File name: Pandora153s1_ChelseaMA_20240424_L2Fit_fout2c6d20231012p1-8.txt File generation date: 20241009T170816.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jeff Geddes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 153 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora153_OF_v2d20200209.txt Instrument calibration file used: Pandora153s1_CF_v6d20231012.txt Level 1 file used: Pandora153s1_ChelseaMA_20240424_L1_smca1c6d20231012p1-8.txt Full location name: Chelsea, Massachusetts Short location name: ChelseaMA Country of location: United States Location latitude [deg]: 42.3946 Location longitude [deg]: -71.0307 Location altitude [m]: 30 Local noon date: 20240424 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: OoB based on session 5 First and last pixel inside fitting window: 231 373 Nominal wavelengths inside fitting window [nm]: 305.0648 305.2058 305.3467 305.4876 305.6286 305.7695 305.9103 306.0512 306.1921 306.3330 306.4738 306.6146 306.7555 306.8963 307.0371 307.1779 307.3187 307.4594 307.6002 307.7409 307.8817 308.0224 308.1631 308.3038 308.4445 308.5852 308.7259 308.8665 309.0072 309.1478 309.2884 309.4290 309.5696 309.7102 309.8508 309.9914 310.1320 310.2725 310.4130 310.5536 310.6941 310.8346 310.9751 311.1156 311.2560 311.3965 311.5369 311.6774 311.8178 311.9582 312.0986 312.2390 312.3794 312.5198 312.6601 312.8005 312.9408 313.0811 313.2214 313.3618 313.5020 313.6423 313.7826 313.9229 314.0631 314.2033 314.3436 314.4838 314.6240 314.7642 314.9043 315.0445 315.1847 315.3248 315.4650 315.6051 315.7452 315.8853 316.0254 316.1655 316.3055 316.4456 316.5856 316.7257 316.8657 317.0057 317.1457 317.2857 317.4257 317.5656 317.7056 317.8455 317.9855 318.1254 318.2653 318.4052 318.5451 318.6849 318.8248 318.9647 319.1045 319.2443 319.3842 319.5240 319.6638 319.8035 319.9433 320.0831 320.2228 320.3626 320.5023 320.6420 320.7817 320.9214 321.0611 321.2008 321.3404 321.4801 321.6197 321.7593 321.8989 322.0385 322.1781 322.3177 322.4573 322.5968 322.7364 322.8759 323.0154 323.1550 323.2944 323.4339 323.5734 323.7129 323.8523 323.9918 324.1312 324.2706 324.4100 324.5494 324.6888 324.8282 324.9675 --------------------------------------------------------------------------------------- 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 --------------------------------------------------------------------------------------- SU 20240424T182657.0Z 8880.768715 13 1 50.76 2 36.95 225.65 151.77 38.67 0.00 1 0.00 1 0 17 1.154e-02 6.700e-03 2.667e-04 9.910e-05 2.601709e-01 4.989126e-05 3.133984e-03 -6.000000e+00 6.556977e-03 229.30 -2.00 3.54 -2.00 316.87 0.00e+00 4.906694e-04 6.389760e-06 8.912894e-05 -6.000000e+00 2.855391e-04 280.35 -2.00 20.00 -2.00 316.19 0.00e+00 1.250 0.000 302.00 328.00 3 5.3055e-02 1.3134e-04 1.8619e-02 -6.0000e+00 1.6367e-02 5.7215e-03 1.4728e-04 1.3458e-02 -6.0000e+00 1.7791e-02 -3.9916e-04 8.6957e-05 6.6078e-03 -6.0000e+00 1.0569e-02 -2.2999e-03 4.1991e-05 1.8550e-03 -6.0000e+00 4.4442e-03 1.0173e-01 6.2285e-05 2.7989e-06 2.0421e-05 -6.0000e+00 3.0567e-04 9.0275e-03 -1.3678e-06 11 8 0 10 0 0 27.69 18.01 0.33 0.00903 0.00950 5378 1017 1 5 0 9.380 21.27 15.04 18.01 23.20 0.0 958.12 -210 -692 -1029 -3511 -4627 -4046 -2298 -589 -401 -1862 -3524 -2897 -1617 -483 424 194 -58 320 714 1184 608 328 871 726 817 872 -51 -854 -973 -171 821 1647 1975 -682 -3107 -3251 -2913 -1334 -123 -166 -451 -355 -259 -223 152 126 -203 -328 -782 -82 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-360 -517 -145 82 -136 234 446 -38 -92 -357 -1023 -1292 SU 20240424T182954.4Z 8880.770768 16 1 50.77 2 37.34 226.64 151.45 39.90 0.00 1 0.00 1 0 17 1.160e-02 6.708e-03 2.700e-04 9.949e-05 2.617416e-01 5.004171e-05 3.151282e-03 -6.000000e+00 6.590901e-03 229.30 -2.00 3.54 -2.00 316.89 0.00e+00 4.782263e-04 6.441397e-06 8.893517e-05 -6.000000e+00 2.869997e-04 280.35 -2.00 20.00 -2.00 316.20 0.00e+00 1.257 0.000 302.00 328.00 3 5.2207e-02 1.3173e-04 1.8723e-02 -6.0000e+00 1.6452e-02 5.8181e-03 1.4774e-04 1.3541e-02 -6.0000e+00 1.7882e-02 -7.7355e-04 8.7365e-05 6.6434e-03 -6.0000e+00 1.0623e-02 -2.1196e-03 4.2278e-05 1.8598e-03 -6.0000e+00 4.4678e-03 1.0088e-01 5.9507e-05 2.8106e-06 2.0589e-05 -6.0000e+00 3.0719e-04 7.9574e-03 1.4095e-06 11 8 0 10 0 0 39.54 18.15 0.33 0.00796 0.00840 5310 1004 1 5 0 9.500 21.48 15.02 18.15 23.50 0.0 959.35 -326 -570 -1042 -3513 -4643 -4022 -2288 -704 -387 -1870 -3553 -2960 -1742 -553 473 283 -65 379 652 1195 569 333 851 740 796 861 -19 -837 -964 -177 853 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-1058 -147 744 1043 849 581 -40 -463 -360 -152 104 503 448 217 434 583 584 893 400 215 866 803 771 371 -353 -511 -157 77 -131 234 459 -57 -86 -372 -1005 -1284 SU 20240424T183254.6Z 8880.772854 19 1 50.78 2 37.75 227.64 151.12 41.14 0.00 1 0.00 1 0 17 1.163e-02 6.680e-03 2.843e-04 1.033e-04 2.635850e-01 5.202066e-05 3.172886e-03 -6.000000e+00 6.610244e-03 229.30 -2.00 3.54 -2.00 316.94 0.00e+00 4.877681e-04 6.766727e-06 9.255888e-05 -6.000000e+00 2.878290e-04 280.35 -2.00 20.00 -2.00 316.25 0.00e+00 1.264 0.000 302.00 328.00 3 1.1380e-01 1.3704e-04 1.8843e-02 -6.0000e+00 1.6500e-02 5.3004e-03 1.5378e-04 1.3634e-02 -6.0000e+00 1.7934e-02 -3.0829e-04 9.1011e-05 6.6922e-03 -6.0000e+00 1.0654e-02 -2.5392e-03 4.4068e-05 1.8775e-03 -6.0000e+00 4.4814e-03 9.3915e-02 3.8835e-05 2.9162e-06 2.0636e-05 -6.0000e+00 3.0805e-04 7.1298e-03 -3.7254e-07 11 8 0 10 0 0 15.88 18.26 0.34 0.00713 0.00742 5009 947 1 5 0 10.070 21.48 15.02 18.26 23.78 0.0 960.52 -288 -543 -1053 -3499 -4640 -4118 -2322 -572 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