File name: Pandora55s1_QueensNY_20211215_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T105118.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20211215_L1_smca1c19d20211111p1-8.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: 20211215 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]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 20211215T131923.9Z 8019.555138 212 1 30.47 2 80.63 132.15 124.16 345.94 0.00 1 0.00 1 0 25 4.835e-01 1.483e-02 1.928e-01 3.519e-03 7.010749e-01 1.921041e-03 8.016944e-03 -6.000000e+00 2.846029e-01 222.82 -2.00 3.51 -2.00 321.06 0.00e+00 5.252924e-03 8.864192e-04 2.824391e-03 -6.000000e+00 1.302990e-02 277.25 -2.00 20.00 -2.00 320.56 0.00e+00 5.847 0.004 302.00 328.00 3 9.5961e-01 6.1988e-03 7.0653e-02 -6.0000e+00 7.0093e-01 1.4702e-01 8.5050e-03 4.4357e-02 -6.0000e+00 7.6553e-01 -1.7514e-01 8.8119e-03 1.9683e-02 -6.0000e+00 4.5485e-01 6.7844e-02 4.2323e-03 8.2849e-03 -6.0000e+00 1.9017e-01 3.0184e-04 -2.2289e-03 1.0191e-04 8.2637e-05 -6.0000e+00 1.4766e-02 1.0520e-03 -4.9694e-05 12 9 9 12 1 1 99.43 22.68 0.26 0.00105 -0.01570 51 16 1 5 0 582.540 25.58 20.00 22.68 11.27 29.8 975.46 -91990 -103006 900000 -227033 -66957 27065 -127896 900000 -142824 -40297 -216780 -107844 -205410 -136817 900000 -47265 -80953 -96912 900000 100299 118962 4689 19796 -67098 10350 -32095 900000 -11083 -54006 -68151 -22367 12101 9720 -24295 7996 110319 -15348 -7176 31005 24094 1264 16053 -5547 7662 9110 24795 -3668 18006 17983 17276 8813 -839 426 17254 15246 10268 9531 4201 8864 5105 1913 11222 5331 -170 7250 -444 6403 -775 5146 2660 -658 -1393 2438 -2360 2674 -37 2771 5438 -176 -543 -1342 1061 -1417 -1146 -3481 -1358 -2057 -595 -1050 -209 -1310 -844 181 504 927 621 -541 -235 -958 -1266 -193 -1011 558 2264 244 -960 -893 -1574 129 154 212 -1173 -319 -93 138 716 928 1142 178 -589 -1025 -86 113 1060 112 251 331 1969 493 -42 368 743 571 531 499 -384 36 -121 -441 -610 -315 -341 114 -212 -395 -597 900000 -4784 -292 93 -1015 900000 -1619 -185 -5759 -1160 -6838 -3113 900000 -727 -1983 -3092 900000 578 594 71 267 -2175 175 -856 900000 -251 -1835 -2806 -695 328 319 -1202 301 1576 -741 -365 1326 1301 97 1175 -527 675 810 1969 -389 1626 1707 1763 1063 -123 68 2579 2501 1845 1797 840 1682 986 383 2189 1222 -46 2010 -137 1851 -241 1613 949 -269 -612 1059 -1046 1067 -14 943 1757 -63 -221 -639 565 -857 -743 -2434 -984 -1574 -467 -840 -165 -1009 -616 125 345 663 496 -492 -240 -1080 -1514 -228 -1142 576 2194 241 -1004 -981 -1814 155 201 301 -1806 -509 -149 216 1082 1371 1698 274 -950 -1688 -140 179 1626 168 369 474 2754 725 -67 641 1378 1112 1076 1054 -851 82 -282 -1035 -1430 -722 -753 241 -442 SS 20211215T132825.3Z 8019.561404 218 1 49.23 2 79.38 133.82 124.50 348.45 0.00 1 0.00 1 0 25 3.064e-01 8.306e-03 6.941e-02 1.710e-03 6.431054e-01 9.093295e-04 7.447129e-03 -6.000000e+00 1.790726e-01 222.82 -2.00 3.51 -2.00 320.59 0.00e+00 2.441113e-03 3.657510e-04 1.731543e-03 -6.000000e+00 7.958186e-03 277.25 -2.00 20.00 -2.00 320.06 0.00e+00 5.220 0.003 302.00 328.00 3 7.9915e-01 2.7700e-03 6.2132e-02 -6.0000e+00 4.4092e-01 6.6402e-02 3.5979e-03 3.5993e-02 -6.0000e+00 4.8065e-01 -5.0638e-02 3.5921e-03 1.7397e-02 -6.0000e+00 2.8563e-01 1.1428e-02 1.7862e-03 5.7486e-03 -6.0000e+00 1.2014e-01 6.8432e-04 -1.8790e-03 4.9525e-05 6.8868e-05 -6.0000e+00 9.2875e-03 9.5986e-04 -4.5373e-05 12 9 1 12 1 1 98.91 22.68 0.25 0.00096 -0.01316 129 25 1 5 0 377.300 25.58 20.00 22.68 11.76 30.0 977.89 -142294 -45021 900000 -144155 -42444 -42445 -91686 900000 -65462 -92236 -140389 -68287 -106142 -93596 31923 -37829 -57275 -22854 26664 12318 3520 -13432 469 -27839 -15482 -18347 38627 -17034 -24841 -39069 -10447 -2907 -1874 -21020 -5629 23560 -16356 -7352 6417 4994 -2305 77 -4243 -1680 1020 6446 -2392 4410 3566 7783 2955 -169 1407 5178 5430 2733 3061 579 3298 686 1962 3604 3057 92 2496 154 2252 -662 2301 974 -496 174 219 -1231 99 77 1078 2693 532 -59 -555 312 -1315 -1345 -1828 -1255 -1322 -703 -774 -736 -412 -220 670 1086 1182 984 298 494 -176 -566 -229 -228 315 1062 -237 -876 -642 -772 18 91 185 -804 -44 24 74 760 827 925 90 -393 -903 -477 -109 121 43 87 535 1450 648 -20 282 118 434 237 214 -319 -203 164 -480 -568 -111 -28 65 161 -1444 -216 900000 -1981 -212 -207 -762 900000 -545 -1090 -2822 -780 -2112 -2095 276 -765 -1594 -516 413 233 75 -344 11 -906 -491 -640 820 -605 -948 -1777 -413 -127 -95 -1391 -331 1050 -1107 -523 482 454 -256 9 -558 -226 137 840 -345 616 524 1171 503 -33 296 1146 1285 696 808 158 873 183 522 994 937 32 927 60 853 -258 921 436 -249 93 119 -664 50 36 466 1110 233 -29 -313 197 -925 -1012 -1449 -1043 -1150 -632 -704 -665 -360 -183 530 843 955 871 295 542 -211 -712 -287 -272 350 1120 -255 -989 -756 -946 24 125 273 -1267 -72 39 117 1161 1232 1386 139 -634 -1491 -782 -175 189 67 130 777 2064 957 -32 485 215 823 464 434 -677 -443 363 -1079 -1275 -243 -59 132 323 SS 20211215T133410.9Z 8019.565404 221 1 48.06 2 78.60 134.91 124.68 350.06 0.00 1 0.00 1 0 25 2.017e-01 6.607e-03 4.912e-02 1.095e-03 6.047673e-01 5.737769e-04 7.082706e-03 -6.000000e+00 1.170301e-01 222.82 -2.00 3.51 -2.00 320.35 0.00e+00 1.939036e-03 2.138399e-04 1.533378e-03 -6.000000e+00 5.171449e-03 277.25 -2.00 20.00 -2.00 319.81 0.00e+00 4.892 0.002 302.00 328.00 3 2.8239e-01 1.7094e-03 5.8069e-02 -6.0000e+00 2.8775e-01 3.7641e-02 2.1556e-03 3.3137e-02 -6.0000e+00 3.1354e-01 -2.1640e-02 2.0724e-03 1.6129e-02 -6.0000e+00 1.8703e-01 -3.9657e-04 1.0477e-03 4.9641e-03 -6.0000e+00 7.8683e-02 1.6392e-03 -2.1547e-03 3.1987e-05 6.3700e-05 -6.0000e+00 6.0158e-03 1.9378e-03 -1.1478e-04 11 8 0 10 0 0 -2.44 22.68 0.20 0.00194 -0.01425 291 55 1 5 0 165.130 25.58 20.02 22.68 12.17 30.0 980.92 -69147 -44353 58187 -93710 -53510 -69487 -72402 7329 -51876 -51829 -87373 -45568 -63586 -41087 -1549 -19467 -24605 -21327 2606 -5043 -4334 -13904 -2884 -14086 -10232 -14335 6427 -10650 -10614 -16087 -7430 468 -314 -5730 -4144 5814 -5168 -2113 2135 829 -2831 -205 -2072 -1622 -727 1299 -1432 890 1019 3549 696 895 679 2719 2194 1145 1822 -444 1096 700 1423 2143 2458 468 621 759 1669 1184 2088 1417 19 -187 -204 -974 -333 -376 477 1410 1097 337 -237 -281 -1243 -1257 -1583 -1226 -1056 -529 -644 -426 -64 346 540 1495 1488 1113 646 748 -384 -503 -262 -231 161 942 -291 -1032 -551 -864 -114 61 -154 -567 -170 43 164 778 1067 866 332 -629 -853 -578 -272 -188 73 46 526 1506 837 144 248 28 418 239 117 -392 -178 31 -494 -474 -110 -1 155 228 -511 -306 171 -1170 -426 -633 -719 37 -545 -600 -1557 -599 -1217 -800 -26 -432 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