File name: Pandora145s1_Toronto-Scarborough_20241031_L2Fit_fout2c9d20230821p1-8.txt File generation date: 20241123T101339.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Vitali Fioletov Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 145 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora145_OF_v5d20190718.txt Instrument calibration file used: Pandora145s1_CF_v9d20230821.txt Level 1 file used: Pandora145s1_Toronto-Scarborough_20241031_L1_smca1c9d20230821p1-8.txt Full location name: University of Toronto - Scarborough Short location name: Toronto-Scarborough Country of location: Canada Location latitude [deg]: 43.7843 Location longitude [deg]: -79.1874 Location altitude [m]: 137 Local noon date: 20241031 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: field cal for autumn2023 ff, based on Session 8(7) First and last pixel inside fitting window: 226 368 Nominal wavelengths inside fitting window [nm]: 305.0462 305.1870 305.3278 305.4686 305.6094 305.7502 305.8910 306.0317 306.1725 306.3132 306.4539 306.5947 306.7354 306.8761 307.0167 307.1574 307.2981 307.4387 307.5794 307.7200 307.8606 308.0012 308.1418 308.2824 308.4230 308.5635 308.7041 308.8446 308.9851 309.1256 309.2661 309.4066 309.5471 309.6876 309.8281 309.9685 310.1089 310.2494 310.3898 310.5302 310.6706 310.8110 310.9513 311.0917 311.2320 311.3724 311.5127 311.6530 311.7933 311.9336 312.0739 312.2141 312.3544 312.4947 312.6349 312.7751 312.9153 313.0555 313.1957 313.3359 313.4761 313.6162 313.7564 313.8965 314.0366 314.1767 314.3168 314.4569 314.5970 314.7370 314.8771 315.0171 315.1572 315.2972 315.4372 315.5772 315.7172 315.8572 315.9971 316.1371 316.2770 316.4169 316.5569 316.6968 316.8367 316.9765 317.1164 317.2563 317.3961 317.5360 317.6758 317.8156 317.9554 318.0952 318.2350 318.3747 318.5145 318.6542 318.7940 318.9337 319.0734 319.2131 319.3528 319.4925 319.6321 319.7718 319.9114 320.0511 320.1907 320.3303 320.4699 320.6095 320.7490 320.8886 321.0282 321.1677 321.3072 321.4467 321.5862 321.7257 321.8652 322.0047 322.1441 322.2836 322.4230 322.5625 322.7019 322.8413 322.9807 323.1200 323.2594 323.3988 323.5381 323.6774 323.8167 323.9561 324.0954 324.2346 324.3739 324.5132 324.6524 324.7917 324.9309 --------------------------------------------------------------------------------------- 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 20241031T124449.7Z 9070.531131 77 1 29.96 2 82.18 118.60 74.66 126.02 0.00 1 0.00 1 0 17 6.256e-01 1.220e-02 2.847e-01 6.038e-03 7.308562e-01 3.200590e-03 8.235465e-03 -6.000000e+00 3.440170e-01 223.87 -2.00 3.57 -2.00 321.59 0.00e+00 2.938481e-03 1.667843e-03 2.084847e-03 -6.000000e+00 1.538362e-02 279.22 -2.00 20.00 -2.00 321.10 0.00e+00 6.851 0.006 302.00 328.00 3 1.1043e+00 1.1334e-02 7.8924e-02 -6.0000e+00 8.4870e-01 1.8504e-01 1.6600e-02 4.4773e-02 -6.0000e+00 9.2467e-01 -2.2924e-01 1.7944e-02 2.2233e-02 -6.0000e+00 5.5094e-01 8.8812e-02 8.3689e-03 8.1521e-03 -6.0000e+00 2.3818e-01 1.1031e-04 -1.0925e-03 1.6059e-04 7.7336e-05 -6.0000e+00 1.5793e-02 -8.8028e-03 0.0000e+00 12 8 8 10 0 0 44.88 18.51 0.51 -0.00880 -0.01701 56 56 1 5 0 534.910 23.11 15.00 18.51 24.95 25.0 1100.00 -233615 -238367 -208656 -247169 900000 -292972 -185913 -202936 -220439 -23100 -119737 -8229 -138285 -34718 -114303 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-115 1491 301 532 -136 -364 -617 -414 -440 -224 476 -1019 -812 -725 -2 -719 1328 487 1213 -440 376 -297 -1070 -962 -551 -139 -821 409 -120 -72 -1655 536 -1688 -422 -2287 -430 -1768 128 -1459 255 -1330 82 -229 17 1132 -576 464 -553 4 74 784 270 2355 1026 368 707 2048 826 681 1108 345 484 360 -235 -787 676 -348 268 -1050 793 -2330 -593 SS 20241031T125440.8Z 9070.537973 80 1 5.50 2 80.63 120.44 73.31 128.02 0.00 1 0.00 1 0 17 4.074e-01 1.415e-02 2.918e-01 1.166e-02 6.358150e-01 6.046000e-03 7.612676e-03 -6.000000e+00 2.244240e-01 223.87 -2.00 3.57 -2.00 320.77 0.00e+00 1.433172e-03 2.495791e-03 2.599980e-03 -6.000000e+00 1.002881e-02 279.22 -2.00 20.00 -2.00 320.23 0.00e+00 5.845 0.004 302.00 328.00 3 2.0880e+00 1.8815e-02 6.7166e-02 -6.0000e+00 5.5415e-01 1.3796e-01 2.4891e-02 3.7105e-02 -6.0000e+00 6.0421e-01 -1.5306e-01 2.4871e-02 1.9275e-02 -6.0000e+00 3.6060e-01 6.1231e-02 1.2288e-02 5.7245e-03 -6.0000e+00 1.5749e-01 1.1384e-04 -5.2170e-04 3.0747e-04 7.3639e-05 -6.0000e+00 1.0208e-02 -9.6970e-03 0.0000e+00 12 9 9 12 1 1 84.00 18.51 0.30 -0.00970 -0.01362 4 27 1 5 0 1098.700 23.11 14.99 18.51 25.44 24.9 1100.00 900000 -143756 900000 -160514 -61827 -181649 -156951 -105410 -99841 48734 -132283 -162648 -70657 -121336 -34747 900000 -46974 -4009 -39457 43018 -55151 62287 34359 -6506 -58105 -15051 5105 -29644 -5875 1811 -12674 -19874 -7808 -10221 34323 173 -9088 -26790 15883 2076 11362 -9462 28953 -3356 8829 5134 4632 5128 2724 20059 30489 4904 6259 14256 9863 7068 4105 6229 -4065 -686 -1574 5616 1743 1147 863 2044 411 -408 6561 -589 4282 1714 1383 -2143 498 -1806 6397 -4111 -1809 -2366 -1684 -48 -2748 1114 -805 1905 -2427 -2008 -1078 -1023 -116 247 -351 1244 -2547 -629 -1470 -193 -27 -627 -1057 -1518 1602 -1288 160 -767 1069 -1490 745 -728 1958 -610 242 646 117 795 838 89 -82 1201 23 529 -292 347 375 111 -494 809 250 1073 -308 -693 -87 605 -620 -698 -204 261 -176 470 -50 -567 124 900000 -2080 900000 -2986 -703 -3567 -2595 -1198 -1238 554 -2598 -4707 -1022 -3762 -632 900000 -1214 -82 -1142 636 -2052 779 586 -185 -2762 -498 157 -1134 -187 56 -485 -986 -403 -602 1366 8 -526 -2187 1051 193 1104 -1222 2693 -444 1040 642 594 673 383 2508 3813 897 1242 2858 2028 1560 972 1452 -1017 -161 -379 1373 505 383 311 711 141 -144 2343 -264 2057 823 667 -1016 229 -756 2261 -1601 -756 -1188 -914 -30 -1932 797 -627 1549 -2022 -1727 -924 -851 -96 189 -257 903 -2131 -557 -1521 -212 -33 -784 -1251 -1742 1595 -1303 174 -894 1197 -1829 973 -1014 2975 -1020 405 1044 179 1143 1199 133 -132 2008 39 857 -459 526 545 167 -712 1169 384 1861 -563 -1358 -177 1222 -1360 -1542 -459 596 -406 1043 -111 -1183 245 SS 20241031T131200.0Z 9070.550000 92 1 1.14 2 77.99 123.75 71.01 131.63 0.00 1 0.00 1 0 25 2.647e-01 1.787e-02 2.505e-01 1.445e-02 5.319319e-01 7.269505e-03 6.439114e-03 -6.000000e+00 1.472462e-01 223.87 -2.00 3.57 -2.00 319.77 0.00e+00 -4.359691e-04 2.201716e-03 1.064658e-03 -6.000000e+00 6.615613e-03 279.22 -2.00 20.00 -2.00 319.17 0.00e+00 4.659 0.002 302.00 328.00 3 1.9851e+00 2.0706e-02 5.3550e-02 -6.0000e+00 3.6350e-01 5.8241e-02 2.4907e-02 2.8754e-02 -6.0000e+00 3.9626e-01 -7.3813e-02 2.1566e-02 1.4162e-02 -6.0000e+00 2.3473e-01 2.8501e-02 1.1343e-02 4.2067e-03 -6.0000e+00 1.0111e-01 4.3126e-04 -7.1200e-04 3.8397e-04 4.2466e-05 -6.0000e+00 6.7640e-03 -1.0709e-02 0.0000e+00 12 9 9 12 1 1 999.00 18.52 0.36 -0.01071 -0.01606 1 53 1 5 0 567.030 23.11 15.00 18.52 25.49 25.1 1100.00 16390 -44736 -102201 900000 68041 900000 -90318 900000 -86907 41117 -61670 118960 -102034 41798 -68116 65806 385 55665 16385 -18772 -10643 13064 -4159 -2883 53662 -24182 85887 -16169 22558 -19239 13135 -16578 10655 -24579 18736 -23961 -1135 3514 4831 790 9579 11834 -10516 13413 -7145 10114 1349 -2652 3234 1611 -94 8101 -5862 3662 3838 2612 5753 -560 2682 -3015 -1974 4115 4590 5767 7734 2637 919 -1893 4360 2049 1594 -2445 -1083 3172 -1402 1510 1274 -715 -1905 -54 -4743 963 -3436 2821 -2868 -518 -3501 2049 1786 -1814 270 -1569 -389 -2158 833 -1221 -1307 -1621 -1196 -1078 1790 -331 -538 1509 -106 -2411 -1655 -978 -818 2310 264 1700 1030 113 -419 2083 -473 1803 -1609 -204 -940 121 515 -65 -52 390 841 1581 1451 466 744 183 -114 -782 429 -12 276 -389 -113 -1244 -48 -435 54 231 -745 -3272 900000 958 900000 -2313 900000 -2893 579 -1816 1676 -5749 765 -4187 1390 16 1426 671 -1154 -627 602 -234 -177 2061 -2167 2903 -1325 1184 -1552 875 -1741 982 -3260 1679 -3129 -128 445 686 143 1810 2347 -2740 2818 -1845 2232 328 -679 801 422 -27 2247 -2039 1258 1402 1005 2231 -233 1049 -1215 -798 1694 2119 2750 3851 1329 449 -954 2215 1241 1017 -1715 -752 2019 -865 866 665 -370 -1071 -35 -3514 769 -2970 2414 -2609 -496 -3649 2096 1845 -1890 257 -1492 -343 -1913 781 -1259 -1459 -1964 -1596 -1456 2215 -400 -587 1698 -125 -2935 -2092 -1305 -1111 3365 413 2783 1621 181 -629 3009 -694 2694 -2524 -335 -1501 195 797 -98 -78 566 1154 2273 2201 764 1267 318 -206 -1491 828 -24 559 -807 -236 -2556 -96 -827 102 SS 20241031T131707.4Z 9070.553558 95 1 4.46 2 77.22 124.75 70.36 132.72 0.00 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