File name: Pandora55s1_QueensNY_20201008_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171300.9Z 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_20201008_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: 20201008 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 20201008T114343.6Z 7586.488699 248 1 51.22 2 82.64 104.72 32.03 247.64 0.00 1 0.00 1 0 25 5.986e-01 2.131e-02 2.112e-01 3.920e-03 7.778295e-01 2.277218e-03 8.710407e-03 -6.000000e+00 3.674068e-01 226.64 -2.00 3.51 -2.00 321.61 0.00e+00 6.268364e-03 1.284436e-03 3.243103e-03 -6.000000e+00 1.747978e-02 285.08 -2.00 20.00 -2.00 321.08 0.00e+00 7.214 0.007 302.00 328.00 3 -1.4678e-02 8.4990e-03 8.6374e-02 -6.0000e+00 9.1674e-01 3.7236e-01 1.2066e-02 5.4657e-02 -6.0000e+00 1.0020e+00 -4.7658e-01 1.1872e-02 2.2451e-02 -6.0000e+00 5.9016e-01 1.9258e-01 5.4423e-03 1.1894e-02 -6.0000e+00 2.4539e-01 1.9943e-04 -1.5634e-03 1.1560e-04 1.1168e-04 -6.0000e+00 1.8910e-02 9.5103e-03 3.8558e-05 12 8 8 10 0 0 15.38 22.90 0.32 0.00951 -0.00224 94 18 1 5 0 539.010 25.79 19.98 22.90 18.75 26.3 975.48 108725 900000 -273810 900000 -152696 -132764 900000 900000 -172328 -203416 -131761 -121053 67419 900000 -78526 -140756 900000 900000 900000 -48886 131506 -14866 -46621 -111339 -66911 900000 21108 -52784 -125111 49278 37194 10459 -82250 154882 900000 -19558 -28000 214759 109219 19919 64799 -22946 17327 18409 84025 3484 107658 19856 59881 19178 4254 -322 35612 44544 19621 35151 17325 43107 6378 19679 25799 10789 1717 16514 1010 13728 2902 11532 14440 -4297 8178 4968 -7 11002 5543 5331 8839 1774 -2972 -783 6756 1431 -312 -4120 -1690 -2857 -2230 -3597 -1524 -3694 525 402 1110 -1636 1784 -2504 604 -1145 -1614 -681 -875 834 833 934 -3152 -989 -1671 -202 -275 -856 -2308 -459 -326 -1099 740 432 2179 262 -679 -1900 354 1127 2907 221 628 994 1580 1052 -648 1059 945 1412 967 514 -349 112 368 -311 -2012 -133 -238 -72 -408 415 900000 -8151 900000 -1270 -916 900000 900000 -2225 -3766 -1352 -1372 257 900000 -1242 -4712 900000 900000 900000 -926 502 -206 -914 -4291 -1790 900000 250 -1264 -6183 535 554 241 -5057 1031 900000 -695 -1200 1066 1815 887 2085 -1786 971 1047 2651 239 2890 1283 2853 1457 414 -36 3158 3921 2288 3697 2180 4235 857 2336 3030 1616 317 2958 220 2680 633 2464 3335 -1323 2430 1568 -2 3044 1479 1307 2025 457 -905 -275 2568 646 -156 -2274 -967 -1739 -1410 -2355 -975 -2339 306 223 606 -963 1140 -1915 516 -1114 -1698 -720 -885 766 715 793 -2910 -944 -1686 -216 -320 -1109 -3311 -690 -499 -1670 1078 617 3088 388 -1060 -3075 559 1722 4250 323 892 1370 2140 1485 -1013 1817 1766 2797 2011 1127 -807 269 902 -773 -5065 -323 -556 -161 -884 SS 20201008T115348.4Z 7586.495700 251 1 50.89 2 80.80 106.44 33.77 250.28 0.00 1 0.00 1 0 25 3.702e-01 9.860e-03 9.325e-02 1.766e-03 6.623913e-01 9.696312e-04 7.562654e-03 -6.000000e+00 2.206571e-01 226.64 -2.00 3.51 -2.00 320.89 0.00e+00 4.372668e-03 4.436429e-04 1.660652e-03 -6.000000e+00 9.978180e-03 285.08 -2.00 20.00 -2.00 320.28 0.00e+00 5.940 0.004 302.00 328.00 3 -3.6761e-02 3.1830e-03 6.9555e-02 -6.0000e+00 5.4637e-01 9.2788e-02 4.2540e-03 3.9195e-02 -6.0000e+00 5.9277e-01 -8.0326e-02 4.1356e-03 1.8300e-02 -6.0000e+00 3.5254e-01 2.3572e-02 1.9984e-03 8.9965e-03 -6.0000e+00 1.4985e-01 7.8400e-04 -9.2004e-04 5.2085e-05 7.9548e-05 -6.0000e+00 1.1306e-02 9.6274e-03 3.4692e-05 12 8 8 10 0 0 -11.46 22.90 0.26 0.00963 0.00271 200 38 1 5 0 251.910 25.79 20.01 22.90 19.15 26.2 977.10 -70003 900000 -184597 -82306 -57136 -161013 900000 -127941 -24930 -152178 -69136 -113743 -31597 68372 -62434 -66017 -113669 77987 27323 -5377 -35773 5037 -44814 -51457 -37754 58761 -17992 -26265 -43505 -25194 17212 -10585 -15914 -3503 24495 -23296 -9418 13412 11806 -2657 3438 -4853 -5006 5954 6356 667 6537 4176 7233 2518 -15 -968 6803 6474 4249 2777 3262 2845 2400 1985 4645 2638 664 3195 393 4875 -241 4314 2628 -62 566 579 -1221 1502 504 198 1953 566 148 -1025 1655 -1431 -1371 -2135 -889 -1476 -960 -961 -980 -451 467 792 880 1081 898 341 627 -475 -560 -507 19 114 1416 -100 -1535 -892 -819 -273 5 -309 -780 -330 -206 -35 561 830 770 638 -463 -905 -355 122 269 -260 398 268 1765 1037 312 316 411 657 352 360 -413 -141 192 -375 -1049 -93 -94 214 -76 -291 900000 -2649 -434 -226 -1859 900000 -1348 -104 -2436 -539 -1694 -269 294 -1164 -1421 -4469 529 332 -95 -832 85 -1248 -1669 -1149 750 -470 -746 -1536 -841 481 -440 -787 -159 832 -1324 -530 727 748 -227 308 -509 -553 608 664 76 729 500 894 338 -2 -168 1206 1244 884 611 730 636 529 441 1062 654 190 990 131 1541 -80 1446 1002 -26 260 276 -582 656 213 77 707 215 64 -505 927 -898 -941 -1515 -665 -1181 -803 -825 -836 -369 357 568 639 817 730 309 631 -547 -673 -614 22 122 1444 -104 -1642 -1008 -980 -336 7 -450 -1213 -524 -329 -56 853 1215 1129 976 -755 -1489 -580 199 422 -397 603 393 2482 1520 493 545 756 1249 709 749 -895 -320 437 -872 -2454 -216 -207 457 -156 SS 20201008T120436.5Z 7586.503200 256 1 50.91 2 78.85 108.32 35.66 252.92 0.00 1 0.00 1 0 25 1.751e-01 6.882e-03 3.085e-02 9.648e-04 5.703127e-01 5.133640e-04 6.647311e-03 -6.000000e+00 1.035580e-01 226.64 -2.00 3.51 -2.00 320.18 0.00e+00 1.792580e-03 1.864783e-04 1.031036e-03 -6.000000e+00 4.655878e-03 285.07 -2.00 20.00 -2.00 319.52 0.00e+00 4.990 0.002 302.00 328.00 3 -1.1039e-01 1.5392e-03 5.8105e-02 -6.0000e+00 2.5617e-01 4.7006e-02 1.9137e-03 3.1233e-02 -6.0000e+00 2.7772e-01 -2.0152e-02 1.7024e-03 1.4948e-02 -6.0000e+00 1.6586e-01 -1.9008e-03 8.6360e-04 5.2033e-03 -6.0000e+00 7.0481e-02 2.2823e-03 -8.3425e-04 2.8591e-05 5.5669e-05 -6.0000e+00 5.2584e-03 9.8640e-03 2.2874e-05 11 8 0 10 0 0 3.61 22.90 0.19 0.00986 0.00360 358 68 1 5 0 140.600 25.79 20.01 22.90 19.87 26.3 980.64 -65334 39165 -99354 -13807 -81425 -50756 -40270 -53256 -44051 -63748 -36456 -42538 -15835 -10727 -10781 -27613 -3161 -3731 8785 -11400 -7897 -5057 -14562 -12567 -14684 8474 -11796 -5834 -19173 -2469 333 -1745 -8001 -2901 5556 -5594 -709 452 2198 -3020 869 -3295 -1756 -595 1213 -460 713 876 1124 2487 -308 1682 1553 2416 1327 1616 585 1027 1087 1405 2830 1453 1425 216 937 1344 1315 2120 1516 74 -142 -460 -1019 -273 -437 889 510 1371 -131 225 -119 -1582 -1205 -1597 -1051 -1139 -632 -799 -434 -354 584 821 1259 1472 1334 799 714 -169 -567 -118 -357 282 836 78 -1241 -728 -770 -180 73 -305 -472 -373 -54 -19 642 909 973 399 -353 -915 -527 -191 -214 55 112 465 1385 1210 144 382 41 346 327 294 -272 -278 178 -477 -584 -188 -157 10 320 -698 176 -1689 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