File name: Pandora55s1_QueensNY_20210309_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T181337.1Z 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_20210309_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: 20210309 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 20210309T123018.5Z 7738.521048 132 1 51.06 2 77.08 107.39 68.77 155.54 0.00 1 0.00 1 0 25 4.978e-01 2.321e-02 1.625e-01 3.863e-03 6.634167e-01 2.134250e-03 7.599375e-03 -6.000000e+00 2.985059e-01 225.91 -2.00 3.51 -2.00 320.77 0.00e+00 9.124650e-03 8.713676e-04 1.734665e-03 -6.000000e+00 1.415889e-02 276.72 -2.00 20.00 -2.00 320.26 0.00e+00 4.355 0.001 302.00 328.00 3 3.1226e+00 6.5775e-03 5.7412e-02 -6.0000e+00 7.4059e-01 2.3172e-01 8.4144e-03 4.0944e-02 -6.0000e+00 8.0831e-01 -3.2019e-01 7.9364e-03 1.8579e-02 -6.0000e+00 4.7798e-01 1.3498e-01 3.9118e-03 1.1550e-02 -6.0000e+00 1.9939e-01 1.3732e-04 -2.6092e-03 1.1436e-04 1.0023e-04 -6.0000e+00 1.5235e-02 5.4047e-03 -1.9957e-04 12 8 8 10 0 0 99.96 22.78 0.26 0.00540 -0.01420 39 7 1 5 0 1309.070 25.68 19.98 22.78 12.33 27.2 1067.58 -115492 900000 900000 -214903 30863 900000 -148787 900000 116952 -127376 -176070 -57644 -115657 4598 900000 -37624 -107822 63482 900000 900000 900000 136224 18570 -26868 -24294 -27647 900000 -12462 -15963 -45403 27347 52135 -16553 -17775 11225 310995 10998 -3703 40645 54727 -9998 9766 -6983 15445 -3324 56691 2220 46008 25336 30792 13266 2642 -1701 22749 27821 11540 20555 11661 12589 5912 4229 11769 2692 -6958 10042 -419 11492 379 9665 7472 -4555 -5 6564 -4605 3897 -296 2782 9196 -2224 -1937 -1831 835 -1444 857 -5257 -2292 -3893 -3108 -4581 -298 -2272 -1431 199 1091 -1584 574 -2080 -367 -279 -1406 -611 -400 505 2038 1438 -371 -187 207 -882 812 195 -2637 306 -1083 -966 858 748 2115 -159 270 -1042 294 1205 1607 661 369 440 1323 1067 89 1058 1250 878 782 601 -647 60 -109 -461 -1067 -214 -134 -419 -961 -1751 900000 900000 -10745 146 900000 -3587 900000 440 -3021 -6835 -815 -3400 57 900000 -1059 -6682 894 900000 900000 900000 1141 467 -1056 -974 -1184 900000 -468 -621 -2427 849 1538 -1072 -1275 631 1170 618 -264 2261 3130 -1170 1039 -918 1727 -452 4565 302 4315 2988 3647 1987 480 -353 4071 5057 2524 4260 2627 2785 1363 996 2726 748 -2365 3191 -152 3695 134 3282 2855 -2145 -3 3069 -2322 1723 -126 1055 3167 -881 -856 -936 473 -928 580 -3942 -1767 -3187 -2627 -4001 -249 -1874 -1113 145 770 -1187 466 -1945 -380 -319 -1713 -741 -462 535 2020 1437 -392 -207 238 -1084 1056 277 -4102 485 -1746 -1518 1284 1092 3063 -242 424 -1698 474 1878 2429 982 535 620 1818 1512 137 1764 2226 1643 1517 1215 -1376 131 -242 -1038 -2413 -469 -284 -851 -1917 SS 20210309T123556.1Z 7738.524955 135 1 26.29 2 76.06 108.39 68.35 156.80 0.00 1 0.00 1 0 25 6.741e-01 1.473e-02 2.489e-01 4.689e-03 6.318958e-01 2.578207e-03 7.148433e-03 -6.000000e+00 4.050399e-01 225.91 -2.00 3.51 -2.00 320.62 0.00e+00 4.663354e-03 1.038379e-03 1.425097e-03 -6.000000e+00 1.961909e-02 276.72 -2.00 20.00 -2.00 320.11 0.00e+00 4.059 0.001 302.00 328.00 3 3.1500e+00 7.8790e-03 5.3158e-02 -6.0000e+00 1.0042e+00 3.4065e-02 1.0286e-02 3.6289e-02 -6.0000e+00 1.0935e+00 -2.2010e-02 1.0338e-02 1.7597e-02 -6.0000e+00 6.4357e-01 -8.6252e-04 5.1176e-03 8.4637e-03 -6.0000e+00 2.7073e-01 1.9012e-04 -5.3032e-04 1.4173e-04 7.6059e-05 -6.0000e+00 2.0857e-02 1.2795e-03 1.0260e-04 12 9 9 12 9 1 99.99 22.78 0.07 0.00128 -0.00271 31 12 1 5 0 816.230 25.68 20.03 22.78 12.43 27.2 1068.47 -87822 900000 900000 -163581 23890 900000 -176957 900000 900000 -40572 -190088 900000 -99841 122773 900000 -2809 -106554 381730 288558 331976 183260 46131 79248 -39047 3917 -11967 900000 -14001 -8188 -35813 -2467 33401 -25529 -22159 -522 234430 -4117 -4827 27290 30806 -12653 -869 -8445 591 -1181 24480 -260 12263 14292 12665 8707 -1203 -2465 12586 11451 3925 7560 3796 4344 4300 242 6530 -213 -8351 4105 -2280 6923 -5312 7401 2301 -3070 -1513 3794 -2461 2203 654 2884 5680 -1784 -304 10 2294 -2549 -480 -3019 -440 -2056 -1114 -2435 -558 -675 -879 1744 759 184 847 577 -119 204 -589 -658 -12 -344 2103 206 15 -1162 528 -709 751 -47 -1139 236 -319 -830 61 1361 1814 144 -100 -1375 -173 309 580 -344 561 -343 1766 28 -189 307 978 574 269 235 -701 331 56 -466 -1071 206 -96 271 -212 -591 900000 900000 -2942 109 900000 -3473 900000 900000 -319 -6026 900000 -1876 561 900000 -43 -4669 1743 1318 1516 837 724 948 -1412 104 -388 900000 -481 -267 -1562 -89 1036 -1565 -1455 -29 1597 -243 -322 1625 2102 -1469 -100 -1105 75 -156 2618 -36 1545 1841 1749 1349 -225 -513 2484 2446 942 1821 958 1085 1059 62 1667 -64 -3000 1435 -873 2418 -2058 2682 963 -1497 -781 1921 -1294 1053 294 1171 2159 -748 -140 5 1347 -1730 -344 -2326 -350 -1743 -975 -2191 -492 -576 -714 1315 564 142 714 546 -127 238 -728 -815 -14 -374 2134 213 17 -1332 624 -891 997 -67 -1774 378 -514 -1307 92 1978 2628 218 -157 -2237 -278 486 885 -516 812 -486 2415 39 -290 511 1723 1064 516 470 -1469 712 122 -1038 -2392 446 -201 546 -420 SS 20210309T124602.4Z 7738.531972 138 1 50.70 2 74.25 110.20 67.63 159.11 0.00 1 0.00 1 0 25 1.637e-01 6.969e-03 2.798e-02 1.176e-03 5.716649e-01 6.160676e-04 6.657599e-03 -6.000000e+00 9.636382e-02 225.91 -2.00 3.51 -2.00 319.84 0.00e+00 1.883788e-03 1.927168e-04 8.049961e-04 -6.000000e+00 4.192720e-03 276.72 -2.00 20.00 -2.00 319.28 0.00e+00 3.620 0.001 302.00 328.00 3 1.8536e+00 1.7598e-03 4.6872e-02 -6.0000e+00 2.3865e-01 3.7386e-02 2.1189e-03 3.0322e-02 -6.0000e+00 2.5926e-01 -4.5133e-02 1.8661e-03 1.4961e-02 -6.0000e+00 1.5426e-01 9.2830e-03 9.6768e-04 4.8101e-03 -6.0000e+00 6.4629e-02 1.1404e-03 -1.1791e-03 3.4518e-05 5.4851e-05 -6.0000e+00 4.8836e-03 1.9746e-03 -5.8399e-05 11 8 0 10 0 0 99.78 22.80 0.22 0.00197 -0.00689 161 30 1 5 0 312.920 25.68 20.00 22.80 12.91 27.2 1071.76 -68851 -30963 34416 -83950 -54595 -40230 -75267 -13657 -41887 -45964 -62710 -31299 -35830 -17622 9449 -15089 -21624 -7165 10486 4802 6844 -1895 -2403 -12218 -6577 -7010 8900 -11796 -6584 -11009 -5379 3710 -4495 -5350 -1033 9510 -3193 -1797 1777 975 -3576 -2379 -2110 -847 -1727 2765 -485 2150 1288 2503 1911 343 677 2219 2919 1132 2260 578 280 995 1354 2417 1206 56 227 207 1816 593 1894 1144 -55 -463 137 -1207 -491 -471 470 1597 485 -43 -247 -357 -1805 -1135 -1445 -1114 -910 -584 -659 -172 23 593 744 1433 1383 1287 744 744 -437 -688 -550 -410 79 872 -89 -1033 -556 -657 -280 -21 -130 -450 -254 -64 58 721 782 966 406 -227 -826 -319 -83 -273 73 -17 354 1406 855 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