File name: Pandora55s1_QueensNY_20201103_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171321.3Z 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_20201103_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: 20201103 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 20201103T122135.1Z 7612.514990 277 1 50.20 2 81.69 118.53 71.75 282.61 0.00 1 0.00 1 0 25 6.527e-01 2.249e-02 2.229e-01 3.727e-03 8.755435e-01 2.171926e-03 9.818044e-03 -6.000000e+00 3.947230e-01 224.23 -2.00 3.51 -2.00 321.68 0.00e+00 3.171210e-03 1.216593e-03 4.021364e-03 -6.000000e+00 1.944352e-02 281.89 -2.00 20.00 -2.00 321.19 0.00e+00 6.500 0.005 302.00 328.00 3 5.1967e-01 8.0003e-03 8.3467e-02 -6.0000e+00 9.7928e-01 4.4732e-01 1.1712e-02 5.9167e-02 -6.0000e+00 1.0732e+00 -6.2313e-01 1.1858e-02 2.6947e-02 -6.0000e+00 6.3491e-01 2.5931e-01 5.3930e-03 9.1452e-03 -6.0000e+00 2.6530e-01 2.0383e-04 -2.1383e-03 1.0433e-04 1.1466e-04 -6.0000e+00 2.0293e-02 1.1402e-02 1.2704e-05 12 8 8 10 0 0 98.20 23.01 0.30 0.01140 -0.00467 85 16 1 5 0 590.520 25.90 20.00 23.01 11.58 26.0 942.39 -12417 900000 -278719 -73285 -232449 -251329 900000 -142078 -43734 -273578 900000 -227571 900000 900000 12072 -122539 900000 900000 900000 900000 -35855 146854 -94956 -50462 -78980 900000 -55755 -53791 -121336 -30166 92615 -1345 -23828 -27061 900000 -24079 -279 223661 132377 19228 30748 -2455 33142 34112 61916 15844 51220 59425 40448 22699 5324 5514 43339 48283 16644 33299 34245 36442 17492 11322 27621 9821 781 24201 9348 21199 276 18976 13949 3562 5349 11784 -2407 10617 3983 4593 12466 3706 2972 -929 12100 -3028 1638 -4471 1134 -3178 -1911 -3142 -1985 -2305 -2399 1357 -1255 371 -1372 -1574 -1191 -1704 -3088 -1218 -1536 158 1042 258 -1842 -2685 -493 -851 632 -1402 -1635 -674 -607 -326 358 986 1749 -329 -71 -1491 332 1035 2358 659 2030 526 2374 1109 -354 -246 1478 1206 1165 324 -287 117 157 -443 -1002 10 -512 -343 -1043 -45 900000 -7491 -266 -3566 -4666 900000 -1113 -159 -8684 900000 -6406 900000 900000 71 -3105 900000 900000 900000 900000 -530 533 -2610 -986 -2146 900000 -1238 -1159 -5151 -627 728 -31 -772 -937 900000 -810 -8 927 1605 787 1253 -145 1459 1511 2143 861 2089 2373 2087 1515 468 542 3314 3817 1862 3345 3447 3555 1963 1322 2892 1338 132 3701 1743 3599 58 3586 3088 974 1557 3325 -756 2770 1006 1057 2587 880 814 -313 4232 -1376 781 -2394 612 -1871 -1158 -1960 -1216 -1372 -1360 714 -675 209 -887 -1180 -1022 -1657 -3271 -1291 -1556 145 878 216 -1634 -2524 -479 -887 713 -1796 -2314 -1009 -934 -496 529 1422 2522 -495 -112 -2409 523 1565 3411 941 2798 717 3147 1549 -550 -427 2765 2418 2454 721 -672 284 388 -1106 -2504 24 -1187 -751 -2226 SS 20201103T123819.5Z 7612.526615 282 1 51.07 2 78.95 121.54 74.72 285.05 0.00 1 0.00 1 0 25 3.786e-01 8.369e-03 7.548e-02 1.257e-03 7.064123e-01 6.805157e-04 8.106306e-03 -6.000000e+00 2.218375e-01 224.23 -2.00 3.51 -2.00 320.75 0.00e+00 3.086733e-03 2.990809e-04 1.952417e-03 -6.000000e+00 1.006334e-02 281.89 -2.00 20.00 -2.00 320.19 0.00e+00 5.031 0.002 302.00 328.00 3 2.0158e-01 2.1600e-03 6.3083e-02 -6.0000e+00 5.4634e-01 6.3223e-02 2.8941e-03 4.0480e-02 -6.0000e+00 5.9366e-01 -4.7657e-02 2.9264e-03 1.9272e-02 -6.0000e+00 3.5476e-01 8.6769e-03 1.4273e-03 7.6122e-03 -6.0000e+00 1.5178e-01 1.3673e-03 -1.2231e-03 3.5563e-05 7.5552e-05 -6.0000e+00 1.1362e-02 1.0824e-02 3.2169e-05 11 8 0 10 0 0 63.25 23.00 0.26 0.01082 0.00163 268 51 1 5 0 188.400 25.90 20.01 23.00 12.55 26.1 947.38 -129752 900000 -192324 -73527 -178357 -145337 -2930 -116852 -55994 -164387 -38953 -137949 -5817 -31732 -37394 -60640 -4524 31103 -6486 649 -25921 -7993 -40015 -20303 -34381 27904 -28806 -25773 -43093 -12681 -8821 -8660 -15127 -10359 23449 -13684 -6188 549 7420 -5544 1419 -4367 -913 1951 3010 156 2334 3788 2304 2457 -765 1669 4313 3469 368 2242 2219 1656 239 698 3759 918 1139 1736 1465 3289 1566 3384 2249 262 -165 558 -874 324 -415 608 1279 1522 192 -381 613 -1801 -825 -1837 -1041 -1432 -826 -1042 -394 -376 608 932 1551 1347 1006 776 315 -167 -1021 -260 -372 399 1003 -49 -1386 -1067 -973 -386 31 -196 -354 -241 79 126 664 982 985 393 -535 -1138 -515 -148 -49 -123 203 443 1555 1093 308 280 256 448 319 231 -317 -274 69 -450 -709 -94 -10 131 167 -795 900000 -2594 -293 -1968 -1203 -7 -943 -275 -2603 -199 -2340 -34 -318 -497 -1208 -59 315 -103 10 -543 -145 -1071 -492 -1040 473 -868 -756 -1455 -391 -294 -347 -733 -499 867 -703 -336 34 522 -521 139 -455 -97 207 324 18 271 457 302 353 -128 305 849 747 81 507 513 382 55 170 875 245 346 583 518 1141 556 1249 941 119 -82 285 -443 152 -180 253 504 623 85 -200 374 -1203 -598 -1360 -814 -1192 -717 -927 -346 -317 478 729 1177 1072 853 724 342 -196 -1248 -318 -449 456 1051 -52 -1560 -1207 -1163 -493 41 -280 -560 -388 128 199 1043 1481 1486 619 -855 -1891 -845 -233 -77 -188 299 655 2220 1625 491 482 468 842 636 472 -694 -607 157 -1040 -1638 -209 -22 267 342 SS 20201103T124419.4Z 7612.530781 285 1 50.89 2 77.99 122.64 75.78 285.92 0.00 1 0.00 1 0 25 3.658e-01 7.207e-03 9.450e-02 9.910e-04 6.590343e-01 5.283361e-04 7.643566e-03 -6.000000e+00 2.143769e-01 224.23 -2.00 3.51 -2.00 320.43 0.00e+00 2.233678e-03 2.082032e-04 1.622410e-03 -6.000000e+00 9.598183e-03 281.89 -2.00 20.00 -2.00 319.84 0.00e+00 4.659 0.002 302.00 328.00 3 1.7141e-01 1.6093e-03 5.8191e-02 -6.0000e+00 5.2797e-01 4.6962e-02 2.0759e-03 3.6681e-02 -6.0000e+00 5.7368e-01 -2.6133e-02 2.0123e-03 1.7563e-02 -6.0000e+00 3.4259e-01 -5.6186e-05 1.0045e-03 6.3422e-03 -6.0000e+00 1.4587e-01 2.1031e-03 -1.0042e-03 2.8374e-05 6.6276e-05 -6.0000e+00 1.0977e-02 1.0406e-02 3.8321e-05 11 8 0 10 0 0 21.29 23.00 0.22 0.01041 0.00286 336 64 1 5 0 150.080 25.90 20.00 23.00 12.82 26.0 948.56 -96821 298844 -139880 -31111 -116624 -102130 -33305 -56055 -77662 -95687 -64235 -83807 -30081 -10283 -21801 -38201 47493 1491 3628 -11224 -7045 -13622 -18470 -16572 -19022 5508 -16804 -13075 -24514 -7178 -4692 -2837 -12566 -3597 9745 -4062 -2852 684 1127 -1542 -546 -5046 -332 -1494 2536 -1622 1387 1872 1752 1340 -4 467 2129 2990 301 1785 259 1135 -74 1149 2402 1365 1248 1217 945 1830 1479 2603 2242 -45 -142 -277 -981 -263 -363 545 1019 1266 -122 -107 -19 -1713 -1376 -1484 -1110 -1090 -629 -697 -399 -95 754 865 1667 1464 1111 701 703 -282 -554 -225 -413 391 826 -52 -1360 -689 -901 -176 -38 -129 -428 -174 104 82 829 1045 906 309 -572 -1177 -672 -218 -258 -41 78 496 1358 1090 189 365 197 537 276 226 -372 -321 132 -458 -625 -205 -10 82 316 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