File name: Pandora55s1_QueensNY_20200721_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T162448.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman 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_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20200721_L1_smca1c10d20200414p1-8.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: 20200721 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20200721T103929.1Z 7507.444087 262 1 50.29 2 80.93 70.93 88.42 63.65 0.00 1 0.00 1 0 25 5.398e-01 2.403e-02 1.183e-01 4.176e-03 7.478706e-01 2.461306e-03 8.504986e-03 -6.000000e+00 3.380691e-01 232.65 -2.00 3.51 -2.00 321.40 0.00e+00 1.097790e-02 1.297330e-03 9.863721e-04 -6.000000e+00 1.651035e-02 289.74 -2.00 20.00 -2.00 320.79 0.00e+00 6.007 0.004 302.00 328.00 3 1.2580e+00 8.9166e-03 7.3924e-02 -6.0000e+00 8.5257e-01 3.9034e-01 1.2068e-02 4.7219e-02 -6.0000e+00 9.2697e-01 -4.9959e-01 1.0911e-02 2.2492e-02 -6.0000e+00 5.4415e-01 1.9210e-01 5.1052e-03 1.6118e-02 -6.0000e+00 2.2702e-01 1.6779e-04 -1.5879e-03 1.2380e-04 1.6898e-04 -6.0000e+00 1.7056e-02 7.9416e-03 1.3902e-05 12 8 8 10 0 0 99.36 23.08 0.40 0.00794 -0.00399 54 10 1 5 0 931.070 25.90 20.01 23.08 32.54 25.7 1059.99 900000 900000 -242280 -142469 900000 -195820 900000 900000 -171643 -159623 -169100 -132563 -42428 900000 900000 -126491 -132328 900000 900000 900000 10722 62646 -20242 -82120 -21974 900000 56053 -85100 -38260 -31099 152162 15361 -28802 105135 900000 22583 -18170 93252 111138 2392 22074 2477 -12979 41050 82737 -2250 62575 10238 39249 -5165 36079 4337 44032 46169 20393 43162 20808 18769 6784 21578 17465 15452 -5517 18389 -722 18459 -2435 14780 6248 2316 1522 6031 -2491 5859 2551 5429 14066 -1538 981 -2265 9130 3176 -1014 -4259 -2152 -3519 -1203 -3135 -1262 -816 -2093 1624 -2534 -443 913 -5369 -1346 -1146 -2206 -162 -1509 147 2487 858 -2476 -1515 -1154 -1313 704 -215 -2328 -805 -276 -576 636 1138 1541 271 -938 -1714 787 1138 2206 232 1337 674 1963 1044 -430 912 1563 1352 1418 1091 69 179 -2 -761 -2846 544 -572 -12 -601 900000 900000 -8638 -1859 900000 -3910 900000 900000 -3198 -2770 -3514 -2378 -418 900000 900000 -5278 -6562 900000 900000 900000 164 576 -423 -3210 -502 900000 612 -3583 -1096 -961 980 445 -1409 1487 900000 696 -906 1903 2262 154 1301 187 -1183 2326 3260 -202 3187 891 2784 -600 3171 565 4321 4752 2787 4934 2940 2677 1058 2941 2599 2603 -1278 3785 -186 3982 -640 3484 1762 757 541 2119 -928 1909 788 1496 3450 -454 318 -888 3741 1539 -555 -2544 -1335 -2322 -814 -2203 -872 -545 -1346 960 -1525 -273 620 -4388 -1218 -1157 -2415 -177 -1586 141 2190 762 -2357 -1509 -1204 -1459 834 -283 -3388 -1221 -424 -874 926 1611 2192 400 -1464 -2762 1244 1747 3265 340 1895 934 2653 1465 -663 1539 2840 2605 2853 2306 155 414 -4 -1832 -6948 1272 -1299 -27 -1269 SS 20200721T104139.2Z 7507.445592 264 1 50.32 2 80.54 71.26 88.07 63.99 0.00 1 0.00 1 0 25 5.778e-01 1.656e-02 1.992e-01 3.184e-03 7.282740e-01 1.835847e-03 8.212303e-03 -6.000000e+00 3.554122e-01 232.65 -2.00 3.51 -2.00 321.27 0.00e+00 7.826001e-03 9.520965e-04 6.616820e-04 -6.000000e+00 1.638140e-02 289.74 -2.00 20.00 -2.00 320.66 0.00e+00 5.787 0.003 302.00 328.00 3 1.0389e+00 6.5533e-03 7.0647e-02 -6.0000e+00 8.9458e-01 1.6839e-01 9.0651e-03 4.2636e-02 -6.0000e+00 9.6924e-01 -2.1432e-01 8.6498e-03 2.2105e-02 -6.0000e+00 5.7275e-01 7.6422e-02 4.0505e-03 1.3207e-02 -6.0000e+00 2.4125e-01 2.7642e-04 -8.6782e-04 9.2923e-05 1.3452e-04 -6.0000e+00 1.7919e-02 6.3886e-03 1.0740e-04 12 8 8 10 0 0 31.13 23.08 0.31 0.00639 -0.00013 84 16 1 5 0 598.830 25.90 20.02 23.08 32.57 25.7 1060.56 900000 900000 -263973 -181389 38809 -219494 900000 12772 -189161 -187037 -146403 -184228 -32694 900000 43057 -142349 -123153 241129 900000 900000 -48487 40144 -22658 -67362 -40424 140651 -20224 -68040 -56127 -52357 20384 -24668 -36445 12070 900000 -14512 -25086 29687 56046 -9073 15847 -11933 -17840 14728 38812 -4693 27986 8056 13241 -6098 10623 474 26314 24382 10239 20925 9367 13251 4918 9328 15349 10898 -4485 12466 -579 10439 -4099 9908 3088 952 -1036 2865 -2622 4252 414 2638 5763 -1007 235 -1635 3916 493 -1523 -2752 -1039 -2415 -606 -2188 107 -769 -910 2230 -505 955 785 -2952 -790 -394 -1557 -123 -684 -249 2495 1039 -2266 -1721 -1226 46 817 -67 -1216 -524 -18 -520 224 677 1622 416 -944 -949 153 597 1085 77 466 -61 1577 914 -381 507 608 726 1228 774 -179 -47 427 -474 -2081 164 -282 296 -312 900000 900000 -5932 -1799 120 -3063 900000 40 -2592 -2689 -1591 -3534 -193 900000 200 -4626 -3798 748 900000 900000 -947 341 -370 -1794 -886 557 -382 -2037 -1589 -1644 393 -871 -1614 355 900000 -557 -1192 1008 1774 -607 930 -972 -1619 1023 2225 -415 1910 696 1165 -698 1161 63 3029 3093 1556 3009 1515 2063 814 1490 2442 2004 -1072 2832 -155 2544 -1148 2570 945 333 -400 1103 -1044 1509 141 810 1651 -319 83 -685 1796 262 -894 -1733 -681 -1693 -437 -1635 78 -550 -622 1409 -321 624 569 -2507 -749 -415 -1770 -140 -746 -251 2310 971 -2271 -1806 -1344 53 1009 -91 -1807 -816 -28 -807 336 987 2358 628 -1502 -1551 248 940 1660 116 679 -87 2187 1311 -598 868 1123 1414 2485 1642 -400 -108 1007 -1138 -5058 384 -640 641 -664 SS 20200721T104350.5Z 7507.447113 266 1 51.05 2 80.15 71.60 87.72 64.33 0.00 1 0.00 1 0 25 5.638e-01 1.352e-02 1.596e-01 2.723e-03 7.058105e-01 1.556321e-03 7.976513e-03 -6.000000e+00 3.454154e-01 232.65 -2.00 3.51 -2.00 321.14 0.00e+00 6.177644e-03 7.730398e-04 4.463563e-04 -6.000000e+00 1.626328e-02 289.74 -2.00 20.00 -2.00 320.50 0.00e+00 5.579 0.003 302.00 328.00 3 1.0066e+00 5.4187e-03 6.7765e-02 -6.0000e+00 8.6533e-01 1.1904e-01 7.4416e-03 3.9596e-02 -6.0000e+00 9.3482e-01 -1.5580e-01 7.0776e-03 2.1028e-02 -6.0000e+00 5.5350e-01 5.3144e-02 3.3404e-03 1.0831e-02 -6.0000e+00 2.3529e-01 3.5999e-04 -8.5497e-04 7.9767e-05 1.1263e-04 -6.0000e+00 1.7409e-02 6.1697e-03 9.7281e-05 12 8 8 10 0 0 56.86 23.08 0.21 0.00617 -0.00025 100 19 1 5 0 505.350 25.90 19.98 23.08 32.65 25.8 1061.48 900000 900000 -248275 -205130 900000 -193699 900000 -85815 -183614 -167301 -143573 -167983 -32712 900000 -1909 -120229 -21257 145874 121578 900000 -19973 9777 -49526 -70587 -42784 238678 -3195 -62108 -33060 -38691 48263 -27884 -21830 17364 142969 -9929 -29730 14998 25504 -7447 1499 -8107 -16176 10587 21842 -2107 14062 2496 9061 -2788 9303 4052 15364 13889 7996 13821 6035 6991 1411 6327 7458 6681 -2708 7859 322 8644 -2371 8024 3792 573 -405 1715 -2694 1875 221 3037 4802 -68 -684 -1928 3303 -450 -1660 -2875 -1059 -1950 -872 -1909 -580 32 -565 1218 -559 1600 1791 -2057 -21 -181 -1361 -730 -206 -200 1487 742 -1518 -1047 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