File name: Pandora55s1_QueensNY_20210423_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T184455.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210423_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210423 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210423T104726.1Z 7783.449608 181 1 50.21 2 82.91 79.34 113.39 310.16 0.00 1 0.00 1 0 17 9.345e-01 3.449e-02 3.398e-01 9.197e-03 1.277902e+00 6.052079e-03 1.555742e-02 -6.000000e+00 6.024749e-01 229.26 -2.00 3.51 -2.00 322.54 0.00e+00 -1.434514e-02 3.529571e-03 2.467575e-02 -6.000000e+00 3.084564e-02 281.23 -2.00 20.00 -2.00 322.13 0.00e+00 7.451 0.008 302.00 328.00 3 5.3758e-01 2.4286e-02 1.7056e-01 -6.0000e+00 1.5073e+00 2.1111e+00 3.1103e-02 1.8844e-01 -6.0000e+00 1.6439e+00 -2.6583e+00 2.3785e-02 7.7301e-02 -6.0000e+00 9.7056e-01 1.0152e+00 1.1586e-02 1.2682e-02 -6.0000e+00 4.0730e-01 3.8364e-05 -2.7006e-03 2.4124e-04 5.4347e-04 -6.0000e+00 3.1242e-02 5.0083e-03 3.3918e-05 12 8 8 10 0 0 8.03 22.74 0.46 0.00501 -0.01529 44 8 1 5 0 1140.760 25.68 20.03 22.74 9.34 27.4 1032.62 225659 900000 900000 -11275 900000 900000 44058 900000 900000 900000 -39749 89276 -57523 122063 900000 314661 -56377 900000 900000 900000 900000 161045 900000 30361 138634 18335 900000 154456 30013 -67463 192839 900000 132739 15408 3314 900000 19638 89634 900000 900000 33875 142717 17099 105079 217177 900000 54771 900000 900000 900000 25725 22350 70994 23058 900000 317465 328591 381212 900000 142350 5875 900000 15701 -8930 116418 -3357 136304 -10167 118173 93891 13933 43887 115943 8678 189308 33306 68465 259627 28292 44966 -5453 73575 23020 38129 -6122 20600 -3239 7604 -9059 12794 -7481 -10779 4326 5517 5843 3830 -7330 -2679 -4086 -8117 -523 -1766 -483 7341 5660 -4006 -1094 2965 -1299 5771 -851 -8014 -553 -3581 -2313 -2051 1383 3274 -2801 -1896 -1289 331 4684 7981 160 -73 197 3574 -312 -2422 98 2090 1553 887 1179 -756 864 1398 640 -1543 -1001 -341 -22 -2368 2014 900000 900000 -609 900000 900000 897 900000 900000 900000 -2029 1373 -4026 1743 900000 2808 -5799 900000 900000 900000 900000 1565 900000 1033 1769 770 900000 1455 838 -4555 1721 900000 1889 716 167 900000 746 1850 900000 900000 1831 2872 1139 2885 1938 900000 1990 900000 900000 900000 1488 1484 3283 1821 900000 2833 2932 3401 900000 3546 489 900000 1253 -1015 4532 -433 4822 -1499 5689 6416 2238 5669 7610 1468 5189 3518 4636 2703 2969 4747 -1114 8540 4935 7865 -2028 5562 -1132 2460 -3422 3836 -2567 -3627 1229 1617 1913 1511 -3844 -1590 -2827 -6396 -392 -1260 -305 3879 2936 -2349 -659 1826 -916 4357 -803 -9304 -670 -4735 -3082 -2718 1766 4173 -3889 -2699 -1833 447 5728 9017 188 -84 223 3939 -384 -3523 163 3898 3221 1993 2848 -1974 2323 3797 1744 -4214 -2607 -820 -48 -5058 SS 20210423T105745.4Z 7783.456776 184 1 50.81 2 80.98 80.98 114.83 312.29 0.00 1 0.00 1 0 46 8.395e-01 1.877e-02 2.282e-01 3.261e-03 1.069270e+00 1.936570e-03 1.181435e-02 -6.000000e+00 5.112902e-01 229.26 -2.00 3.51 -2.00 321.98 0.00e+00 8.066588e-03 1.154491e-03 1.016985e-02 -6.000000e+00 2.348600e-02 281.23 -2.00 20.00 -2.00 321.53 0.00e+00 6.048 0.004 302.00 328.00 3 5.8747e-01 7.4816e-03 1.0768e-01 -6.0000e+00 1.2798e+00 6.4707e-01 1.1975e-02 1.1190e-01 -6.0000e+00 1.3937e+00 -8.3201e-01 1.2969e-02 4.0796e-02 -6.0000e+00 8.2317e-01 3.3251e-01 5.7331e-03 1.5000e-02 -6.0000e+00 3.4094e-01 2.1158e-04 -2.4099e-03 8.2157e-05 1.5057e-04 -6.0000e+00 2.5777e-02 4.9606e-03 6.0048e-06 12 8 8 10 0 0 20.31 22.75 0.34 0.00496 -0.01315 114 22 1 5 0 441.790 25.68 20.00 22.75 9.97 27.4 1036.26 -283643 900000 900000 -308502 -237208 114027 -322163 900000 36266 -227357 -311413 -250030 -288983 -220851 900000 -86705 -206023 -25013 900000 900000 -19381 49181 -35659 -47294 -114281 -43374 900000 -40470 -73891 -122872 6410 92262 -8843 -72491 29934 900000 -3059 -28422 152007 133285 1708 31216 -12656 9883 1540 139871 -1982 131967 59014 58382 11905 17957 19767 56043 65100 36701 45336 33144 53704 20827 5218 38481 11940 981 20292 6948 19598 3775 14198 19114 2440 10605 11073 3115 13029 3319 9433 15285 3886 735 375 8480 1522 2185 -2329 1953 -2093 -580 -2023 -19 -1093 -1373 -306 924 33 -291 -2060 -1109 -2413 -2340 -946 -922 146 976 -794 -2745 -1428 -1329 -527 -55 -1203 -2459 -615 -752 -707 560 859 1214 -328 -283 -711 761 1340 1825 672 159 863 2227 904 -249 599 641 1233 632 625 -375 18 103 -184 -740 -540 -29 -290 -819 -2407 900000 900000 -4674 -1691 362 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-2.00 20.00 -2.00 320.27 0.00e+00 4.366 0.001 302.00 328.00 3 4.2642e-01 1.7046e-03 6.2575e-02 -6.0000e+00 7.4479e-01 1.0079e-01 2.3188e-03 4.6704e-02 -6.0000e+00 8.0651e-01 -8.2708e-02 2.4086e-03 2.1818e-02 -6.0000e+00 4.7990e-01 2.2495e-02 1.1650e-03 9.3212e-03 -6.0000e+00 2.0055e-01 1.7340e-03 -1.2558e-03 2.6338e-05 8.5643e-05 -6.0000e+00 1.4970e-02 3.8544e-03 1.6811e-05 11 8 0 10 0 0 25.29 22.75 0.22 0.00385 -0.00558 360 68 1 5 0 140.020 25.68 20.01 22.75 11.15 27.5 1042.46 -204134 -144877 -112132 -187960 -179147 -102965 -192078 -119336 -159275 -147068 -163264 -114725 -129309 -111816 -20050 -72264 -77202 -28471 602 -36316 -22286 -34835 -21839 -40666 -33871 -26300 -5906 -28402 -36081 -33341 -23483 -4657 -12014 -12058 -10726 5427 -7964 -6427 767 -703 -4266 -2368 -3889 -2441 159 3597 148 4089 2837 4376 -255 1868 1948 4352 3706 2690 2756 1119 1202 1006 599 3282 2417 1111 1768 968 3384 1208 2596 2062 502 219 -86 -743 -144 -8 798 1761 1127 476 -298 117 -1423 -1032 -1840 -1331 -1066 -982 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