File name: Pandora166s1_PhiladelphiaPA_20231213_L2Fit_fout2c5d20220925p1-8.txt File generation date: 20240123T195140.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 166 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora166_OF_v5d20210217.txt Instrument calibration file used: Pandora166s1_CF_v5d20220925.txt Level 1 file used: Pandora166s1_PhiladelphiaPA_20231213_L1_smca1c5d20220925p1-8.txt Full location name: Philadelphia, Pennsylvania; Philadelphia-Camden-Wilmington; North East Waste (NE Short location name: PhiladelphiaPA Country of location: United States Location latitude [deg]: 39.9919 Location longitude [deg]: -75.0811 Location altitude [m]: 6 Local noon date: 20231213 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: HCHO modification of session 4 "Field cal based on session3" First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0654 305.2061 305.3468 305.4875 305.6282 305.7689 305.9096 306.0503 306.1910 306.3316 306.4722 306.6129 306.7535 306.8941 307.0347 307.1753 307.3158 307.4564 307.5969 307.7375 307.8780 308.0185 308.1590 308.2995 308.4400 308.5805 308.7209 308.8614 309.0018 309.1422 309.2827 309.4231 309.5635 309.7038 309.8442 309.9846 310.1249 310.2652 310.4056 310.5459 310.6862 310.8265 310.9668 311.1070 311.2473 311.3875 311.5278 311.6680 311.8082 311.9484 312.0886 312.2288 312.3690 312.5091 312.6493 312.7894 312.9295 313.0696 313.2097 313.3498 313.4899 313.6300 313.7700 313.9101 314.0501 314.1901 314.3301 314.4701 314.6101 314.7501 314.8901 315.0300 315.1700 315.3099 315.4498 315.5897 315.7296 315.8695 316.0094 316.1493 316.2891 316.4290 316.5688 316.7086 316.8484 316.9882 317.1280 317.2678 317.4076 317.5473 317.6871 317.8268 317.9665 318.1062 318.2459 318.3856 318.5253 318.6650 318.8046 318.9443 319.0839 319.2235 319.3631 319.5027 319.6423 319.7819 319.9215 320.0610 320.2006 320.3401 320.4796 320.6191 320.7586 320.8981 321.0376 321.1770 321.3165 321.4559 321.5954 321.7348 321.8742 322.0136 322.1530 322.2923 322.4317 322.5711 322.7104 322.8497 322.9891 323.1284 323.2677 323.4069 323.5462 323.6855 323.8247 323.9640 324.1032 324.2424 324.3816 324.5208 324.6600 324.7992 324.9383 --------------------------------------------------------------------------------------- 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 20231213T130845.7Z 8747.547751 72 1 28.98 2 82.12 129.35 91.55 127.28 0.00 1 0.00 1 0 25 5.187e-01 3.440e-02 3.961e-01 2.505e-02 8.590013e-01 1.440078e-02 9.440401e-03 -6.000000e+00 2.984953e-01 223.00 -2.00 3.49 -2.00 321.98 0.00e+00 2.574951e-03 5.827989e-03 9.644071e-04 -6.000000e+00 1.285618e-02 278.21 -2.00 20.00 -2.00 321.61 0.00e+00 6.813 0.006 302.00 328.00 3 1.8231e+00 4.5349e-02 8.1086e-02 -6.0000e+00 7.4020e-01 1.0559e+00 5.7344e-02 4.4712e-02 -6.0000e+00 8.1140e-01 -1.4499e+00 5.3639e-02 2.4806e-02 -6.0000e+00 4.7569e-01 6.0988e-01 2.8066e-02 8.4451e-03 -6.0000e+00 2.0212e-01 3.7024e-05 -4.0438e-03 7.2649e-04 1.2290e-04 -6.0000e+00 1.5513e-02 -1.0068e-02 -4.2063e-04 12 9 9 12 1 1 99.96 19.38 0.44 -0.01007 -0.04045 11 4 1 5 0 2414.760 26.21 19.98 19.38 9.38 22.6 911.88 900000 32697 -57203 900000 62968 900000 -78298 900000 -130827 -134933 -31542 -76820 900000 35807 900000 54400 900000 117949 2083 50051 -21991 900000 9990 900000 -33737 131644 39212 40012 900000 -11635 205531 243888 90895 3918 80289 41005 28909 900000 -14372 900000 83955 29990 126746 23189 84229 1823 174456 -12889 73067 80236 133093 54438 9442 46595 12055 48931 53388 22459 33404 -14378 43468 9829 10589 -4074 53565 12583 3026 17100 -5559 24857 12828 10678 11577 13961 27549 16888 22744 34401 -4160 5110 1271 2017 -2986 7258 -7021 2331 3977 5061 -12947 -2833 11339 1371 -10642 -12864 -4971 -6645 -6093 578 40 357 -3996 -3759 -5928 -3783 -2489 -7301 -3622 -2056 2745 -3389 203 1042 -420 896 -2809 4436 -2406 1863 -200 663 1551 1075 1967 2656 3687 10 5086 3155 1492 787 -802 26 -85 827 -1315 866 -286 -693 2938 -1686 -243 -1646 -1426 900000 797 -3031 900000 1535 900000 -3340 900000 -9399 -10073 -919 -3585 900000 873 900000 1507 900000 2875 105 1610 -1290 900000 403 900000 -2106 3208 1226 1154 900000 -527 5009 5944 2459 242 2339 1601 1294 900000 -1219 900000 3685 2218 4006 1837 3780 169 4252 -1393 3793 4129 4637 4212 1181 4452 1642 4881 5156 2804 3587 -2266 4041 1322 1586 -787 6544 2231 582 2993 -1305 4985 3147 2769 2921 3216 5057 3053 3630 5038 -971 1302 395 718 -1236 2900 -3398 1091 1910 2472 -7485 -1439 4736 594 -5055 -6514 -2640 -4220 -4520 468 37 332 -3689 -3131 -4517 -2734 -1879 -6135 -3105 -1873 2649 -3962 261 1455 -617 1292 -4056 5784 -3351 2589 -298 1020 2340 1560 2711 3533 4707 13 6067 3971 2168 1331 -1543 55 -187 1927 -3339 2270 -774 -1898 7749 -4466 -592 -3776 -3093 SS 20231213T132035.0Z 8747.555961 75 1 28.49 2 80.40 131.48 89.84 129.11 0.00 1 0.00 1 0 17 5.253e-01 2.316e-02 3.750e-01 1.632e-02 7.520901e-01 9.110437e-03 8.193942e-03 -6.000000e+00 3.028851e-01 223.00 -2.00 3.49 -2.00 321.65 0.00e+00 3.397463e-03 3.740151e-03 8.692322e-04 -6.000000e+00 1.423264e-02 278.21 -2.00 20.00 -2.00 321.30 0.00e+00 5.720 0.003 302.00 328.00 3 2.5361e+00 2.8427e-02 6.9043e-02 -6.0000e+00 7.5138e-01 3.9687e-01 3.9024e-02 3.9576e-02 -6.0000e+00 8.2530e-01 -5.2638e-01 4.3490e-02 2.2303e-02 -6.0000e+00 4.8316e-01 2.1972e-01 2.1583e-02 7.6644e-03 -6.0000e+00 2.0383e-01 6.2098e-05 -1.3866e-03 4.8964e-04 1.0385e-04 -6.0000e+00 1.4826e-02 -1.5594e-02 -4.6308e-05 12 9 9 12 9 1 99.90 19.38 0.20 -0.01559 -0.02601 11 4 1 5 0 2373.570 26.21 19.99 19.38 10.54 22.6 921.72 900000 -233484 -158657 900000 -156987 900000 -170666 -201475 900000 27480 -164531 900000 -106183 -54993 6703 -94095 900000 141056 -77062 900000 113936 4362 160447 -15162 900000 900000 14086 -28149 -49049 80086 35505 900000 68774 34878 88223 -8718 90848 9163 32489 98948 30091 14419 -35424 51196 14782 -2159 -7971 52118 -781 16451 12818 19372 27445 -801 18711 11871 24351 -4568 5946 19080 -5108 28924 5534 16872 9100 15592 7712 8174 13612 -5571 6381 7753 5608 2566 693 12611 -9278 7970 -9243 -5905 7310 2012 -1635 -3447 67 76 3794 -1683 -1162 1635 1364 -2503 -959 -3109 2740 1238 -1666 -3356 -2587 -767 2337 -950 1339 -2899 -2581 -212 -2446 -528 -4250 891 672 -1462 -1554 -2815 858 -260 1418 -803 -1063 481 988 2577 1813 1798 -6 2048 266 5231 -915 370 2068 -1043 355 664 -282 137 1011 639 -270 -893 395 -2178 -1054 900000 -8627 -3273 900000 -2826 900000 -3417 -5697 900000 437 -4055 900000 -2143 -896 106 -3101 900000 2241 -2838 900000 1810 82 2549 -365 900000 900000 293 -816 -1671 1272 729 900000 1432 1041 1621 -357 1684 389 1333 2680 1638 959 -3837 2633 1051 -181 -718 2865 -72 1380 1221 1936 2789 -114 2356 1648 3087 -752 861 2385 -809 3634 974 3026 1883 3035 1603 1748 3020 -1691 1913 2402 1760 783 197 2881 -2426 1797 -2723 -1999 2567 854 -796 -1817 36 44 2209 -1065 -733 974 767 -1372 -502 -1709 1590 848 -1364 -3215 -2716 -810 2281 -868 1081 -2381 -2243 -192 -2372 -539 -4920 1106 935 -2236 -2435 -4387 1238 -365 1955 -1171 -1638 759 1545 3827 2609 2512 -8 2673 342 6619 -1375 624 3797 -2118 750 1480 -674 342 2567 1648 -701 -2261 931 -4939 -2266 SS 20231213T132828.8Z 8747.561445 80 1 30.70 2 79.28 132.93 88.73 130.35 0.00 1 0.00 1 0 25 6.446e-01 1.143e-02 2.727e-01 6.407e-03 6.973049e-01 3.463130e-03 7.654391e-03 -6.000000e+00 3.666058e-01 223.00 -2.00 3.49 -2.00 321.38 0.00e+00 4.477710e-03 1.381766e-03 7.383363e-04 -6.000000e+00 1.579385e-02 278.21 -2.00 20.00 -2.00 321.05 0.00e+00 5.175 0.002 302.00 328.00 3 1.8008e+00 1.0526e-02 6.2873e-02 -6.0000e+00 9.1126e-01 1.6043e-01 1.4961e-02 3.6861e-02 -6.0000e+00 9.9744e-01 -1.7858e-01 1.7803e-02 2.1041e-02 -6.0000e+00 5.8401e-01 6.6800e-02 8.8464e-03 7.2103e-03 -6.0000e+00 2.4726e-01 2.3597e-04 -1.1467e-03 1.8769e-04 8.8893e-05 -6.0000e+00 1.8178e-02 -1.4048e-02 -1.0830e-04 12 9 9 12 1 1 99.98 19.37 0.37 -0.01405 -0.02266 37 11 1 5 0 807.800 26.21 20.01 19.37 11.17 22.7 925.92 900000 -168555 16996 -85334 -188687 -51771 -206467 900000 -141826 900000 -101656 -139519 900000 -127966 216542 -88801 62982 -64443 -27453 509550 7599 16230 -90114 900000 -77714 15415 47199 -48826 87422 -52261 13781 -7950 36952 47614 12527 44510 -10753 11151 -13243 5292 -7706 -270 10284 8551 21408 276 6465 1132 12511 14122 5950 3234 2523 8151 -1844 9125 -3355 1906 5941 306 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