File name: Pandora55s1_QueensNY_20210110_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T174308.2Z 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_20210110_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: 20210110 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 20210110T131102.3Z 7680.549333 138 1 50.67 2 82.54 127.48 66.62 159.59 0.00 1 0.00 1 0 25 7.591e-01 2.100e-02 2.298e-01 3.890e-03 9.428874e-01 2.286846e-03 1.020460e-02 -6.000000e+00 4.551462e-01 223.61 -2.00 3.51 -2.00 321.90 0.00e+00 6.356268e-03 1.277638e-03 5.397737e-03 -6.000000e+00 2.157837e-02 275.66 -2.00 20.00 -2.00 321.48 0.00e+00 7.144 0.007 302.00 328.00 3 9.6628e-02 8.3805e-03 9.4163e-02 -6.0000e+00 1.1263e+00 5.5079e-01 1.3312e-02 7.3134e-02 -6.0000e+00 1.2341e+00 -6.9885e-01 1.4781e-02 3.2737e-02 -6.0000e+00 7.2788e-01 2.8126e-01 6.6561e-03 1.1669e-02 -6.0000e+00 3.0435e-01 1.5567e-04 -1.5984e-03 1.0788e-04 1.4054e-04 -6.0000e+00 2.3939e-02 -2.5092e-04 4.7875e-05 12 8 8 10 0 0 42.24 22.81 0.37 -0.00025 -0.01226 105 20 1 5 0 477.910 25.68 19.99 22.81 4.52 26.5 1020.26 -250907 900000 900000 -272510 -116513 900000 -263298 900000 -281217 111132 -293732 -154321 -283513 -161845 900000 -51955 -114789 -56762 900000 900000 900000 237263 62424 -101827 -21297 -58794 900000 56376 -95437 -63286 -48103 900000 -43382 1307 12000 900000 -18268 -39970 900000 31926 60969 14778 9094 -8357 46287 157725 36569 82769 73308 54385 6583 32886 5282 99607 53724 36102 53020 44893 33984 25275 16838 29516 18813 -4083 32452 -7409 30423 -3221 24769 14193 5039 7668 14897 -438 10454 3759 7812 15212 -3232 4928 -3339 9306 -1257 1556 -1719 -110 -1644 -3335 -3479 -1955 2136 -2721 4099 240 -862 491 -3543 -891 -2246 -2777 -1723 42 -1262 1981 -124 -659 -2123 -567 -17 259 49 -2995 240 -1184 -367 -333 1144 1491 -15 54 -1163 902 1042 2379 -467 984 -14 2150 587 -216 140 900 734 668 915 -824 252 256 203 -1094 68 -519 -304 -765 -2399 900000 900000 -4402 -441 900000 -3440 900000 -5101 421 -6890 -1064 -8677 -2077 900000 -385 -1871 -600 900000 900000 900000 898 243 -2066 -213 -889 900000 280 -2092 -1095 -856 900000 -1137 25 216 900000 -439 -1317 900000 754 1256 523 363 -409 1377 1649 1260 1935 2018 1961 413 1824 426 3651 3297 2758 3604 3310 2732 2123 1510 2464 1944 -602 3851 -1360 4034 -601 3839 2731 1182 1897 3526 -116 2313 806 1474 2625 -715 1174 -1027 2995 -507 669 -812 -54 -859 -1839 -1957 -1073 1090 -1382 1882 115 -452 290 -2542 -725 -2088 -2811 -1749 39 -1104 1550 -98 -542 -1865 -518 -17 281 60 -4171 350 -1794 -551 -489 1629 2135 -22 85 -1851 1389 1537 3347 -657 1335 -18 2803 818 -337 246 1725 1511 1450 2091 -2006 633 652 520 -2819 169 -1229 -679 -1661 SS 20210110T132237.2Z 7680.557375 141 1 50.33 2 80.83 129.57 65.95 162.32 0.00 1 0.00 1 0 25 6.055e-01 1.639e-02 1.387e-01 2.737e-03 8.116741e-01 1.537696e-03 8.987934e-03 -6.000000e+00 3.617305e-01 223.61 -2.00 3.51 -2.00 321.33 0.00e+00 5.159240e-03 7.462364e-04 1.638707e-03 -6.000000e+00 1.630428e-02 275.66 -2.00 20.00 -2.00 320.87 0.00e+00 5.959 0.004 302.00 328.00 3 8.1814e-01 5.0958e-03 7.3818e-02 -6.0000e+00 8.9632e-01 2.8064e-01 7.3576e-03 4.6909e-02 -6.0000e+00 9.8122e-01 -3.2575e-01 7.9389e-03 2.4000e-02 -6.0000e+00 5.7850e-01 1.3045e-01 3.7435e-03 9.5914e-03 -6.0000e+00 2.3963e-01 2.6739e-04 -1.6174e-03 7.6784e-05 1.0928e-04 -6.0000e+00 1.8472e-02 -6.2391e-05 -5.9796e-06 12 8 8 10 0 0 96.35 22.81 0.23 -0.00006 -0.01222 106 20 1 5 0 470.290 25.68 19.98 22.81 5.16 26.5 1023.69 -236455 -16179 900000 -272849 -121727 900000 -178647 900000 -214896 -120499 -237869 -176202 -243053 -136688 900000 -68118 -107671 30553 900000 900000 900000 -25240 -1330 -62240 -68386 -43844 96056 -35370 -89030 -76041 -45759 37089 -36931 -20874 -926 900000 -6644 -13702 62584 16143 8340 3728 -6413 -9650 16591 45942 7669 26860 21156 19561 701 11671 -551 27846 21752 16440 19384 10756 8880 8855 4096 13142 7840 -3873 12898 -7 11037 -1377 11251 5709 2465 3241 4186 -1346 2745 229 2596 6155 1101 1560 -1811 3293 -2207 -1022 -2103 -1560 -1967 -1897 -2394 -1858 556 -927 1624 -245 -1307 629 -1188 -369 -1678 -1685 -945 -204 -85 1122 -110 -1240 -921 -681 -80 754 -355 -1528 -90 -624 0 421 1302 1430 600 -129 -1043 50 754 1193 -3 545 333 1560 804 -120 276 484 735 431 534 -506 158 -4 -290 -785 -195 -464 -103 -142 -2569 -43 900000 -5852 -595 900000 -1486 900000 -3080 -767 -4976 -2342 -7476 -2052 900000 -874 -2370 206 900000 900000 900000 -359 -15 -1355 -1702 -925 552 -711 -2970 -2387 -1261 580 -1382 -754 -29 900000 -223 -550 1476 700 447 231 -467 -757 1047 2277 554 1708 1503 1523 71 1200 -71 3021 2696 2259 2703 1647 1365 1329 641 1983 1385 -866 2752 -2 2556 -364 2816 1675 834 1174 1539 -509 937 74 748 1674 332 533 -749 1504 -1191 -590 -1304 -1011 -1343 -1348 -1739 -1331 377 -608 994 -152 -865 459 -1005 -352 -1807 -1934 -1085 -222 -86 1038 -102 -1212 -942 -727 -91 924 -483 -2282 -140 -992 -1 639 1920 2117 920 -207 -1708 80 1170 1788 -5 781 467 2140 1152 -190 480 906 1452 893 1156 -1151 370 -9 -698 -1890 -456 -1044 -220 -296 SS 20210110T134307.5Z 7680.571615 155 1 49.08 2 77.92 133.40 65.00 167.26 0.00 1 0.00 1 0 25 2.458e-01 6.584e-03 2.817e-02 8.139e-04 6.530954e-01 4.280402e-04 7.502885e-03 -6.000000e+00 1.434896e-01 223.61 -2.00 3.51 -2.00 320.30 0.00e+00 2.222805e-03 1.563550e-04 9.828924e-04 -6.000000e+00 6.265837e-03 275.65 -2.00 20.00 -2.00 319.79 0.00e+00 4.636 0.002 302.00 328.00 3 1.8847e-02 1.2625e-03 5.7193e-02 -6.0000e+00 3.5365e-01 9.4578e-02 1.5920e-03 3.4828e-02 -6.0000e+00 3.8477e-01 -5.6684e-02 1.5543e-03 1.7503e-02 -6.0000e+00 2.2920e-01 1.0924e-02 7.8947e-04 6.0060e-03 -6.0000e+00 9.6466e-02 2.4799e-03 -9.3944e-04 2.3015e-05 6.6893e-05 -6.0000e+00 7.3227e-03 -1.2532e-03 1.7519e-05 11 8 0 10 0 0 36.63 22.81 0.22 -0.00125 -0.00831 463 88 1 5 0 104.850 25.68 19.98 22.81 5.86 26.4 1027.20 -114454 -80543 -38068 -97028 -76015 -62940 -91612 -41312 -88991 -54168 -87315 -54057 -68336 -40576 -13708 -27478 -23096 -40957 753 -4470 -5707 -7023 -6252 -15316 -11328 -12019 -5091 -12494 -14314 -15005 -11313 -1960 -5345 -4414 -2947 4037 -3091 -2370 1318 -757 -1400 -909 -1999 -2436 118 1716 -180 1003 2091 1891 1139 1798 1153 2976 1841 1594 1351 371 354 705 1282 1908 2129 998 969 467 1894 922 2453 1641 499 24 -332 -714 -448 -259 544 697 684 524 -228 -328 -1621 -1570 -1434 -1017 -1053 -635 -545 -655 158 367 807 1211 1263 1061 700 686 -402 -595 -464 -257 262 1052 -111 -1070 -651 -748 -196 74 -218 -518 -299 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