File name: Pandora55s1_QueensNY_20201007_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171227.1Z 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_20201007_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: 20201007 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 20201007T114918.0Z 7585.492569 256 1 49.95 2 81.42 105.34 43.03 258.08 0.00 1 0.00 1 0 25 7.162e-01 3.935e-02 2.378e-01 6.559e-03 7.121151e-01 3.765876e-03 8.154118e-03 -6.000000e+00 4.352227e-01 226.75 -2.00 3.51 -2.00 321.36 0.00e+00 9.945580e-03 1.858167e-03 2.180998e-03 -6.000000e+00 2.133893e-02 285.20 -2.00 20.00 -2.00 320.80 0.00e+00 6.314 0.005 302.00 328.00 3 1.7558e+00 1.3017e-02 7.5760e-02 -6.0000e+00 1.0839e+00 6.6635e-01 1.6296e-02 4.8612e-02 -6.0000e+00 1.1825e+00 -9.1862e-01 1.2892e-02 1.9065e-02 -6.0000e+00 6.9785e-01 3.8053e-01 6.2284e-03 1.3131e-02 -6.0000e+00 2.9380e-01 7.8417e-05 -2.1411e-03 1.9731e-04 1.3260e-04 -6.0000e+00 2.3107e-02 9.5549e-03 6.0969e-05 12 8 8 10 0 0 86.56 22.91 0.48 0.00955 -0.00653 27 5 1 5 0 1849.770 25.79 20.01 22.91 21.79 26.5 990.94 64762 900000 -147299 900000 112841 55755 900000 -27598 900000 -102365 265400 -103022 900000 900000 9561 -67495 -61302 900000 900000 382157 27789 206515 -61937 -41718 -51625 900000 30555 3428 -73386 -15545 331970 41373 -33488 100877 900000 -44312 16634 900000 207825 22954 125775 53736 10001 73338 132038 32170 165708 56906 90667 43549 -598 11542 54604 118798 48406 66222 40025 69941 34606 33793 54025 17354 2698 28404 2646 37801 3835 21443 21777 -1549 6110 18905 -6103 29516 3609 12331 14896 -5343 -5414 -6414 17241 -3215 4111 -12245 1635 -7621 -3768 -4192 -3077 -7535 -3586 3785 -3881 -2241 -1244 -4461 -2129 -1412 -3377 995 -1234 25 2059 1477 -4481 -1399 -398 -209 720 -1639 -3534 -1044 -833 -1408 -200 856 1662 476 -1078 -2525 -57 3604 6733 -457 2655 974 2092 1602 -964 1245 3692 2422 2673 1188 -398 440 846 -788 -4428 367 -793 259 -2048 610 900000 -10870 900000 720 448 900000 -518 900000 -3981 1694 -4904 900000 900000 292 -4821 -4476 900000 900000 2439 918 1318 -4582 -2585 -3532 900000 926 131 -5893 -805 2119 1715 -3062 2621 900000 -4282 979 900000 2630 1892 4241 3739 1080 4425 4633 2917 4350 4306 5243 4163 -94 1772 6015 7604 6182 7312 5624 7298 4858 4750 6545 3238 646 5898 728 7440 1029 5076 5633 -554 2188 6184 -2454 8046 1144 3282 3691 -1651 -1874 -2626 6541 -1651 2149 -7843 978 -5204 -2597 -2963 -2153 -5316 -2323 2168 -2334 -1378 -843 -3551 -1904 -1409 -3691 1060 -1279 24 1792 1282 -4284 -1381 -409 -229 847 -2177 -5193 -1592 -1288 -2152 -293 1212 2349 700 -1680 -4115 -92 5464 9662 -676 3740 1352 2824 2242 -1498 2106 6632 4663 5365 2532 -900 1028 2015 -1918 -11075 867 -1815 560 -4379 SS 20201007T120328.5Z 7585.502413 261 1 51.04 2 78.85 107.79 45.60 260.84 0.00 1 0.00 1 0 33 2.523e-01 1.015e-02 7.765e-02 2.025e-03 5.975634e-01 1.095390e-03 6.924443e-03 -6.000000e+00 1.504085e-01 226.75 -2.00 3.51 -2.00 320.48 0.00e+00 3.297999e-03 4.391209e-04 1.447643e-03 -6.000000e+00 6.802604e-03 285.20 -2.00 20.00 -2.00 319.84 0.00e+00 4.987 0.002 302.00 328.00 3 1.2711e+00 3.4055e-03 5.9336e-02 -6.0000e+00 3.7250e-01 4.1451e-02 4.3495e-03 3.4316e-02 -6.0000e+00 4.0411e-01 -4.1739e-02 4.0042e-03 1.5950e-02 -6.0000e+00 2.4033e-01 7.2469e-03 1.9906e-03 6.9607e-03 -6.0000e+00 1.0214e-01 5.6072e-04 -9.7878e-04 6.0812e-05 6.3808e-05 -6.0000e+00 7.7043e-03 9.7395e-03 2.5181e-05 12 8 8 10 0 0 90.26 22.91 0.30 0.00974 0.00238 100 19 1 5 0 505.240 25.79 19.98 22.91 22.89 26.5 996.69 1411 900000 -135051 -16694 -99954 -88458 900000 -73148 -39749 -100400 -20163 -65411 -21826 57252 -28097 -58900 -78131 44113 51436 -532 -548 5811 -35510 -31312 -20184 28678 -7265 -10652 -41095 -11291 10809 5052 -25108 3621 33363 -16007 -9225 10227 7247 -4786 2158 -11021 -3080 1406 7326 -2111 9043 4092 8737 2973 -1947 -1589 4932 6750 3069 3382 1196 4412 550 2749 4802 1470 -755 1775 -945 3663 1237 3242 3070 -527 -149 263 -2104 1279 -824 530 2458 895 -888 -1009 1218 -1479 -1157 -2269 -704 -1541 -846 -1328 -429 -797 369 1129 1087 919 1186 295 553 -502 -687 -114 -337 52 1558 104 -1086 -352 -801 -103 378 -85 -893 -418 -151 35 526 979 1159 511 -447 -1493 -588 62 477 -289 58 525 1245 1136 -55 401 332 764 481 404 -218 -129 69 -302 -1302 -70 -55 59 168 6 900000 -2270 -87 -1119 -921 900000 -827 -361 -1739 -179 -1058 -295 456 -611 -1968 -3462 684 796 -14 -15 153 -1448 -1333 -830 774 -276 -415 -2180 -502 458 263 -1910 220 1520 -1185 -724 799 693 -587 274 -1683 -457 206 1038 -332 1319 647 1389 536 -402 -360 1146 1649 814 931 342 1225 155 766 1375 474 -276 688 -388 1423 488 1303 1358 -267 -81 146 -1181 666 -409 240 1049 396 -438 -567 758 -1040 -869 -1814 -585 -1355 -768 -1235 -396 -717 315 908 853 739 1032 287 595 -596 -861 -142 -406 59 1650 112 -1229 -415 -984 -133 515 -125 -1398 -678 -245 56 802 1447 1714 780 -713 -2463 -969 101 748 -446 87 766 1777 1653 -86 676 592 1418 924 805 -455 -278 152 -671 -2921 -154 -118 120 338 SS 20201007T120941.2Z 7585.506727 264 1 50.36 2 77.73 108.88 46.73 262.00 0.00 1 0.00 1 0 25 3.193e-01 7.571e-03 1.041e-01 1.462e-03 5.508920e-01 7.772326e-04 6.428743e-03 -6.000000e+00 1.889637e-01 226.75 -2.00 3.51 -2.00 320.10 0.00e+00 1.804800e-03 2.741320e-04 9.617297e-04 -6.000000e+00 8.495596e-03 285.20 -2.00 20.00 -2.00 319.43 0.00e+00 4.567 0.002 302.00 328.00 3 1.1279e+00 2.3168e-03 5.4003e-02 -6.0000e+00 4.6753e-01 1.5931e-02 2.8641e-03 3.0084e-02 -6.0000e+00 5.0679e-01 -1.0786e-02 2.5110e-03 1.4422e-02 -6.0000e+00 3.0266e-01 -5.0657e-03 1.2769e-03 5.0054e-03 -6.0000e+00 1.2862e-01 1.0171e-03 -8.5297e-04 4.4078e-05 5.3424e-05 -6.0000e+00 9.5905e-03 9.3686e-03 3.9982e-05 11 8 0 10 0 0 55.27 22.91 0.28 0.00937 0.00296 150 28 1 5 0 335.660 25.79 19.98 22.91 23.22 26.5 998.38 -7368 311695 -82684 -21742 -47523 -57174 113785 -47487 -41336 -62016 -38548 -36907 -20801 27217 -24538 -24337 -4972 17277 10336 -2667 -4564 -1800 -16035 -19211 -12800 7779 -3772 -12554 -16984 -11664 8963 -3176 -16063 -128 9335 -7633 -4440 5970 299 -2879 -1372 -5656 -3603 -1024 2804 -1693 4447 -420 4058 894 228 -858 3307 3788 1671 1886 745 1969 780 1817 2577 1537 -345 1048 -560 2094 780 2605 2235 23 -65 -513 -1245 303 -129 398 1711 764 278 -522 370 -1831 -1266 -1504 -1070 -822 -705 -692 -449 -274 390 628 1255 1296 1499 505 662 -420 -561 -515 -295 -2 1124 241 -1239 -656 -753 -26 55 36 -636 -229 -80 -64 522 962 1109 476 -458 -1143 -667 -91 56 -193 338 157 1444 1088 138 278 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