File name: Pandora177s1_WestportCT_20230716_L2Fit_fwvt1c7d20230401p1-8.txt File generation date: 20241124T023953.1Z Data description: Level 2 spectral fitting results file Data file version: fwvt1c7p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 177 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora177_OF_v3d20201002.txt Instrument calibration file used: Pandora177s1_CF_v7d20230401.txt Level 1 file used: Pandora177s1_WestportCT_20230716_L1_smca1c7d20230401p1-8.txt Full location name: Westport - Sherwood Island State Park CTDEEP (USEPA AQS ID 09-001-9003) Short location name: WestportCT Country of location: USA Location latitude [deg]: 41.1183 Location longitude [deg]: -73.3367 Location altitude [m]: 4 Local noon date: 20230716 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: 1637 1786 Nominal wavelengths inside fitting window [nm]: 492.0717 492.1928 492.3139 492.4349 492.5560 492.6770 492.7980 492.9190 493.0400 493.1610 493.2819 493.4028 493.5237 493.6446 493.7655 493.8864 494.0072 494.1280 494.2488 494.3696 494.4904 494.6112 494.7319 494.8526 494.9733 495.0940 495.2147 495.3354 495.4560 495.5766 495.6972 495.8178 495.9384 496.0589 496.1795 496.3000 496.4205 496.5410 496.6615 496.7819 496.9024 497.0228 497.1432 497.2636 497.3840 497.5043 497.6246 497.7450 497.8653 497.9856 498.1058 498.2261 498.3463 498.4665 498.5867 498.7069 498.8271 498.9472 499.0674 499.1875 499.3076 499.4277 499.5477 499.6678 499.7878 499.9078 500.0278 500.1478 500.2678 500.3877 500.5077 500.6276 500.7475 500.8674 500.9872 501.1071 501.2269 501.3467 501.4665 501.5863 501.7060 501.8258 501.9455 502.0652 502.1849 502.3046 502.4243 502.5439 502.6635 502.7831 502.9027 503.0223 503.1419 503.2614 503.3809 503.5004 503.6199 503.7394 503.8588 503.9783 504.0977 504.2171 504.3365 504.4559 504.5752 504.6946 504.8139 504.9332 505.0525 505.1717 505.2910 505.4102 505.5294 505.6486 505.7678 505.8870 506.0061 506.1253 506.2444 506.3635 506.4825 506.6016 506.7207 506.8397 506.9587 507.0777 507.1967 507.3156 507.4346 507.5535 507.6724 507.7913 507.9102 508.0290 508.1479 508.2667 508.3855 508.5043 508.6230 508.7418 508.8605 508.9793 509.0980 509.2166 509.3353 509.4540 509.5726 509.6912 509.8098 509.9284 --------------------------------------------------------------------------------------- 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: Water vapor slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor 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: Water vapor effective temperature [K] Column 28: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for water vapor [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Nitrogen dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen 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: Nitrogen dioxide effective temperature [K] Column 39: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for nitrogen dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 45: 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 46: 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 47: 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 48: 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 49: Ozone effective temperature [K] Column 50: 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 51: 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 52: 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 53: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 54: 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 55: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 56: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 57: Lower limit used for wavelength scaling [nm] Column 58: Upper limit used for wavelength scaling [nm] Column 59: Order of smoothing polynomial Column 60: Smoothing polynomial coefficient, order 0 Column 61: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 62: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 63: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 64: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 65: Smoothing polynomial coefficient, order 1 Column 66: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 67: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 68: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 69: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 70: Mean value of measured data inside fitting window [same units as measurements] Column 71: Wavelength change polynomial coefficient, order 0 Column 72: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 76: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 77: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 78: 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 79: 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 80: 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 81: 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 82: 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 83: 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 84: Atmospheric variability [%], 999=no atmospheric variability was determined Column 85: Wavelength effective temperature [°C], 999=no effective temperature given Column 86: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 87: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 88: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 89: Number of bright count cycles Column 90: Number of dark count cycles Column 91: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 92: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 93: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 94: Integration time [ms] Column 95: Temperature at electronics board [°C], 999=no temperature signal Column 96: Spectrometer control temperature [°C], 999=no temperature signal Column 97: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 98: Temperature in head sensor [°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 101-250: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 251-400: 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 --------------------------------------------------------------------------------------- SQ 20230716T143843.9Z 8597.610231 232 1 7.24 2 35.63 112.89 22.66 120.17 0.00 1 0.00 1 0 22 4.717e-03 4.696e-03 3.179e-03 3.170e-03 5.418562e+03 2.321236e+02 3.568216e+02 -6.000000e+00 2.993853e+02 289.47 -2.00 20.00 -2.00 505.24 0.00e+00 4.187032e-04 9.307504e-05 3.174979e-05 -6.000000e+00 1.410419e-04 289.47 -2.00 20.00 -2.00 500.33 0.00e+00 -1.088501e-01 6.690808e-02 3.781508e-02 -6.000000e+00 9.910628e-02 232.91 -2.00 3.51 -2.00 501.93 0.00e+00 1.229 0.000 489.00 513.00 1 7.3389e+00 5.1754e-03 3.7069e-03 -6.0000e+00 7.6710e-03 8.2738e-03 1.2798e-03 8.8142e-04 -6.0000e+00 1.9194e-03 1.0617e-03 1.1160e-03 4.2346e-04 1.6643e-05 -6.0000e+00 6.6665e-04 -4.6135e-04 -9.9828e-05 12 9 9 12 1 1 999.00 23.60 1.82 -0.00046 0.00728 1 3 1 4 0 3532.770 26.94 20.01 23.60 28.37 21.6 1043.05 -421 -109 -324 -307 320 -120 51 421 704 34 259 -277 -81 -333 -460 32 62 -89 166 -267 -40 259 -53 582 189 192 662 -230 108 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454 597 132 -227 389 794 -64 886 175 77 724 437 604 790 470 425 141 -87 300 590 113 -599 -256 -162 47 56 -299 -208 -487 -136 195 -2 -65 195 329 -107 48 -420 -806 -157 SQ 20230716T144255.9Z 8597.613147 235 1 49.76 2 34.91 114.02 22.00 121.81 0.00 1 0.00 1 0 22 3.970e-03 3.931e-03 1.741e-03 1.732e-03 6.598909e+03 1.303266e+02 4.319766e+02 -6.000000e+00 2.519700e+02 289.47 -2.00 20.00 -2.00 505.21 0.00e+00 3.784902e-04 5.100073e-05 3.335857e-05 -6.000000e+00 1.186916e-04 289.47 -2.00 20.00 -2.00 500.19 0.00e+00 4.953707e-02 3.686144e-02 4.371616e-02 -6.000000e+00 8.338776e-02 232.91 -2.00 3.51 -2.00 501.81 0.00e+00 1.219 0.000 489.00 513.00 1 7.8944e+00 2.8551e-03 4.1498e-03 -6.0000e+00 6.4547e-03 4.9922e-03 7.0260e-04 1.0279e-03 -6.0000e+00 1.6144e-03 6.0207e-04 1.4002e-03 2.2791e-04 1.7256e-05 -6.0000e+00 5.6114e-04 3.1597e-03 -9.5659e-05 11 8 0 10 0 0 99.85 23.63 1.78 0.00316 0.01287 19 4 1 4 0 2618.710 26.94 20.01 23.63 28.51 21.6 1043.63 -714 -26 -273 -238 67 33 409 321 459 -54 409 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300 472 -69 12 253 206 -813 -397 -686 -648 -77 -298 -117 -733 -690 -551 137 -66 33 58 78 413 561 307 432 509 483 511 -35 329 753 745 418 711 209 -161 599 389 199 -377 -309 -287 -356 -123 -56 -462 -245 125 16 264 -18 293 36 -336 -259 -437 -329 -113 SQ 20230716T160252.2Z 8597.668660 290 1 49.77 2 23.13 144.57 13.74 174.44 0.00 1 0.00 1 0 22 3.684e-03 3.666e-03 1.304e-03 1.298e-03 6.184921e+03 9.650882e+01 3.961144e+02 -6.000000e+00 2.338005e+02 289.47 -2.00 20.00 -2.00 505.21 0.00e+00 3.118090e-04 3.813538e-05 3.195037e-05 -6.000000e+00 1.101368e-04 289.47 -2.00 20.00 -2.00 500.24 0.00e+00 -3.216377e-02 2.752313e-02 4.335912e-02 -6.000000e+00 7.738126e-02 232.91 -2.00 3.51 -2.00 501.85 0.00e+00 1.087 0.000 489.00 513.00 1 7.6354e+00 2.1324e-03 4.0168e-03 -6.0000e+00 5.9896e-03 5.3634e-03 5.2606e-04 9.9488e-04 -6.0000e+00 1.4983e-03 8.0109e-04 8.9878e-04 1.7171e-04 1.4201e-05 -6.0000e+00 5.2066e-04 1.4323e-03 -9.4470e-05 10 0 0 10 0 0 99.46 23.58 1.88 0.00143 0.00767 16 4 1 4 0 3110.030 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