File name: Pandora55s1_QueensNY_20201019_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171241.3Z 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_20201019_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: 20201019 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 20201019T120321.9Z 7597.502336 62 1 31.71 2 81.46 111.52 116.43 94.44 0.00 1 0.00 1 0 25 4.947e-01 3.660e-02 1.991e-01 8.366e-03 7.268363e-01 4.899678e-03 8.280817e-03 -6.000000e+00 3.045765e-01 225.54 -2.00 3.51 -2.00 321.40 0.00e+00 5.073954e-03 2.518458e-03 6.191425e-04 -6.000000e+00 1.538118e-02 283.73 -2.00 20.00 -2.00 320.86 0.00e+00 6.341 0.005 302.00 328.00 3 1.7752e+00 1.7230e-02 7.3854e-02 -6.0000e+00 7.5746e-01 5.4862e-01 2.2598e-02 3.9713e-02 -6.0000e+00 8.2885e-01 -7.4901e-01 1.9821e-02 2.0392e-02 -6.0000e+00 4.8494e-01 3.0468e-01 9.3650e-03 8.1881e-03 -6.0000e+00 2.0525e-01 7.6474e-05 -1.7718e-03 2.5745e-04 1.0986e-04 -6.0000e+00 1.6326e-02 1.0139e-02 6.4109e-05 12 9 9 12 1 1 20.17 22.96 0.46 0.01014 -0.00318 15 5 1 5 0 1970.750 25.79 20.02 22.96 17.82 26.1 971.79 900000 -125401 -161849 900000 900000 -87919 900000 900000 900000 -24979 9239 -113448 900000 900000 -69396 -64743 28200 900000 900000 900000 55630 69960 -38408 -94550 27692 900000 118106 -51751 -109207 -23394 900000 118940 -49009 155183 900000 5154 -17274 900000 107933 51451 93687 -20856 58970 48804 179346 -960 900000 69479 175566 34826 -2886 4507 75835 93991 31102 59478 45831 60821 19847 25321 29444 21646 -11918 37111 -2898 26024 -604 26136 27413 -3821 13890 15440 1475 12819 9045 7051 19715 -1038 -5841 -1311 17052 4812 -1327 -7121 1322 -6561 -6336 -3999 -4755 -9662 -5460 3337 -172 -4073 1997 -5064 -554 -2782 -1116 -1514 275 -541 1727 3081 -2633 -843 -1904 279 1397 -892 -3417 627 -945 -477 -67 1964 3197 -2646 885 -3464 316 2331 5586 -1233 2730 544 1805 1427 -1336 1592 2948 3334 -1354 848 -544 1159 442 134 -4663 1098 -567 303 -1160 900000 -3920 -7026 900000 900000 -1543 900000 900000 900000 -291 82 -3858 900000 900000 -2874 -2910 572 900000 900000 900000 953 1026 -1628 -7118 677 900000 1186 -2574 -9494 -1005 900000 1813 -4034 1858 900000 251 -1138 900000 2998 2769 3686 -2526 3480 3195 3446 -102 900000 4052 3935 3171 -411 659 6160 6876 4276 6482 5699 6451 2996 3598 4161 3625 -3052 6634 -784 5357 -159 5627 6428 -1336 4456 5019 533 3929 2632 1907 4532 -300 -1978 -497 6323 2245 -710 -4267 777 -4357 -4371 -2769 -3293 -6770 -3503 1884 -98 -2508 1299 -4009 -481 -2754 -1172 -1618 277 -504 1477 2591 -2434 -812 -1942 298 1605 -1153 -4919 926 -1436 -711 -96 2710 4385 -3920 1335 -5556 491 3473 7891 -1795 3754 741 2389 1956 -2043 2633 5240 6270 -2753 1779 -1211 2651 1038 318 -11466 2540 -1275 643 -2424 SS 20201019T121728.4Z 7597.512134 67 1 50.72 2 79.00 114.01 113.91 96.57 0.00 1 0.00 1 0 25 4.965e-01 1.471e-02 1.441e-01 2.825e-03 6.091786e-01 1.534313e-03 7.098283e-03 -6.000000e+00 2.949754e-01 225.54 -2.00 3.51 -2.00 320.55 0.00e+00 3.397930e-03 6.240041e-04 1.666040e-03 -6.000000e+00 1.361884e-02 283.73 -2.00 20.00 -2.00 319.93 0.00e+00 5.050 0.002 302.00 328.00 3 1.8404e+00 4.7776e-03 6.0254e-02 -6.0000e+00 7.2840e-01 9.1317e-02 6.1184e-03 3.5388e-02 -6.0000e+00 7.9136e-01 -1.0298e-01 5.6400e-03 1.6268e-02 -6.0000e+00 4.7065e-01 3.4389e-02 2.7934e-03 6.8778e-03 -6.0000e+00 2.0071e-01 2.9221e-04 -1.5264e-03 8.4936e-05 6.5395e-05 -6.0000e+00 1.5353e-02 1.1170e-02 -3.5488e-06 12 8 8 10 0 0 99.25 22.96 0.29 0.01117 -0.00030 48 9 1 5 0 1056.410 25.79 20.00 22.96 18.40 26.2 974.72 -25786 900000 -171846 900000 22084 -139685 900000 -53578 8325 -87303 -5020 -119366 50709 900000 -49791 -61717 -66716 426615 94067 41566 -22042 22398 -35132 -53988 -35261 148740 -12913 -41493 -61540 -25082 9038 -13936 -23100 3730 75766 -21700 -9826 25524 8529 -548 4010 -9396 453 6050 11655 -3418 21331 9641 15563 2295 -5472 -3273 11411 13715 6518 6756 5323 5544 1931 199 5023 3489 -1974 4419 -2302 4989 -935 5827 4452 -2163 875 2265 -1707 2447 767 427 3980 -682 -1693 -2616 3092 -1443 -1120 -3524 -765 -2616 -1894 -829 -974 -1989 -1197 1797 1251 1212 851 130 648 -571 -937 -139 5 87 1215 552 -1174 -621 -374 -134 342 -466 -937 -165 -492 -188 327 987 1428 23 -489 -1632 -220 77 1291 -156 772 284 1419 1123 105 381 444 1092 713 411 -179 271 3 -247 -2091 221 -327 23 -22 -144 900000 -4383 900000 81 -2502 900000 -528 49 -1385 -40 -3312 352 900000 -1365 -2177 -2733 1174 993 752 -740 507 -1436 -2843 -1663 1284 -514 -2131 -3907 -1255 387 -861 -1718 223 2294 -1667 -761 1693 787 -63 490 -1383 64 824 1544 -529 2704 1407 2262 403 -1135 -732 2429 3066 1627 1755 1419 1469 521 55 1382 1068 -703 1621 -927 1858 -365 2226 1889 -1078 457 1205 -928 1225 363 187 1612 -295 -811 -1446 1843 -987 -820 -2779 -622 -2260 -1698 -752 -882 -1764 -1008 1404 954 952 728 124 687 -668 -1164 -173 6 96 1268 581 -1305 -722 -452 -169 460 -677 -1456 -265 -795 -297 497 1451 2099 34 -777 -2682 -359 124 2003 -239 1145 411 2005 1624 163 638 792 2021 1368 820 -373 584 8 -549 -4711 484 -697 46 -44 SS 20201019T122340.6Z 7597.516442 70 1 51.10 2 77.93 115.12 112.81 97.50 0.00 1 0.00 1 0 25 2.421e-01 8.557e-03 9.985e-02 1.682e-03 5.721583e-01 8.953834e-04 6.690015e-03 -6.000000e+00 1.425975e-01 225.54 -2.00 3.51 -2.00 320.20 0.00e+00 9.885837e-04 3.267228e-04 1.230188e-03 -6.000000e+00 6.486022e-03 283.73 -2.00 20.00 -2.00 319.56 0.00e+00 4.637 0.002 302.00 328.00 3 1.3284e+00 2.6819e-03 5.5166e-02 -6.0000e+00 3.5200e-01 2.3532e-02 3.3496e-03 3.1293e-02 -6.0000e+00 3.8201e-01 -1.8778e-02 3.0233e-03 1.5060e-02 -6.0000e+00 2.2831e-01 -1.5733e-03 1.5305e-03 4.7468e-03 -6.0000e+00 9.7575e-02 7.6188e-04 -9.0112e-04 5.0076e-05 5.5525e-05 -6.0000e+00 7.2697e-03 1.0287e-02 2.8069e-05 11 8 0 10 0 0 90.75 22.96 0.23 0.01029 0.00352 113 21 1 5 0 448.090 25.79 19.98 22.96 18.84 26.3 977.89 -73166 900000 -120782 16504 -84614 -73350 149072 -32816 15064 -79547 -991 -73308 40190 21365 -11789 -28115 20523 30476 22912 5962 -16965 8020 -28345 -11986 -24949 40017 -9485 -11449 -33221 -9198 2476 -3810 -13826 -4934 25532 -10567 -3150 4483 4063 -4090 1640 -5826 -488 -822 3885 -2043 4332 3437 4067 3773 -2882 20 2381 5164 1657 2181 1946 1484 1209 1608 3197 529 97 817 -265 1014 583 3081 1726 -875 -417 765 -1637 139 -339 1145 1353 1017 -240 114 673 -1499 -857 -2143 -818 -1474 -991 -951 -654 -867 290 1206 1491 1692 726 647 325 -105 -512 -210 -473 515 1079 438 -1191 -559 -641 -77 536 -451 -370 -368 51 14 507 923 1100 353 -388 -1235 -662 -70 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