0000e+00 7.1257e-01 6.1285e-07 1.0207e-01 4.2200e-03 2.3096e-04 -6.0000e+00 4.8165e-02 -7.8626e-02 0.0000e+00 12 12 8 10 0 0 -45.12 27.84 11.45 -0.07863 0.68841 6 6 2 8 0 4000.000 20.01 27.84 23.74 25.79 26.11 23.2 964.83 900000 900000 -52421 3884 900000 205131 316030 288395 900000 10238 900000 -8845 900000 -69161 23750 900000 139293 7949 900000 287376 220871 900000 140162 52463 128159 900000 -5295 900000 199164 900000 8504 900000 104491 900000 900000 52873 794640 -49104 900000 182645 900000 200139 80492 900000 380635 900000 84150 900000 123081 55733 7272 900000 323461 900000 233920 368677 900000 -20531 900000 53294 900000 -3096 -70 -22437 900000 900000 900000 382086 163065 101465 900000 900000 -48836 39673 -41767 246742 900000 900000 369352 130597 900000 44750 900000 62029 51147 49929 900000 197788 900000 117217 46779 187563 89242 42358 95923 167693 34607 90631 -44118 13224 900000 900000 -41390 900000 68458 59228 124935 15889 78895 6566 28629 -26646 185929 -64175 229827 62418 81115 113143 32832 -8226 3577 900000 -8737 138629 55508 86658 57578 105679 9708 50806 -19125 53662 9263 -22673 43059 -22701 18944 -28961 23675 -9816 9864 27575 9234 900000 900000 -38210 3071 900000 47889 72909 66534 900000 5000 900000 -3759 900000 -43884 6315 900000 32136 3565 900000 66299 54629 900000 62355 34166 29567 900000 -2386 900000 45948 900000 3188 900000 24297 900000 900000 54829 183326 -133903 900000 42137 900000 46173 26628 900000 87814 900000 27826 900000 33919 33057 8073 900000 74624 900000 53966 85055 900000 -25352 900000 31833 900000 -2504 -54 -23139 900000 900000 900000 88149 44708 47981 900000 900000 -65144 20931 -49170 56924 900000 900000 85211 46015 900000 41847 900000 50324 44179 40700 900000 45630 900000 40744 32881 43272 45801 35701 48518 40476 27430 40845 -75375 14601 900000 900000 -86234 900000 52961 52497 60817 21305 54813 8300 26963 -40544 42895 -150157 53022 50024 54967 55545 33632 -11938 4466 900000 -11042 44797 41989 50917 45418 53175 12631 47979 -37779 55143 14857 -49960 50331 -48176 26153 -61706 31355 -18909 17012 43355 18534 SS 20241027T131051.9Z 9066.549212 156 1 28.00 2 82.36 109.95 30.57 127.80 0.00 1 0.00 1 0 25 1.007e+00 1.869e-01 4.802e-01 9.874e-02 6.516079e-01 5.541786e-02 7.054359e-03 -6.000000e+00 6.042209e-01 226.16 -2.00 3.25 -2.00 320.70 0.00e+00 4.088607e-03 1.380399e-02 4.687881e-03 -6.000000e+00 3.401498e-02 290.09 -2.00 20.00 -2.00 319.80 0.00e+00 6.983 0.004 302.00 328.00 3 3.5888e+00 1.6292e-01 8.2344e-02 -6.0000e+00 1.5038e+00 1.6246e+00 1.9245e-01 5.6835e-02 -6.0000e+00 1.6601e+00 -1.4711e+00 1.0926e-01 1.6072e-02 -6.0000e+00 9.6837e-01 4.1773e-01 5.7071e-02 1.0634e-02 -6.0000e+00 4.1839e-01 4.6156e-06 5.5378e-03 3.0241e-03 9.1414e-05 -6.0000e+00 2.8529e-02 -3.1891e-03 0.0000e+00 12 8 8 10 0 0 82.58 27.36 3.24 -0.00319 0.03842 7 7 5 8 0 4000.000 20.00 27.36 24.35 25.79 26.11 23.2 969.29 900000 900000 102544 -14244 900000 900000 900000 82884 -67934 17780 900000 -27254 900000 9866 202671 900000 900000 33635 900000 35235 391294 900000 -4735 591225 900000 900000 30213 900000 -27106 900000 -6942 900000 900000 900000 900000 -83556 22407 900000 900000 29247 900000 50689 89322 900000 286270 93905 156127 900000 109679 3030 -4284 138561 900000 900000 189207 900000 174546 -22883 900000 26408 900000 90747 -56350 31311 89264 161337 900000 12122 21425 9752 96777 234785 5362 72863 -5772 34048 91097 54437 28847 137561 135718 -37065 137236 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11691 -1158 6860 -2479 4166 -3366 -8323 2624 32635 -53711 21107 7666 9331 30171 9828 -25605 -8055 24692 -1095 8956 -23300 -7215 13450 30071 8651 29241 3082 22010 -21898 -21812 37977 -6646 -7625 -11357 16138 -507 17741 5470 -28166 SS 20241027T131722.0Z 9066.553727 159 1 48.00 2 81.04 110.84 29.51 130.14 0.00 1 0.00 1 0 33 1.078e+00 8.561e-02 3.962e-01 2.720e-02 5.976278e-01 1.510414e-02 6.836184e-03 -6.000000e+00 6.252216e-01 226.16 -2.00 3.25 -2.00 321.38 0.00e+00 1.066037e-02 7.475106e-03 1.357583e-03 -6.000000e+00 3.578588e-02 290.09 -2.00 20.00 -2.00 320.75 0.00e+00 6.078 0.003 302.00 328.00 3 3.7013e+00 5.5132e-02 6.7155e-02 -6.0000e+00 1.5568e+00 9.7248e-01 6.5107e-02 3.4141e-02 -6.0000e+00 1.7130e+00 -1.3529e+00 4.1214e-02 1.5087e-02 -6.0000e+00 1.0099e+00 5.3469e-01 2.1801e-02 1.3726e-02 -6.0000e+00 4.3963e-01 1.4716e-05 2.7020e-03 7.9626e-04 1.8376e-04 -6.0000e+00 2.8130e-02 -3.5175e-03 0.0000e+00 12 9 8 11 40 0 78.29 27.38 1.59 -0.00352 0.01679 12 3 5 8 0 4000.000 20.00 27.38 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