File name: Pandora55s1_QueensNY_20210408_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T182859.9Z 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_20210408_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: 20210408 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 20210408T110915.5Z 7768.464762 80 1 50.94 2 82.90 86.36 72.60 127.34 0.00 1 0.00 1 0 17 9.029e-01 3.506e-02 2.859e-01 8.550e-03 1.098952e+00 5.411778e-03 1.239741e-02 -6.000000e+00 5.705725e-01 228.04 -2.00 3.51 -2.00 322.27 0.00e+00 -3.135767e-03 3.003882e-03 1.099026e-02 -6.000000e+00 2.771819e-02 279.61 -2.00 20.00 -2.00 321.84 0.00e+00 7.441 0.007 302.00 328.00 3 7.1896e-01 2.0502e-02 1.1364e-01 -6.0000e+00 1.4233e+00 1.6750e+00 2.5771e-02 9.7730e-02 -6.0000e+00 1.5530e+00 -2.1194e+00 2.0771e-02 3.7922e-02 -6.0000e+00 9.0618e-01 8.2238e-01 1.0110e-02 1.0085e-02 -6.0000e+00 3.7843e-01 4.1677e-05 -2.5586e-03 2.3626e-04 2.2769e-04 -6.0000e+00 2.9858e-02 1.8926e-03 -1.7625e-05 12 8 8 10 0 0 72.66 22.88 0.44 0.00189 -0.01733 39 7 1 5 0 1305.820 25.79 20.00 22.88 15.37 27.8 1074.12 244796 900000 900000 -71340 182429 900000 900000 900000 900000 114220 -4379 -3569 -57672 900000 900000 184108 -60394 40552 900000 900000 900000 900000 432554 35 146555 -30327 900000 -21048 1399 -32207 13460 900000 121013 -45652 -6471 900000 36947 39506 900000 900000 32026 144862 13515 182848 3074 900000 19116 900000 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-2692 3756 -1121 65 -6293 2083 -4463 -5534 394 280 -2495 1303 -3523 -3316 -2381 -2384 -321 -1266 -380 2953 3379 -3132 -1496 1117 -3042 2124 1166 -9355 251 -3022 -3737 -2481 1797 5357 -3093 1963 -4415 -1004 5581 8469 1386 4759 -2170 3173 1599 -3080 1388 983 3388 2960 2339 -1844 542 2010 505 -4665 1986 -2094 -1639 -3202 SS 20210408T111935.5Z 7768.471939 83 1 50.98 2 80.94 88.03 71.07 129.36 0.00 1 0.00 1 0 25 7.764e-01 1.632e-02 1.965e-01 3.027e-03 9.398742e-01 1.771802e-03 1.023425e-02 -6.000000e+00 4.718668e-01 228.04 -2.00 3.51 -2.00 321.70 0.00e+00 5.677371e-03 9.783607e-04 4.085546e-03 -6.000000e+00 2.217417e-02 279.61 -2.00 20.00 -2.00 321.24 0.00e+00 6.024 0.004 302.00 328.00 3 7.1301e-01 6.4250e-03 8.3922e-02 -6.0000e+00 1.1763e+00 3.8734e-01 9.9605e-03 6.6034e-02 -6.0000e+00 1.2825e+00 -4.7183e-01 1.0935e-02 2.9463e-02 -6.0000e+00 7.5576e-01 1.8428e-01 4.9524e-03 1.2516e-02 -6.0000e+00 3.1437e-01 2.3188e-04 -1.5695e-03 8.1395e-05 1.2837e-04 -6.0000e+00 2.3849e-02 1.2189e-03 6.5122e-06 12 8 8 10 0 0 -15.00 22.88 0.35 0.00122 -0.01057 109 21 1 5 0 463.360 25.79 20.00 22.88 16.08 27.8 1078.58 -216007 900000 900000 -306249 -278440 900000 -252726 900000 -143058 -238573 -298212 -231365 -286876 -148676 900000 -88720 -167345 -76342 900000 154379 900000 5184 78115 -84142 -74504 -87933 900000 -73528 -88618 -82137 -78795 900000 -12224 -69482 -42199 900000 13693 -35192 105916 47299 -1504 9144 -11084 10980 -9514 65431 11552 58481 28159 57247 -4014 14403 -4767 38088 35298 25572 25697 23404 25358 10350 11877 17789 9166 -5858 15546 -1688 14111 -3716 9297 11542 1084 6407 6206 -1235 6213 4872 3732 12948 -609 1302 -187 5097 612 445 -2594 -685 -1429 -2617 -2602 -756 -1141 -2115 688 444 -799 842 -1072 -293 -1640 -947 -880 -46 -604 1811 -480 -1696 -367 -807 -855 -54 -288 -1947 -289 -938 -251 138 1022 1522 189 0 -790 228 964 1351 161 615 261 1750 818 -153 465 79 1035 234 766 -772 65 137 -186 -769 -73 -353 -123 -259 -867 900000 900000 -4289 -2862 900000 -1991 900000 -473 -2197 -5331 -2515 -6819 -1275 900000 -730 -3535 -774 900000 455 900000 30 230 -1254 -1098 -1566 900000 -1184 -1676 -1584 -1766 900000 -226 -2496 -1224 900000 238 -1098 1035 977 -57 351 -549 465 -500 1749 531 1837 1262 2144 -298 1018 -455 2704 2797 2356 2468 2323 2436 1113 1246 1856 1163 -981 2412 -328 2431 -778 1864 2560 296 1801 1785 -370 1617 1173 834 2600 -149 364 -63 1914 272 217 -1381 -377 -831 -1599 -1611 -457 -667 -1188 363 236 -463 548 -821 -257 -1633 -1008 -945 -46 -562 1534 -409 -1514 -340 -789 -900 -62 -370 -2793 -437 -1462 -386 208 1495 2234 288 0 -1279 361 1454 1966 230 857 356 2338 1155 -241 813 152 2101 502 1725 -1839 159 341 -466 -1923 -177 -816 -268 -549 SS 20210408T113954.2Z 7768.486045 96 1 50.49 2 77.09 91.33 68.21 133.49 0.00 1 0.00 1 0 25 3.389e-01 7.169e-03 4.282e-02 9.327e-04 7.069338e-01 5.014345e-04 8.028895e-03 -6.000000e+00 2.011247e-01 228.05 -2.00 3.51 -2.00 320.52 0.00e+00 2.992832e-03 1.989715e-04 1.343696e-03 -6.000000e+00 8.780711e-03 279.61 -2.00 20.00 -2.00 319.97 0.00e+00 4.359 0.001 302.00 328.00 3 4.5887e-01 1.5217e-03 5.7948e-02 -6.0000e+00 5.0009e-01 1.0304e-01 1.9713e-03 3.9146e-02 -6.0000e+00 5.4209e-01 -8.0999e-02 1.9540e-03 1.9104e-02 -6.0000e+00 3.2257e-01 2.2056e-02 9.7118e-04 7.2154e-03 -6.0000e+00 1.3500e-01 1.8766e-03 -1.0817e-03 2.5875e-05 7.2074e-05 -6.0000e+00 1.0111e-02 2.4512e-04 3.0054e-06 11 8 0 10 0 0 -16.87 22.88 0.22 0.00025 -0.00788 355 67 1 5 0 142.190 25.79 20.00 22.88 17.32 28.0 1085.06 -113196 -117215 -2909 -151109 -80175 -146154 -99681 -103068 -79590 -111414 -110965 -88071 -100529 -37685 -35216 -8078 -54535 -9130 -7517 -472 -19317 -17267 -16031 -25558 -16515 -24716 2206 -25893 -16501 -29470 -7253 -6164 -631 -11954 -5206 4586 -5863 -1044 -885 3891 -4891 451 -3560 539 -2752 3804 -166 2511 2858 2366 2430 971 2141 2437 3818 1361 2583 564 1087 354 973 3122 1441 1243 801 1522 1857 1374 2449 2036 245 35 -59 -954 39 -233 1154 707 1250 -402 -179 -347 -1683 -1339 -1603 -1006 -1168 -819 -717 -221 -125 717 681 1386 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