File name: Pandora55s1_QueensNY_20210122_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175146.7Z 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_20210122_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: 20210122 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 20210122T130639.7Z 7692.546292 121 1 49.33 2 82.07 124.45 122.55 18.07 0.00 1 0.00 1 0 25 7.238e-01 5.046e-02 2.011e-01 1.061e-02 9.226913e-01 6.288543e-03 1.044970e-02 -6.000000e+00 4.474120e-01 224.02 -2.00 3.51 -2.00 321.78 0.00e+00 -7.510541e-03 2.510270e-03 9.443834e-04 -6.000000e+00 2.211059e-02 275.31 -2.00 20.00 -2.00 321.29 0.00e+00 6.778 0.006 302.00 328.00 3 1.9671e+00 2.0277e-02 8.2782e-02 -6.0000e+00 1.1136e+00 1.4486e+00 2.4749e-02 4.9693e-02 -6.0000e+00 1.2266e+00 -1.8596e+00 1.7606e-02 2.4469e-02 -6.0000e+00 7.1839e-01 7.3188e-01 8.9806e-03 9.1642e-03 -6.0000e+00 2.9661e-01 2.9141e-05 -4.0122e-03 3.0393e-04 1.3185e-04 -6.0000e+00 2.3854e-02 2.9465e-03 -2.6823e-04 12 9 8 11 32 0 99.98 22.81 0.46 0.00295 -0.02720 20 4 1 5 0 2466.180 25.68 19.99 22.81 10.10 27.1 1049.40 44396 900000 900000 -54063 900000 900000 90188 900000 307786 125219 -75722 100424 -55953 900000 900000 102090 -4221 900000 900000 900000 900000 101793 126062 25884 14819 25779 900000 22399 5231 -18965 52254 900000 22076 60893 900000 900000 84279 55339 900000 900000 66948 107634 16947 2761 181026 80936 14005 900000 318428 201986 -5995 55030 6718 900000 250532 122038 900000 139979 217636 75103 57706 131353 25694 -28635 84869 -11546 80545 7756 70226 41122 -3783 27293 74296 1338 46041 -1325 41119 77513 -13480 14146 -4132 40290 11327 10113 -11420 15727 -8394 3513 -14301 7299 6546 -3684 7087 -12092 -17352 3940 -11621 -8160 -3961 -10781 -3547 194 -2866 3731 -3074 1603 171 4804 2508 8482 4332 -8620 1261 -1436 -3277 -1713 761 4084 -1575 2349 3776 1066 7186 138 -2170 3069 -1511 707 -1232 -3397 925 4459 1854 860 902 -1822 1607 260 899 -1389 -289 -1715 419 -2569 2597 900000 900000 -7059 900000 900000 2100 900000 3173 2316 -9255 2404 -6353 900000 900000 3728 -440 900000 900000 900000 900000 3375 3176 1711 1146 1844 900000 1459 361 -1564 2341 900000 1652 3328 900000 900000 3270 3024 900000 900000 4894 5707 2119 384 4501 4934 1538 900000 3282 3963 -884 5026 1046 900000 4488 7657 900000 7597 5426 6653 5688 6483 3655 -7482 8440 -2935 8679 1659 8881 7566 -1168 6752 12000 409 8519 -342 6434 8257 -3515 3228 -1316 9868 4126 4058 -5946 6706 -4663 1807 -8754 3603 3114 -1823 3039 -6210 -10003 2127 -8394 -6600 -3494 -10923 -3409 172 -2363 2670 -2305 1204 137 3918 2249 8008 4808 -11963 1737 -2094 -4832 -2441 1038 5455 -2274 3425 5540 1575 9680 190 -2968 3923 -1962 887 -1653 -5190 1544 8023 3670 1819 2019 -4407 3940 655 2267 -3542 -706 -4011 902 -5447 SS 20210122T131742.4Z 7692.553963 124 1 50.77 2 80.37 126.44 121.85 20.97 0.00 1 0.00 1 0 25 7.080e-01 1.356e-02 1.607e-01 2.056e-03 8.479638e-01 1.139676e-03 9.458345e-03 -6.000000e+00 4.171412e-01 224.02 -2.00 3.51 -2.00 321.35 0.00e+00 6.830854e-03 5.550230e-04 3.190291e-03 -6.000000e+00 1.824602e-02 275.31 -2.00 20.00 -2.00 320.90 0.00e+00 5.704 0.003 302.00 328.00 3 4.8890e-01 3.7793e-03 7.5154e-02 -6.0000e+00 1.0302e+00 2.5568e-01 5.5293e-03 5.4232e-02 -6.0000e+00 1.1213e+00 -2.9303e-01 6.1118e-03 2.5115e-02 -6.0000e+00 6.6557e-01 1.1271e-01 2.8749e-03 1.1138e-02 -6.0000e+00 2.7972e-01 4.5249e-04 -1.7946e-03 5.5898e-05 1.1111e-04 -6.0000e+00 2.1491e-02 -2.6128e-03 -1.1900e-05 12 8 8 10 0 0 62.32 22.81 0.21 -0.00261 -0.01610 170 32 1 5 0 296.810 25.68 20.00 22.81 10.75 27.1 1053.67 -303022 -127787 900000 -306568 -125515 -177116 -180134 900000 -161847 -218753 -276390 -166837 -205783 -89781 900000 -89366 -125355 -45308 122708 251426 8395 -42255 -46932 -66817 -51797 -57506 113961 -64169 -34552 -84226 -15331 -8032 -26931 -31511 -2402 102847 -20344 -10128 24625 22130 1778 2072 -4185 -2370 6111 28603 3349 21021 13976 14986 3206 9032 4050 18585 15584 8818 12636 8396 8292 5034 4588 10218 3612 1010 7165 2165 7341 3117 5607 4585 2184 2414 2782 454 2020 352 1908 2874 -45 -191 -178 1370 -1077 -778 -2905 -965 -2208 -1305 -2256 -504 -227 342 618 454 -369 497 -596 -395 -985 -1564 -613 -345 372 1381 5 -1481 -1340 -588 -528 137 -326 -750 -265 -82 -104 591 930 1044 356 -166 -932 57 577 604 -75 374 236 1411 752 69 487 535 896 448 226 -461 -121 235 -433 -1020 -170 -50 -73 7 -4268 -418 900000 -6526 -457 -1019 -1097 900000 -1007 -2561 -6032 -1485 -3352 -654 900000 -1101 -2598 -509 302 504 70 -583 -692 -1252 -910 -1136 453 -1405 -585 -2426 -275 -168 -813 -1122 -68 1081 -697 -354 746 820 92 118 -271 -159 390 1535 235 1317 998 1150 302 908 477 2113 1975 1258 1814 1266 1240 756 692 1540 644 211 1583 532 1748 789 1480 1361 741 879 1039 169 696 113 555 805 -14 -66 -73 645 -582 -456 -1840 -631 -1532 -931 -1651 -361 -157 225 387 284 -246 370 -512 -385 -1074 -1832 -719 -386 380 1309 4 -1471 -1393 -637 -609 171 -450 -1131 -420 -132 -166 917 1408 1586 558 -270 -1555 93 911 925 -112 547 338 1973 1099 111 862 1020 1805 946 501 -1068 -290 570 -1061 -2505 -404 -113 -159 14 SS 20210122T133524.5Z 7692.566256 137 1 51.05 2 77.73 129.73 120.53 25.52 0.00 1 0.00 1 0 25 3.334e-01 7.347e-03 7.521e-02 9.976e-04 7.003578e-01 5.312454e-04 8.066667e-03 -6.000000e+00 1.949461e-01 224.02 -2.00 3.51 -2.00 320.54 0.00e+00 2.730763e-03 2.082862e-04 1.765205e-03 -6.000000e+00 8.487381e-03 275.31 -2.00 20.00 -2.00 320.05 0.00e+00 4.570 0.002 302.00 328.00 3 4.3940e-01 1.5929e-03 5.8841e-02 -6.0000e+00 4.8096e-01 8.7454e-02 2.0793e-03 3.8899e-02 -6.0000e+00 5.2316e-01 -6.0766e-02 2.1339e-03 1.9064e-02 -6.0000e+00 3.1148e-01 1.2489e-02 1.0656e-03 6.5376e-03 -6.0000e+00 1.3096e-01 1.6424e-03 -1.3750e-03 2.7754e-05 7.3654e-05 -6.0000e+00 9.9334e-03 -3.1257e-03 -2.4989e-05 11 8 0 10 0 0 95.66 22.82 0.23 -0.00313 -0.01346 350 66 1 5 0 144.180 25.68 20.00 22.82 12.46 27.3 1062.91 -170964 -83769 68380 -142082 -84632 -125849 -62587 -89895 -50180 -104748 -119315 -87286 -97417 -50447 -27966 -32812 -44171 -19676 -11137 10916 -13336 -9778 -20188 -19813 -21752 -20806 3010 -25147 -14124 -30682 -5967 -6958 -3589 -12299 1395 6327 -5510 -5939 2407 1202 -3863 -83 -5118 -1413 -415 4002 -1661 2067 2057 2543 1727 1706 2638 2924 3827 1399 2673 293 1248 -155 1343 3010 1453 808 794 1254 1817 1624 2149 2047 -236 398 -139 -449 -333 -429 1383 698 1499 -278 262 -488 -1326 -1564 -1472 -1287 -1238 -770 -845 -363 137 928 1012 1498 930 1170 494 631 -336 -661 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