File name: Pandora55s1_QueensNY_20210606_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T185859.5Z 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_20210606_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: 20210606 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 20210606T102026.5Z 7827.430862 119 1 49.60 2 81.39 67.38 58.49 107.18 0.00 1 0.00 1 0 25 7.337e-01 4.738e-02 2.732e-01 1.127e-02 7.860824e-01 7.363441e-03 1.065618e-02 -6.000000e+00 4.806283e-01 232.39 -2.00 3.51 -2.00 322.00 0.00e+00 5.388394e-03 4.228823e-03 2.204444e-02 -6.000000e+00 2.808441e-02 285.82 -2.00 20.00 -2.00 321.50 0.00e+00 6.297 0.004 302.00 328.00 3 2.8133e+00 2.8496e-02 1.5743e-01 -6.0000e+00 1.2181e+00 9.4016e-01 3.6235e-02 1.8941e-01 -6.0000e+00 1.3377e+00 -1.4956e+00 2.7115e-02 4.0810e-02 -6.0000e+00 7.7486e-01 6.1752e-01 1.2609e-02 2.6002e-02 -6.0000e+00 3.2131e-01 2.4988e-05 -4.9008e-03 3.7671e-04 9.7684e-05 -6.0000e+00 2.4909e-02 9.9216e-03 2.7421e-05 12 9 8 11 32 0 41.52 22.76 1.73 0.00992 -0.02691 17 3 1 5 0 2917.220 25.68 19.98 22.76 30.92 29.4 1100.00 129069 900000 900000 -63734 900000 900000 219233 900000 900000 207714 900000 -33308 -55822 -84709 900000 900000 -37010 900000 900000 900000 900000 900000 900000 56965 900000 71239 900000 900000 85605 53859 900000 900000 67435 17286 900000 900000 85195 76326 900000 900000 46632 900000 26484 61635 205686 900000 24393 900000 900000 900000 900000 87306 12677 900000 900000 251807 900000 345685 900000 119834 45376 176573 66298 7068 139732 -26830 76555 -2052 159148 50249 -10037 15946 103286 2989 137366 38096 51902 87350 6383 12714 5516 53480 15984 23180 -10695 1698 -5511 -4558 -11551 6633 -7386 -569 8748 -466 2264 8117 -11555 -6084 -284 -9033 -584 -98 4606 12255 4115 -1185 -2577 1125 -654 4867 2443 -9968 -2623 -1838 562 -3334 -1617 7024 -1669 1423 -5780 -1899 8163 3502 -245 1184 836 4304 -2456 -2263 -499 4122 3675 2496 2164 -1116 2420 -53 436 -1923 -2963 -1200 908 -1215 1408 900000 900000 -4654 900000 900000 2391 900000 900000 2265 900000 -1216 -2851 -6872 900000 900000 -2854 900000 900000 900000 900000 900000 900000 1593 900000 1738 900000 900000 1546 1314 900000 900000 2071 932 900000 900000 2133 2228 900000 900000 2684 900000 2035 3392 2701 900000 1866 900000 900000 900000 900000 4470 1459 900000 900000 3262 900000 3770 900000 5365 4075 4504 5430 1147 6898 -6886 7253 -411 6999 7033 -2784 3724 10735 788 9306 6108 6595 7496 1234 2608 1432 10248 4945 7338 -4945 743 -2721 -2328 -6458 3118 -3824 -263 3508 -201 999 3813 -7550 -4378 -220 -8261 -504 -80 3330 7677 2760 -876 -2053 916 -582 4532 2611 -13133 -3485 -2487 737 -4409 -2059 8355 -2224 1945 -8678 -2759 10600 4584 -323 1505 1037 5099 -3205 -3250 -794 6941 6660 4824 4435 -2482 5475 -124 1040 -4671 -7094 -2710 1902 -2501 SS 20210606T103415.3Z 7827.440455 124 1 50.48 2 78.96 69.47 56.02 109.86 0.00 1 0.00 1 0 25 4.761e-01 1.484e-02 1.205e-01 2.913e-03 6.904003e-01 1.658774e-03 7.777930e-03 -6.000000e+00 2.921186e-01 232.39 -2.00 3.51 -2.00 321.08 0.00e+00 7.834726e-03 7.922054e-04 5.932578e-04 -6.000000e+00 1.395289e-02 285.82 -2.00 20.00 -2.00 320.48 0.00e+00 5.034 0.002 302.00 328.00 3 1.9287e+00 5.5989e-03 6.3248e-02 -6.0000e+00 7.3400e-01 1.0411e-01 7.5648e-03 3.9859e-02 -6.0000e+00 7.9506e-01 -2.0699e-01 7.2535e-03 2.0874e-02 -6.0000e+00 4.7137e-01 8.1825e-02 3.4427e-03 1.2056e-02 -6.0000e+00 1.9648e-01 2.4574e-04 -1.3280e-03 8.6061e-05 1.2097e-04 -6.0000e+00 1.4721e-02 1.6174e-03 3.5319e-05 12 8 8 10 0 0 5.77 22.76 0.35 0.00162 -0.00836 79 15 1 5 0 638.890 25.68 20.01 22.76 31.81 29.5 1100.00 -172060 900000 900000 -252801 900000 86566 -174137 900000 -83363 -117651 -173645 -157277 -144641 -157699 900000 -3905 -92305 -15381 900000 900000 31896 -7388 -2176 -55744 -16691 -48772 900000 -47910 -36369 -70790 461 14876 -2675 -32173 15624 77836 -13335 -4343 40459 32346 -9656 24489 -10851 1758 2370 39272 565 22127 19680 16128 -1705 3234 -1756 18301 19847 5568 12456 5959 10351 691 2076 10499 4630 -447 6876 -3138 5668 -559 7472 3410 -1128 682 3480 -951 3721 449 2875 2339 -1495 -1081 -309 1359 37 -350 -2489 -1799 -2124 -1458 -1703 -751 -1052 172 -95 649 219 698 -808 -232 -749 -1527 -249 -620 791 1087 259 -1617 -1277 -913 -487 535 120 -927 -491 -110 -347 255 974 1342 268 -24 -1195 -243 593 1304 118 323 680 1745 494 -338 542 597 773 632 327 -336 127 137 -550 -576 -811 -153 -124 24 -1696 900000 900000 -7514 900000 246 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20.00 -2.00 320.11 0.00e+00 4.609 0.002 302.00 328.00 3 1.7825e+00 3.7065e-03 5.8414e-02 -6.0000e+00 6.9831e-01 2.6914e-02 4.8507e-03 3.7167e-02 -6.0000e+00 7.5369e-01 -8.0853e-02 4.5754e-03 1.8017e-02 -6.0000e+00 4.4904e-01 2.4986e-02 2.2267e-03 8.7629e-03 -6.0000e+00 1.8914e-01 4.4883e-04 -9.5452e-04 6.1483e-05 7.9523e-05 -6.0000e+00 1.3818e-02 1.2530e-03 4.6160e-05 12 8 8 10 0 0 28.47 22.76 0.27 0.00125 -0.00592 114 22 1 5 0 440.310 25.68 19.99 22.76 32.30 29.5 1100.00 -151260 900000 900000 -187947 -99827 48358 -153936 171405 -104361 -59072 -122211 -121138 -110325 -119913 122942 -17954 -70445 -55391 236246 35547 17583 -7808 15202 -41680 -17335 -22381 67494 -21446 -33372 -35883 -15099 10208 -11651 -13741 5823 23727 -2417 -10436 14585 9278 -4257 4578 -8067 -5583 -334 15478 -2597 6953 6578 5841 -1537 2505 46 7742 8169 3774 4436 1317 4582 1272 -104 3418 3168 -326 3795 -1708 3822 319 4495 1395 -1254 -296 1356 -1462 1234 749 1095 2711 50 516 -902 894 -1288 -900 -2110 -1954 -1419 -1279 -735 -576 -49 331 1210 809 879 824 284 469 -111 -776 -538 -372 310 1148 -309 -1461 -969 -394 -240 126 111 -809 -315 -83 -66 557 762 1168 486 -90 -1254 -403 120 362 -39 82 383 1798 862 -229 427 326 367 318 499 -394 -9 66 -352 -572 -511 -66 43 103 -1505 900000 900000 -3674 -817 99 -2118 349 -1121 -452 -1832 -1992 -1976 -2995 384 -267 -1984 -1522 482 492 302 -175 280 -1385 -497 -715 967 -708 -1231 -1413 -554 352 -577 -770 281 961 -130 -680 904 719 -429 468 -986 -698 -41 1690 -342 868 857 814 -248 429 9 1523 1716 867 1053 327 1104 310 -26 867 891 -105 1290 -631 1331 114 1628 574 -585 -148 686 -747 585 332 446 1050 21 233 -475 526 -855 -640 -1598 -1560 -1185 -1109 -647 -505 -41 267 921 605 679 697 270 496 -130 -959 -665 -440 339 1190 -326 -1626 -1125 -475 -305 170 161 -1266 -510 -135 -104 851 1134 1744 750 -145 -2088 -667 193 570 -61 123 561 2565 1270 -365 732 595 701 630 1023 -846 -19 149 -806 -1310 -1151 -145 90 212 SS 20210606T104555.9Z 7827.448564 130 1 50.05 2 76.88 71.21 53.97 112.24 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