File name: Pandora55s1_QueensNY_20201107_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171326.8Z 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_20201107_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: 20201107 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 20201107T122557.4Z 7616.518025 277 1 50.73 2 81.87 120.11 34.08 248.50 0.00 1 0.00 1 0 25 6.121e-01 2.000e-02 1.851e-01 3.657e-03 7.516696e-01 2.088691e-03 8.492373e-03 -6.000000e+00 3.692314e-01 223.88 -2.00 3.51 -2.00 321.46 0.00e+00 7.021659e-03 1.105302e-03 3.608530e-03 -6.000000e+00 1.740374e-02 281.40 -2.00 20.00 -2.00 320.95 0.00e+00 6.623 0.005 302.00 328.00 3 5.2928e-01 7.3915e-03 8.0836e-02 -6.0000e+00 9.1454e-01 2.7751e-01 1.0427e-02 5.3923e-02 -6.0000e+00 1.0015e+00 -3.7923e-01 1.0535e-02 2.1635e-02 -6.0000e+00 5.9412e-01 1.5456e-01 4.8989e-03 1.1580e-02 -6.0000e+00 2.5045e-01 2.1196e-04 -1.8114e-03 1.0903e-04 1.0352e-04 -6.0000e+00 1.9078e-02 1.6367e-02 9.4060e-05 12 8 8 10 0 0 8.29 22.93 0.39 0.01637 0.00276 85 16 1 5 0 596.690 25.79 20.00 22.93 19.35 26.8 984.11 900000 900000 -272599 126726 -169364 -230741 900000 -26200 -166919 -203668 -149854 -202339 900000 900000 -78278 -62779 900000 900000 900000 226184 -17879 -64288 -38205 -105513 -28962 900000 23905 -93459 -93123 -33994 37181 4148 -45062 4228 900000 -21837 -34860 206401 51852 11732 13422 -13436 29926 22180 69274 -4489 53183 26681 41166 386 2357 -9289 34153 30098 8344 18178 19972 32455 1335 13639 9840 9608 -4824 20408 -578 12896 4523 10180 12774 -1350 4576 6630 1343 3322 3587 -175 12986 774 -1039 -985 5266 -587 -765 -2272 -1139 -2003 -2817 -2019 -1051 -1635 -1341 1149 957 -546 50 -2632 655 -1341 -2304 -1138 -433 397 828 933 -1588 -800 -1554 -516 429 -1259 -1937 -468 -926 -466 443 1307 1833 -149 -175 -1698 376 578 2454 -154 1324 429 1847 1034 -428 771 1401 1386 790 672 -469 360 33 -183 -2263 -39 -40 -202 -438 900000 900000 -8093 451 -1679 -4160 900000 -93 -2080 -3836 -1877 -5161 900000 900000 -1287 -1047 900000 900000 900000 805 -268 -1512 -730 -4079 -570 900000 291 -3507 -3661 -882 594 109 -2107 129 900000 -858 -1724 1196 1597 607 758 -1039 1620 1323 2728 -363 2622 1766 2555 38 255 -1242 3351 3302 1178 2435 2666 3811 205 1866 1469 1595 -1035 3860 -140 2761 1059 2390 3261 -438 1520 2226 465 1064 1057 -49 3111 217 -336 -373 2188 -289 -412 -1311 -689 -1286 -1905 -1388 -713 -1081 -840 671 553 -335 34 -2108 584 -1360 -2520 -1250 -449 377 734 824 -1500 -791 -1625 -570 511 -1676 -2832 -712 -1440 -712 650 1864 2625 -224 -273 -2747 598 890 3626 -227 1883 598 2506 1466 -669 1321 2586 2716 1624 1448 -1067 846 80 -445 -5571 -93 -92 -441 -934 SS 20201107T124343.7Z 7616.530366 283 1 13.33 2 79.01 123.31 37.20 252.80 0.00 1 0.00 1 0 25 3.370e-01 9.940e-03 1.621e-01 3.388e-03 6.002657e-01 1.803321e-03 6.923790e-03 -6.000000e+00 1.973189e-01 223.88 -2.00 3.51 -2.00 320.38 0.00e+00 2.446299e-03 6.920270e-04 7.120762e-04 -6.000000e+00 8.939441e-03 281.40 -2.00 20.00 -2.00 319.79 0.00e+00 5.056 0.002 302.00 328.00 3 8.9121e-01 5.4693e-03 5.9103e-02 -6.0000e+00 4.8567e-01 5.7896e-02 6.9165e-03 3.2087e-02 -6.0000e+00 5.2781e-01 -4.8698e-02 6.4607e-03 1.6018e-02 -6.0000e+00 3.1541e-01 9.9158e-03 3.2443e-03 5.8603e-03 -6.0000e+00 1.3506e-01 7.6772e-04 -6.5167e-04 1.0076e-04 6.4105e-05 -6.0000e+00 1.0114e-02 8.3749e-03 6.7170e-05 12 9 9 12 1 1 70.33 22.93 0.21 0.00837 0.00348 30 23 1 5 0 410.880 25.79 20.00 22.93 20.96 27.0 992.92 -91384 900000 -160803 148356 -149156 -83754 109610 -52230 -63217 -98018 -7549 -93942 114594 -18738 1034 -60546 7450 68140 4341 18086 -10425 -577 -16301 -15788 -32670 51347 -10043 -8698 -37996 4251 -11637 -2198 -19292 -7018 34793 -12075 -7201 2352 7211 -5088 1509 -8226 4745 438 7839 -1846 5884 4401 2109 4491 -2159 -932 3816 5942 757 3633 1210 1819 727 1911 4899 1113 1210 2114 710 2262 1508 930 3480 394 309 1050 -2212 1392 -799 464 1141 2629 -1018 -861 177 -1076 -946 -2315 -1180 -980 -273 -1725 -489 -930 723 27 1058 951 187 504 427 -67 -980 234 -689 -64 1251 -164 -1341 -696 -296 -528 424 27 -661 -263 74 132 588 324 1392 339 -231 -993 -841 161 104 38 403 411 1284 1465 -232 509 524 416 -66 405 -8 -271 -41 -281 -972 -95 123 319 -399 -992 900000 -3791 490 -2925 -924 362 -544 -800 -1841 -67 -2206 468 -341 19 -2247 164 929 115 439 -337 -17 -606 -634 -1642 1234 -426 -362 -2116 177 -656 -133 -1498 -504 1688 -928 -595 212 742 -671 207 -1310 703 69 1178 -309 942 738 379 848 -473 -222 946 1551 217 1059 366 545 216 565 1471 378 454 853 300 933 621 399 1600 205 174 602 -1291 755 -412 219 512 1191 -520 -500 115 -776 -731 -1896 -1009 -877 -253 -1643 -460 -856 627 22 851 784 167 499 469 -80 -1246 296 -840 -73 1349 -179 -1539 -831 -366 -686 581 40 -1038 -426 120 210 899 484 2066 520 -368 -1634 -1387 259 164 59 606 603 1836 2139 -365 856 934 773 -126 804 -16 -581 -90 -619 -2157 -206 260 647 -798 SS 20201107T125005.5Z 7616.534786 286 1 50.94 2 78.01 124.49 38.33 254.22 0.00 1 0.00 1 0 25 1.468e-01 6.585e-03 2.521e-02 9.438e-04 5.602325e-01 4.974620e-04 6.550894e-03 -6.000000e+00 8.591251e-02 223.88 -2.00 3.51 -2.00 320.08 0.00e+00 1.762211e-03 1.728597e-04 9.390697e-04 -6.000000e+00 3.843097e-03 281.40 -2.00 20.00 -2.00 319.46 0.00e+00 4.667 0.002 302.00 328.00 3 2.1261e-01 1.4656e-03 5.4788e-02 -6.0000e+00 2.1146e-01 2.7386e-02 1.8020e-03 3.0128e-02 -6.0000e+00 2.2982e-01 -1.9068e-02 1.6166e-03 1.4704e-02 -6.0000e+00 1.3724e-01 -1.4333e-03 8.2690e-04 4.9934e-03 -6.0000e+00 5.8469e-02 2.2976e-03 -7.4649e-04 2.8266e-05 5.6225e-05 -6.0000e+00 4.4036e-03 8.4995e-03 3.0655e-05 11 8 0 10 0 0 21.98 22.94 0.25 0.00850 0.00289 342 65 1 5 0 147.610 25.79 20.00 22.94 21.61 26.9 996.53 -47074 8762 -73823 -31661 -63129 -65018 -28513 -44449 -36803 -59141 -22786 -50682 -14469 -3685 -14566 -9594 -6185 9440 -355 -1994 -6939 -5640 -9789 -11866 -9263 1544 -8144 -8248 -13031 -2708 433 -1537 -5802 -2772 7177 -5782 -2364 1655 1336 -2173 -992 -3147 -1149 -391 976 -1321 705 900 1479 867 274 439 1828 2263 895 1216 293 1058 384 1739 2268 1915 629 616 732 1232 935 1899 1614 203 -55 -242 -837 -642 -354 509 1313 1189 259 -40 -218 -1598 -1442 -1403 -1121 -952 -720 -604 -573 -90 375 857 1404 1546 1190 660 848 -168 -635 -349 -413 168 1007 92 -1082 -601 -904 -192 -40 -193 -476 -291 -56 78 674 902 1017 476 -355 -920 -651 -221 -154 -58 113 356 1387 1139 198 389 96 330 199 230 -299 -177 159 -386 -630 -160 -62 7 271 -473 61 -1093 -323 -771 -838 -315 -599 -508 -1094 -320 -1111 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