File name: Pandora55s1_QueensNY_20210314_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T181314.3Z 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_20210314_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: 20210314 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 20210314T115059.4Z 7743.493743 59 1 50.87 2 82.75 99.42 93.07 90.49 0.00 1 0.00 1 0 25 6.696e-01 4.092e-02 2.173e-01 9.115e-03 1.024689e+00 5.731764e-03 1.139497e-02 -6.000000e+00 4.263246e-01 226.14 -2.00 3.51 -2.00 322.11 0.00e+00 1.204170e-02 2.942476e-03 1.253246e-02 -6.000000e+00 2.205885e-02 277.03 -2.00 20.00 -2.00 321.68 0.00e+00 7.317 0.007 302.00 328.00 3 9.7504e-01 2.0288e-02 1.2339e-01 -6.0000e+00 1.0584e+00 1.7598e+00 2.4321e-02 1.2308e-01 -6.0000e+00 1.1587e+00 -2.1260e+00 1.8222e-02 3.2052e-02 -6.0000e+00 6.8445e-01 8.1638e-01 9.2587e-03 2.0693e-02 -6.0000e+00 2.9136e-01 3.6071e-05 -2.8856e-03 2.5606e-04 1.4172e-04 -6.0000e+00 2.2648e-02 4.3033e-04 1.6801e-05 12 9 8 11 8 0 25.16 22.78 0.76 0.00043 -0.02125 31 6 1 5 0 1640.600 25.68 19.99 22.78 12.14 27.3 1065.03 900000 900000 900000 -28051 900000 900000 18305 900000 900000 209674 -66494 69469 -9854 900000 900000 120292 -65208 900000 900000 900000 900000 900000 900000 26911 151330 26376 900000 37133 73114 -15197 88681 900000 24022 13923 70156 900000 64193 141604 900000 900000 9769 211264 33134 168047 61778 900000 66837 900000 207311 900000 96677 29232 24041 900000 257393 138194 900000 167392 175511 133704 40817 900000 9679 -22385 87659 12287 93779 11245 10905 57123 8784 19438 112892 -7403 77097 3059 42968 94665 -3396 2787 833 50488 12921 26818 -4903 16120 -10239 1382 -14554 7249 -3912 -10215 10406 5570 -4515 -3143 -3626 -5241 1578 -6985 -1196 -1350 -4959 5548 3073 4471 -2286 3137 -6191 4837 -1077 -7999 -1470 -3345 -4552 -1240 1743 3693 -902 1007 -2558 1348 4784 6656 1443 1641 92 1823 370 -1295 631 3666 1186 1246 178 -416 871 1129 -226 -2308 1486 -770 81 -3705 900000 900000 900000 -2496 900000 900000 625 900000 900000 1854 -4007 1154 -416 900000 900000 2675 -9494 900000 900000 900000 900000 900000 900000 1216 1953 1096 900000 1201 1578 -793 1931 900000 1387 947 2699 900000 2272 2447 900000 900000 818 2627 2361 3247 3273 900000 3294 900000 2749 900000 4305 2711 2539 900000 3182 5555 900000 4908 4505 4812 3440 900000 1224 -4349 6713 2036 7252 1930 1985 7432 1988 4211 10142 -1966 8402 595 5130 6705 -651 586 215 9606 3964 7895 -2048 5803 -4885 611 -7539 3015 -1728 -4533 3656 2055 -1983 -1576 -2165 -3739 1213 -6318 -1046 -1119 -3831 3538 1953 2906 -1666 2307 -5369 4275 -1149 -10231 -1934 -4661 -6416 -1670 2252 4749 -1250 1433 -3809 1905 6256 8192 1811 2006 111 2161 470 -1894 1045 6608 2364 2646 406 -1006 2171 2863 -581 -5986 3612 -1795 174 -7882 SS 20210314T120114.4Z 7743.500861 62 1 50.83 2 80.84 101.14 91.16 92.09 0.00 1 0.00 1 0 33 6.552e-01 1.759e-02 1.523e-01 3.040e-03 8.800205e-01 1.737865e-03 9.663697e-03 -6.000000e+00 3.940221e-01 226.14 -2.00 3.51 -2.00 321.55 0.00e+00 1.026975e-02 8.947776e-04 2.679149e-03 -6.000000e+00 1.803599e-02 277.03 -2.00 20.00 -2.00 321.10 0.00e+00 5.966 0.004 302.00 328.00 3 8.4459e-01 5.9751e-03 7.9156e-02 -6.0000e+00 9.7959e-01 4.2011e-01 8.7571e-03 5.8229e-02 -6.0000e+00 1.0692e+00 -5.1524e-01 9.4608e-03 2.6507e-02 -6.0000e+00 6.3169e-01 2.0668e-01 4.3918e-03 1.5033e-02 -6.0000e+00 2.6312e-01 2.2815e-04 -1.8431e-03 8.2692e-05 1.4962e-04 -6.0000e+00 2.0099e-02 5.7849e-04 2.4125e-06 12 8 8 10 0 0 57.30 22.78 0.34 0.00058 -0.01327 100 19 1 5 0 503.180 25.68 19.99 22.78 12.76 27.3 1068.20 -199914 900000 900000 -281459 -218245 -144998 -232329 900000 -94069 -172002 -274125 -171726 -220894 -105323 900000 -107593 -182042 -70838 900000 90558 900000 -14276 21276 -75766 -23488 -53356 900000 -46051 -9847 -77663 -19603 73699 -36405 -50117 -6639 900000 6518 24178 38634 72495 -15619 8805 -3718 14696 6640 82271 797 38899 22113 30553 21769 6369 1955 36292 25784 19165 23835 15577 16214 11882 6805 18489 5935 -6607 13913 2242 16178 2977 14462 9826 2959 3459 8366 -1459 5372 -1090 5516 7667 -2484 -6 -583 4021 275 433 -2960 42 -3195 -2159 -2673 -677 -399 -1815 684 575 -363 -310 -1453 -552 -967 -1943 -916 -277 -553 1940 -479 -1870 -1768 -384 -1466 31 -383 -1417 -364 -601 -829 151 1216 1269 274 190 -586 536 1301 1086 337 565 679 1647 1045 -43 391 802 830 548 260 -408 -97 236 -411 -811 -311 -229 16 -582 -1399 900000 900000 -6193 -2486 -760 -2854 900000 -343 -1432 -6473 -1732 -4542 -973 900000 -1746 -7139 -1111 900000 349 900000 -158 166 -1561 -311 -978 900000 -804 -124 -2022 -353 682 -1174 -2076 -189 900000 164 575 947 1531 -864 427 -217 760 380 2402 52 1862 1325 1843 1570 595 213 3160 2668 2210 2721 1938 1974 1459 876 2254 910 -1300 2549 486 3145 668 3122 2471 886 1110 2618 -486 1571 -308 1350 1791 -680 -2 -215 1657 132 227 -1693 24 -2022 -1406 -1777 -439 -249 -1092 386 325 -221 -213 -1165 -503 -995 -2156 -1021 -292 -535 1708 -425 -1744 -1732 -390 -1609 37 -506 -2072 -559 -944 -1294 228 1791 1881 422 303 -958 854 1994 1613 490 800 940 2239 1488 -67 686 1527 1682 1161 581 -955 -235 580 -1019 -2009 -747 -524 34 -1234 SS 20210314T122111.5Z 7743.514716 75 1 50.91 2 77.15 104.56 87.44 95.21 0.00 1 0.00 1 0 25 2.693e-01 6.666e-03 4.852e-02 9.982e-04 6.740478e-01 5.307459e-04 7.684444e-03 -6.000000e+00 1.587106e-01 226.14 -2.00 3.51 -2.00 320.40 0.00e+00 3.174433e-03 2.017135e-04 1.262929e-03 -6.000000e+00 6.904339e-03 277.03 -2.00 20.00 -2.00 319.88 0.00e+00 4.379 0.001 302.00 328.00 3 6.3902e-01 1.5872e-03 5.6533e-02 -6.0000e+00 3.9322e-01 8.6249e-02 2.0224e-03 3.6983e-02 -6.0000e+00 4.2699e-01 -5.6120e-02 1.9990e-03 1.8199e-02 -6.0000e+00 2.5407e-01 1.0288e-02 1.0055e-03 6.9198e-03 -6.0000e+00 1.0651e-01 1.6301e-03 -1.0201e-03 2.7957e-05 7.0049e-05 -6.0000e+00 8.0295e-03 -1.2256e-03 -7.4817e-06 11 9 0 11 8 0 43.41 22.80 0.20 -0.00123 -0.00889 306 58 1 5 0 164.710 25.68 19.99 22.80 14.02 27.5 1075.28 -59820 -87565 19585 -141611 -107232 -70789 -116946 -19940 -77777 -63901 -104711 -52299 -80442 -25358 -14421 -25551 -50946 -13291 124 -12198 2650 -12142 -6457 -19751 -7942 -18278 7239 -16983 -11937 -18521 -9209 1767 -8395 -8630 -5498 8586 -6856 -2241 554 2007 -4522 -2322 -3464 -839 -726 1746 345 837 2404 1782 1864 376 1317 3392 2480 2058 1323 578 407 1245 766 3177 1321 305 1062 987 2484 673 2490 1336 524 -458 131 -1055 -306 -377 680 1275 855 411 -264 143 -1733 -1139 -1669 -981 -1133 -693 -575 -463 41 575 762 1219 1283 951 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