File name: Pandora55s1_QueensNY_20200722_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T162200.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman 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_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20200722_L1_smca1c10d20200414p1-8.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: 20200722 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 20200722T105115.7Z 7508.452265 233 1 51.46 2 78.94 72.88 97.92 58.95 0.00 1 0.00 1 0 25 1.618e+00 1.109e-01 2.181e-01 8.461e-03 5.465403e-01 4.862080e-03 2.047443e-02 -6.000000e+00 1.005025e+00 232.62 -2.00 3.51 -2.00 319.29 0.00e+00 1.084130e-01 1.938870e-03 1.731776e-02 -6.000000e+00 4.970001e-02 289.77 -2.00 20.00 -2.00 318.77 0.00e+00 5.025 0.002 302.00 328.00 3 2.9125e+00 1.5428e-02 5.8311e-02 -6.0000e+00 2.5283e+00 1.8830e+00 1.6721e-02 9.0841e-02 -6.0000e+00 2.7476e+00 -2.2912e+00 7.9304e-03 1.6145e-02 -6.0000e+00 1.6236e+00 9.4827e-01 5.0407e-03 5.7330e-02 -6.0000e+00 6.8052e-01 5.3798e-05 -3.4573e-03 2.4304e-04 1.3712e-03 -6.0000e+00 5.1280e-02 1.1569e-02 -1.9410e-04 12 8 8 10 0 0 96.14 23.05 0.82 0.01157 -0.01441 17 3 1 5 0 3026.250 25.90 19.99 23.05 33.10 25.9 1063.13 900000 900000 429819 743998 900000 429351 900000 498265 271409 275819 323728 161615 900000 900000 900000 256607 -13486 900000 900000 900000 389121 551077 250881 150092 123332 900000 128076 171184 197871 209895 355918 228445 222958 328711 900000 160757 157883 226343 900000 66684 192162 42070 52185 127001 522471 101176 232127 137604 146974 89270 133047 100843 139189 147877 70087 140314 49246 43158 21545 37883 78552 43441 27410 74184 37890 63331 20874 60255 27523 20749 3847 12055 -13315 24880 -7231 12080 6903 -4015 -103 -881 26327 11853 -2375 -16707 -9546 -18221 -10237 -20509 -6571 -10756 -12334 -4424 -20055 -15047 -10828 -20447 -9056 966 -6023 4969 -1509 1618 4114 3765 -7944 -8705 -4240 -3333 5467 -209 -2746 -2894 -720 -5482 -4836 -2981 5110 1220 2028 984 5779 8789 8779 3716 4695 2914 2161 4991 2956 5431 8826 5497 7373 5613 2338 1256 -2181 -3259 -9795 -4 -3286 -1227 -4777 900000 900000 42716 6123 900000 13795 900000 4101 7831 5351 3592 11167 900000 900000 900000 31481 -20714 900000 900000 900000 11024 4536 12252 11628 8214 900000 6222 6332 7332 9583 5506 14559 15828 7994 900000 13951 12493 8530 900000 9295 7844 7161 8890 12095 4300 15518 11309 17057 16843 17530 17413 17902 16859 15364 13295 11923 8545 7319 4475 7415 12170 11022 9310 17996 13316 16964 7802 15067 9559 8081 1793 5102 -6678 8030 -2838 3610 2074 -1415 -40 -418 11113 6239 -1485 -12139 -6684 -14340 -7783 -17549 -5001 -8303 -9107 -2811 -13828 -10076 -7768 -18654 -8804 988 -7132 5428 -1658 1575 3608 3259 -7893 -9223 -4589 -3849 6387 -282 -4090 -4489 -1096 -8381 -7044 -4174 6819 1765 3096 1576 8997 13108 12712 5422 6564 4003 2919 6750 4413 8774 14965 10080 13751 11004 4866 2730 -4945 -7517 -23792 -9 -7191 -2512 -9724 SS 20200722T110830.0Z 7508.464236 350 1 14.01 2 75.80 75.49 95.23 61.84 0.00 1 0.00 1 0 25 2.275e-01 1.225e-02 6.973e-02 4.781e-03 5.195604e-01 2.619684e-03 5.993622e-03 -6.000000e+00 1.393599e-01 232.62 -2.00 3.51 -2.00 319.91 0.00e+00 2.986773e-03 8.579908e-04 4.500438e-04 -6.000000e+00 6.493375e-03 289.77 -2.00 20.00 -2.00 319.13 0.00e+00 3.987 0.001 302.00 328.00 3 2.6479e+00 7.7569e-03 4.8741e-02 -6.0000e+00 3.4896e-01 2.7798e-02 9.4223e-03 2.8462e-02 -6.0000e+00 3.7687e-01 -3.8201e-02 7.7076e-03 1.3804e-02 -6.0000e+00 2.2317e-01 8.9823e-03 3.9386e-03 5.5818e-03 -6.0000e+00 9.4911e-02 3.8725e-04 -6.0042e-04 1.4781e-04 5.4385e-05 -6.0000e+00 7.0227e-03 6.7974e-03 4.0660e-05 12 9 9 12 1 1 36.20 23.04 0.31 0.00680 0.00229 10 8 1 5 0 1257.900 25.90 19.99 23.04 33.76 26.0 1066.86 900000 900000 -95336 -66196 900000 -114173 900000 -77796 -10848 -80460 -38302 -69488 4734 900000 15914 -48507 -11358 57481 27382 94114 -9017 29990 764 -17923 -8172 39146 5758 -10577 2081 -16108 14681 -11592 -4872 1535 47751 4214 -350 7976 8821 -5717 -2729 -1770 -10258 4269 4191 -1391 4875 1997 3410 -6911 2942 -2143 7192 4420 2546 5006 2767 336 911 1004 4625 1585 -2103 4304 -2316 3954 -4159 5532 -621 950 -1283 13 -1792 1079 -195 1557 2524 -1249 927 -1847 2051 -688 -1131 -2143 -1020 -1901 -249 -1049 -924 -922 54 1346 -126 2001 1306 -94 -219 48 -1117 119 -677 -501 2068 1093 -237 -1499 -540 -543 652 15 -446 2 150 -505 179 1119 970 706 -695 -952 -889 563 566 -131 233 -328 1822 -63 478 252 732 119 689 410 -223 -263 -126 -290 -560 13 -546 396 -303 900000 900000 -2510 -1270 900000 -3373 900000 -2031 -165 -2479 -855 -2398 100 900000 437 -2750 -499 1441 969 1856 -478 1129 40 -1189 -525 1675 335 -703 124 -1235 967 -1116 -481 147 2937 399 -39 969 1259 -1062 -541 -368 -2389 892 892 -315 1061 455 795 -1869 790 -655 2183 1462 891 1778 1017 126 336 371 1732 659 -986 2052 -1191 1885 -2079 2623 -337 559 -825 9 -1180 668 -114 837 1275 -657 518 -1189 1424 -534 -936 -1875 -930 -1831 -247 -1063 -936 -911 51 1183 -109 1717 1202 -97 -245 58 -1432 151 -835 -581 2260 1212 -276 -1841 -684 -718 901 23 -695 3 238 -785 267 1613 1400 1047 -1082 -1526 -1437 890 877 -199 345 -475 2540 -90 719 405 1238 209 1242 765 -434 -527 -258 -600 -1165 27 -1091 763 -578 SS 20200722T111332.1Z 7508.467732 356 1 50.13 2 74.88 76.26 94.42 62.67 0.00 1 0.00 1 0 25 5.091e-01 3.644e-02 1.472e-01 7.141e-03 4.850378e-01 3.965330e-03 5.601083e-03 -6.000000e+00 3.139857e-01 232.62 -2.00 3.51 -2.00 320.14 0.00e+00 7.877861e-03 1.347385e-03 3.914791e-04 -6.000000e+00 1.439728e-02 289.77 -2.00 20.00 -2.00 319.37 0.00e+00 3.758 0.001 302.00 328.00 3 4.3285e+00 1.1926e-02 4.6182e-02 -6.0000e+00 7.9058e-01 1.6968e-01 1.4521e-02 2.8599e-02 -6.0000e+00 8.5680e-01 -1.1945e-01 1.1331e-02 1.4389e-02 -6.0000e+00 5.0644e-01 3.1130e-02 5.7005e-03 1.0146e-02 -6.0000e+00 2.1294e-01 8.6348e-05 -4.7933e-04 2.2864e-04 9.4712e-05 -6.0000e+00 1.5788e-02 9.1756e-03 1.7217e-04 12 8 8 10 0 0 99.99 23.05 0.80 0.00918 0.00557 36 7 1 5 0 1392.230 25.90 20.02 23.05 33.96 26.0 1067.87 900000 900000 -123065 -65140 39719 -107311 900000 30630 -36469 -62276 -89652 -70261 24600 900000 89309 -78404 44189 900000 447728 900000 5820 62953 -14694 -44181 16538 132526 13536 -28091 -4420 -22149 157030 -10094 -8055 30233 900000 -3992 -22683 41526 48215 -8020 2978 -8680 -24589 18643 44170 -6756 33961 9910 16787 -15783 21027 -7078 28950 20244 12505 22799 12220 13438 937 9165 11147 4197 -10117 17531 -9129 14413 -12906 14878 3701 12 -2968 3915 -5895 7384 2682 3025 11891 -6392 1870 -7508 10931 3373 -1441 -4540 -1657 -5094 -2151 -4624 -562 -385 -3042 3726 -5099 979 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