File name: Pandora55s1_QueensNY_20210528_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T185730.3Z 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_20210528_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: 20210528 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 20210528T102227.1Z 7818.432258 204 1 50.35 2 81.55 68.80 83.24 226.30 0.00 1 0.00 1 0 25 8.707e-01 2.075e-02 1.899e-01 3.686e-03 8.158900e-01 2.180736e-03 9.012725e-03 -6.000000e+00 5.418913e-01 231.87 -2.00 3.51 -2.00 321.63 0.00e+00 8.892371e-03 1.218479e-03 2.475596e-03 -6.000000e+00 2.622792e-02 284.93 -2.00 20.00 -2.00 321.10 0.00e+00 6.401 0.005 302.00 328.00 3 8.1665e-01 8.0912e-03 8.1147e-02 -6.0000e+00 1.3654e+00 3.6854e-01 1.1589e-02 5.6120e-02 -6.0000e+00 1.4871e+00 -5.2042e-01 1.1415e-02 2.3862e-02 -6.0000e+00 8.7623e-01 2.1414e-01 5.1968e-03 1.4351e-02 -6.0000e+00 3.6368e-01 1.7259e-04 -1.7239e-03 1.0667e-04 1.4331e-04 -6.0000e+00 2.7083e-02 1.7546e-03 6.2676e-05 12 8 8 10 0 0 40.35 22.80 0.30 0.00175 -0.01120 87 16 1 5 0 578.600 25.68 20.00 22.80 20.81 28.5 1072.71 900000 900000 900000 -279435 194790 900000 -263019 900000 -204916 -107821 -239492 -134265 -231988 -106237 900000 -39485 -136777 900000 900000 900000 900000 -1982 455514 -107690 -4083 -65092 900000 -53181 -69295 -77290 -45713 501011 -29535 -28576 -1237 900000 -27011 -25140 103475 130436 12154 50258 -1810 1328 33414 96614 14043 29868 60219 37338 7915 12551 9156 43774 30612 25022 25941 23615 25788 14612 7646 22172 9886 -260 16273 -2789 18140 245 17832 6328 3194 4258 9875 -645 11055 3990 6255 7597 -1651 1782 -9 6362 -965 1250 -4571 -1226 -3365 -1036 -1302 -394 -1281 -2041 1132 -722 838 -1322 -3027 -1147 -1113 -2414 -476 -1520 378 1336 -1099 -1439 -1883 -9 -1676 148 -718 -2213 -304 -623 -236 -293 1261 1308 591 -385 -799 -461 1810 1878 516 1065 589 2167 547 -131 658 837 1007 1314 719 -247 286 23 -208 -2089 -285 -78 100 -750 900000 900000 900000 -7854 699 900000 -5660 900000 -2936 -639 -5338 -1222 -6669 -1218 900000 -392 -4049 900000 900000 900000 900000 -22 1634 -3441 -51 -1533 900000 -1133 -1740 -2226 -1148 1797 -942 -1008 -35 900000 -974 -994 1440 1667 543 1732 -108 80 1544 2544 827 1587 2549 2112 643 1092 916 3479 2963 2673 2855 2678 2831 1741 972 2593 1450 -48 2846 -613 3322 54 3544 1560 904 1294 2920 -206 2972 1049 1484 1724 -432 515 -3 2429 -443 613 -2513 -691 -2037 -642 -825 -246 -782 -1195 615 -398 482 -870 -2333 -998 -1088 -2568 -502 -1543 346 1140 -951 -1307 -1811 -9 -1810 172 -931 -3181 -456 -953 -356 -430 1791 1874 881 -602 -1283 -732 2745 2757 746 1499 812 2912 774 -204 1137 1566 1996 2727 1576 -571 684 57 -513 -5210 -687 -179 220 -1607 SS 20210528T103706.4Z 7818.442435 209 1 50.02 2 78.94 71.02 85.20 228.79 0.00 1 0.00 1 0 25 3.410e-01 8.691e-03 1.365e-01 1.536e-03 6.709262e-01 8.425264e-04 7.570069e-03 -6.000000e+00 2.052975e-01 231.87 -2.00 3.51 -2.00 320.75 0.00e+00 5.518637e-03 3.668280e-04 9.615399e-04 -6.000000e+00 9.142264e-03 284.93 -2.00 20.00 -2.00 320.13 0.00e+00 5.027 0.002 302.00 328.00 3 7.5403e-01 2.7151e-03 6.2454e-02 -6.0000e+00 5.1431e-01 7.1680e-02 3.5815e-03 3.8430e-02 -6.0000e+00 5.5538e-01 -7.0176e-02 3.4484e-03 1.9082e-02 -6.0000e+00 3.3071e-01 1.8784e-02 1.6762e-03 9.6886e-03 -6.0000e+00 1.3852e-01 7.9902e-04 -1.0499e-03 4.4273e-05 8.6945e-05 -6.0000e+00 1.0194e-02 1.5552e-03 3.8187e-05 11 8 0 10 0 0 54.08 22.80 0.30 0.00156 -0.00633 198 37 1 5 0 252.550 25.68 20.01 22.80 21.67 28.5 1077.35 -111714 55473 900000 -151496 -76715 37213 -149310 13679 -102946 -96367 -127036 -95285 -104534 -74129 33749 -26097 -58380 -113843 54211 26931 1847 -14333 4861 -27982 -16065 -21598 35842 -27589 -28472 -27600 -13212 1576 -9276 -12594 -3667 14471 -6017 -9229 6237 7450 -3473 333 -5496 -2444 245 6354 -1011 2708 4657 5416 471 2863 1312 5596 5029 1662 3165 1507 1195 -347 1297 3329 2056 818 1994 10 2976 864 3666 2208 135 453 52 -1244 328 234 854 1816 1205 82 30 734 -1207 -932 -1526 -918 -1507 -1036 -924 -575 -9 491 760 1006 1462 824 -48 459 -284 -775 -300 -557 403 1131 -219 -1308 -807 -912 -303 -1 -74 -685 -55 -190 -207 664 1226 1105 440 -257 -1005 -334 34 44 -14 181 345 1577 854 183 218 69 407 357 325 -355 -238 241 -391 -879 -291 1 197 177 -600 83 900000 -1739 -402 66 -1621 35 -886 -854 -1649 -1011 -1500 -1027 206 -362 -1319 -4695 501 353 33 -306 88 -747 -413 -628 608 -888 -931 -944 -448 56 -405 -638 -176 621 -305 -552 387 553 -334 34 -645 -293 30 741 -122 351 577 710 71 471 245 1101 1073 387 756 373 295 -85 317 845 591 252 670 4 1022 303 1323 907 64 218 26 -617 161 105 347 698 486 38 15 435 -825 -654 -1150 -733 -1287 -925 -797 -519 -7 397 576 741 1121 713 -46 504 -336 -943 -364 -670 436 1195 -235 -1427 -930 -1114 -394 -2 -106 -1092 -88 -305 -338 1025 1815 1646 688 -426 -1662 -547 57 69 -21 268 514 2269 1284 293 375 125 786 698 676 -760 -536 555 -887 -1998 -664 2 416 362 SS 20210528T104311.3Z 7818.446659 212 1 49.69 2 77.85 71.94 86.04 229.81 0.00 1 0.00 1 0 25 2.311e-01 6.642e-03 4.632e-02 1.135e-03 6.230481e-01 6.137674e-04 7.107547e-03 -6.000000e+00 1.390986e-01 231.87 -2.00 3.51 -2.00 320.38 0.00e+00 2.301674e-03 2.345830e-04 1.058789e-03 -6.000000e+00 6.120857e-03 284.93 -2.00 20.00 -2.00 319.72 0.00e+00 4.609 0.002 302.00 328.00 3 6.6593e-01 1.8774e-03 5.7253e-02 -6.0000e+00 3.4846e-01 3.8600e-02 2.3778e-03 3.4758e-02 -6.0000e+00 3.7630e-01 -3.1778e-02 2.1961e-03 1.6619e-02 -6.0000e+00 2.2394e-01 3.2275e-03 1.0971e-03 6.0738e-03 -6.0000e+00 9.3477e-02 1.3776e-03 -9.0921e-04 3.3091e-05 6.0222e-05 -6.0000e+00 6.9029e-03 1.4303e-03 3.4427e-05 11 8 0 10 0 0 48.60 22.80 0.20 0.00143 -0.00540 266 50 1 5 0 186.740 25.68 19.99 22.80 21.77 28.5 1077.55 -65557 -31701 -2398 -112572 -65871 -80333 -109509 -25764 -70871 -72516 -85210 -59168 -70847 -40016 2909 -17600 -36872 9067 10468 -4375 -2105 -8524 -4425 -21687 -12103 -16682 13585 -10503 -14954 -18304 -7091 -480 -2454 -7068 -461 4839 -4491 -5133 2320 1372 -2403 -703 -4519 -1391 -1209 3658 -2021 1231 2210 2953 335 738 330 2374 2458 1021 1299 -107 1399 168 1127 1985 1654 605 1092 215 1556 1633 2853 1551 -173 -97 -183 -745 -575 240 572 1224 1512 -34 -96 -622 -1170 -1166 -1299 -1084 -1154 -585 -508 -433 37 489 533 1406 1173 1245 583 551 -450 -698 -348 -261 474 949 -199 -1154 -547 -734 -9 124 -84 -523 -212 -174 18 665 859 954 448 -385 -779 -553 -105 -277 121 -167 433 1323 944 -9 316 56 388 226 266 -364 -145 229 -321 -753 -145 -51 108 210 -380 -172 -11 -1447 -510 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