File name: Pandora55s1_QueensNY_20210514_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T184740.2Z 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_20210514_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: 20210514 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 20210514T102313.3Z 7804.432793 64 1 50.61 2 83.06 71.20 99.56 47.11 0.00 1 0.00 1 0 31 9.950e-01 4.968e-02 3.079e-01 1.119e-02 1.078039e+00 7.252610e-03 1.352293e-02 -6.000000e+00 6.460516e-01 231.01 -2.00 3.51 -2.00 322.34 0.00e+00 -1.616593e-02 3.875801e-03 1.840870e-02 -6.000000e+00 3.266047e-02 283.53 -2.00 20.00 -2.00 321.88 0.00e+00 7.583 0.008 302.00 328.00 3 1.0189e+00 2.7821e-02 1.3723e-01 -6.0000e+00 1.6131e+00 1.7633e+00 3.4169e-02 1.3484e-01 -6.0000e+00 1.7534e+00 -2.2545e+00 2.2831e-02 5.1231e-02 -6.0000e+00 1.0340e+00 8.5008e-01 1.1421e-02 8.7634e-03 -6.0000e+00 4.3636e-01 2.8311e-05 -3.2075e-03 3.1782e-04 3.9202e-04 -6.0000e+00 3.3237e-02 4.7412e-03 1.2938e-05 12 8 8 10 0 0 12.98 22.85 0.59 0.00474 -0.01936 31 6 1 5 0 1632.000 25.68 20.00 22.85 18.67 28.4 1072.50 23542 900000 900000 -30038 900000 900000 -41483 900000 900000 234630 -1701 43570 -55131 153919 900000 369573 -37353 63896 900000 900000 900000 139804 900000 65578 52578 33476 900000 19353 58533 -63809 900000 900000 69945 -40347 183846 900000 22522 10522 900000 900000 37449 900000 51418 238008 188403 900000 50418 900000 900000 900000 30843 42956 41313 900000 900000 361164 340608 900000 900000 112583 103423 900000 41954 -3178 131335 -24315 178466 5812 146099 76835 11764 28788 101967 8236 543401 21245 40345 111590 2910 17397 -6380 77208 8287 37683 -6311 15955 -5232 8866 -12268 16039 -13702 -9168 4721 -1880 14984 7728 -11814 -5103 -1662 -6483 32 -5242 3965 16079 3731 -2192 -3625 4523 -1349 11150 -94 -13162 -1149 -44 -4666 -1379 177 4095 -1574 1273 -4123 -2430 7241 11366 315 590 675 2911 -3131 -4830 397 2896 3260 1698 1954 115 1033 2115 1863 -7265 -912 589 1895 -1596 1309 900000 900000 -2310 900000 900000 -2437 900000 900000 2545 -82 1401 -4920 2025 900000 4009 -3885 2541 900000 900000 900000 2145 900000 2083 2063 1648 900000 948 1725 -5644 900000 900000 2264 -3932 1994 900000 1058 598 900000 900000 2568 900000 3288 2582 2851 900000 2579 900000 900000 900000 2156 2946 3164 900000 900000 3917 3694 900000 900000 4844 4496 900000 3430 -442 5620 -4762 5134 888 6345 7235 2283 5086 9171 1710 5894 3161 4472 6052 469 2805 -1524 9912 2324 8845 -2380 5161 -2145 3298 -5596 5504 -5928 -3595 1569 -675 5029 3210 -6930 -3284 -1184 -5251 25 -4049 2556 8469 2156 -1397 -2480 3041 -1040 8643 -93 -16609 -1432 -57 -6350 -1799 225 5078 -2129 1744 -6036 -3430 8964 12983 388 709 793 3332 -4014 -7163 651 5210 6397 3629 4459 283 2649 5502 4876 -20262 -2338 1400 4149 -3446 SS 20210514T103342.6Z 7804.440076 67 1 51.13 2 81.17 72.83 98.12 48.93 0.00 1 0.00 1 0 46 6.542e-01 2.436e-02 2.265e-01 3.853e-03 9.382827e-01 2.277392e-03 1.029154e-02 -6.000000e+00 4.024183e-01 231.01 -2.00 3.51 -2.00 321.82 0.00e+00 9.771086e-03 1.320524e-03 3.471725e-03 -6.000000e+00 1.864691e-02 283.53 -2.00 20.00 -2.00 321.34 0.00e+00 6.161 0.004 302.00 328.00 3 9.0450e-01 8.6176e-03 8.5900e-02 -6.0000e+00 1.0096e+00 6.5468e-01 1.2423e-02 6.8839e-02 -6.0000e+00 1.0974e+00 -8.8495e-01 1.2207e-02 2.7575e-02 -6.0000e+00 6.4675e-01 3.6104e-01 5.5073e-03 1.5845e-02 -6.0000e+00 2.6591e-01 1.6056e-04 -2.3041e-03 1.0338e-04 1.6520e-04 -6.0000e+00 2.0075e-02 4.5553e-03 1.9975e-05 12 8 8 10 0 0 -4.81 22.86 0.37 0.00456 -0.01276 86 16 1 5 0 587.580 25.68 20.00 22.86 19.36 28.4 1076.48 -219469 47610 900000 -248379 -67903 900000 -270960 900000 -86238 7087 -220172 -127041 -244077 -64097 900000 -45365 -148819 107812 900000 900000 42130 -52571 900000 -63619 -16329 -65107 900000 -33383 -15904 -110396 -9506 101389 -13633 -52919 31671 900000 -2188 6861 163074 174853 28457 92842 18941 14095 50377 194859 22513 47379 84265 57247 19426 17607 21436 76040 57559 48749 43716 37959 47156 24467 19226 32035 14662 6301 28769 2647 30525 4901 24109 13271 8691 7998 15868 2536 18834 5091 6834 10979 -603 2284 -2647 9272 -798 2394 -2762 880 -3635 35 -3499 -725 -3413 -1579 877 -2879 -39 -1431 -3569 -2493 -1322 -2163 -1566 -1317 -1159 2144 -1455 -2438 -2744 -867 -1033 66 -994 -3387 -723 -604 -486 82 874 1126 1 103 -336 289 2445 2439 1117 902 1116 2439 946 -494 565 1358 1416 934 677 -191 172 523 -130 -2293 -433 -465 78 -915 -3462 179 900000 -6792 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-6.000000e+00 9.522299e-03 283.53 -2.00 20.00 -2.00 319.97 0.00e+00 4.389 0.001 302.00 328.00 3 6.4922e-01 1.7988e-03 5.8628e-02 -6.0000e+00 5.4250e-01 7.7544e-02 2.3473e-03 3.9817e-02 -6.0000e+00 5.8644e-01 -6.3491e-02 2.2794e-03 1.9119e-02 -6.0000e+00 3.4894e-01 1.4232e-02 1.1227e-03 7.9110e-03 -6.0000e+00 1.4563e-01 1.5216e-03 -1.0975e-03 2.9656e-05 7.2467e-05 -6.0000e+00 1.0801e-02 3.8448e-03 2.4050e-05 11 8 0 10 0 0 17.73 22.87 0.24 0.00384 -0.00440 305 58 1 5 0 165.500 25.79 19.98 22.87 21.32 28.6 1087.06 -180267 -59780 -4987 -157372 -117848 -131227 -109377 -81361 -69453 -119502 -108502 -121204 -87758 -73082 -14935 -32336 -51504 -18403 -1887 8687 -30768 -20807 -20651 -12712 -32347 -16488 -2150 -22501 -11135 -29849 -6697 -10026 3242 -18387 -542 7532 -1767 -7634 2590 2770 -3919 -188 -3833 -48 -1736 4436 -1694 2550 1564 3538 1268 1141 1364 3117 3118 1018 2864 -548 1969 -167 1969 1791 2073 1232 1324 1229 1994 1608 2460 2091 -290 147 -17 -422 -150 -228 483 960 1282 87 26 -292 -1233 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