File name: Pandora155s1_BostonMA_20240811_L2Fit_fout2c9d20240425p1-8.txt File generation date: 20241210T070529.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jeff Gedes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 155 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora155_OF_v4d20190702.txt Instrument calibration file used: Pandora155s1_CF_v9d20240425.txt Level 1 file used: Pandora155s1_BostonMA_20240811_L1_smca1c9d20240425p1-8.txt Full location name: Boston University Short location name: BostonMA Country of location: USA Location latitude [deg]: 42.3497 Location longitude [deg]: -71.1040 Location altitude [m]: 40 Local noon date: 20240811 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: None First and last pixel inside fitting window: 232 374 Nominal wavelengths inside fitting window [nm]: 305.0903 305.2311 305.3720 305.5128 305.6537 305.7945 305.9353 306.0761 306.2169 306.3576 306.4984 306.6391 306.7799 306.9206 307.0613 307.2020 307.3427 307.4834 307.6241 307.7647 307.9054 308.0460 308.1866 308.3273 308.4679 308.6085 308.7490 308.8896 309.0302 309.1707 309.3113 309.4518 309.5923 309.7328 309.8733 310.0138 310.1543 310.2947 310.4352 310.5756 310.7160 310.8565 310.9969 311.1372 311.2776 311.4180 311.5584 311.6987 311.8390 311.9794 312.1197 312.2600 312.4003 312.5406 312.6808 312.8211 312.9613 313.1016 313.2418 313.3820 313.5222 313.6624 313.8026 313.9428 314.0829 314.2231 314.3632 314.5033 314.6434 314.7835 314.9236 315.0637 315.2038 315.3438 315.4839 315.6239 315.7639 315.9039 316.0439 316.1839 316.3239 316.4638 316.6038 316.7437 316.8837 317.0236 317.1635 317.3034 317.4433 317.5831 317.7230 317.8629 318.0027 318.1425 318.2823 318.4221 318.5619 318.7017 318.8415 318.9812 319.1210 319.2607 319.4005 319.5402 319.6799 319.8196 319.9592 320.0989 320.2386 320.3782 320.5178 320.6575 320.7971 320.9367 321.0762 321.2158 321.3554 321.4949 321.6345 321.7740 321.9135 322.0530 322.1925 322.3320 322.4715 322.6109 322.7504 322.8898 323.0292 323.1686 323.3080 323.4474 323.5868 323.7262 323.8655 324.0049 324.1442 324.2835 324.4228 324.5621 324.7014 324.8407 324.9800 --------------------------------------------------------------------------------------- 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 20240811T102217.6Z 8989.432148 53 1 49.71 2 84.83 74.32 151.86 25.05 0.00 1 0.00 1 0 46 1.774e+00 3.500e-01 5.474e-01 6.453e-02 1.057888e+00 3.703543e-02 5.143536e-02 -6.000000e+00 1.047070e+00 232.01 -2.00 3.54 -2.00 321.14 0.00e+00 2.950754e-01 1.533853e-02 6.948470e-03 -6.000000e+00 5.166514e-02 289.07 -2.00 20.00 -2.00 320.42 0.00e+00 9.559 0.016 302.00 328.00 3 -3.2276e+00 1.1265e-01 3.2998e-01 -6.0000e+00 2.6256e+00 6.3898e+00 1.4425e-01 5.4796e-01 -6.0000e+00 2.8505e+00 -1.3489e+00 9.5684e-02 3.5660e-02 -6.0000e+00 1.6939e+00 -8.0910e-01 4.1766e-02 2.2256e-01 -6.0000e+00 7.1158e-01 6.6365e-06 2.2456e-02 1.1877e-03 3.4875e-03 -6.0000e+00 5.1145e-02 -2.5552e-03 0.0000e+00 12 9 8 11 4 0 30.48 18.68 1.75 -0.00256 0.16619 14 3 1 5 0 3550.090 21.69 15.00 18.68 26.72 4.1 982.15 109530 105413 900000 200378 -83037 -187635 -270854 -413694 -565197 -385339 900000 -277375 14879 900000 158170 226762 324768 433071 240942 900000 139871 135114 900000 -3742 900000 -171615 -122518 44749 900000 267602 272902 216049 900000 204040 257903 452844 131416 203782 124203 99556 155817 214902 154184 254220 188129 314408 279181 340630 320695 334151 242101 278537 264322 197199 220569 102527 86693 83887 206438 149316 215070 279015 268693 231695 266208 223938 227974 216044 194455 190978 159489 155885 107472 104711 96084 129082 131079 193819 182987 -71887 154228 154894 127018 94365 132080 96607 93302 92514 104164 63716 67756 49455 60792 57692 117387 96663 99708 95594 79180 57148 41282 29879 39975 20789 19775 34034 14095 31702 32022 30762 17679 4965 -5110 -12219 704 -3345 9179 3466 1822 -16734 -21334 -24836 -26315 -30460 -24449 -19048 -9164 1867 12993 6431 6397 5376 3063 2262 -3570 -6367 -6409 -2897 -5606 -3741 3411 8438 20314 6883 6624 900000 12591 -8538 -12862 -17020 -25996 -74260 -24214 900000 -36444 935 900000 9939 14249 20408 27213 17893 900000 11186 8490 900000 -235 900000 -10784 -9239 2812 900000 16816 20578 33323 900000 29489 16206 28456 13213 12805 7805 6256 9791 13504 14533 15975 31918 21732 35086 25685 30228 27297 47161 33255 28236 27261 15246 16106 13619 15287 15567 30025 32435 29806 38834 52413 41820 49251 42976 43442 46433 42002 40088 32325 28364 23029 20528 21089 27181 30448 41395 -211490 52333 48666 47889 45659 41498 41887 40454 38368 34691 27226 23843 19578 23684 29364 43521 56490 67040 70281 63189 46684 30092 19339 21100 13063 12799 20531 11691 25698 29781 31509 20774 6303 -6679 -16278 831 -4415 11421 4683 2393 -23975 -28823 -32149 -32410 -37132 -27193 -20946 -10883 2488 18615 11234 12260 11216 6987 5486 -9466 -17845 -18565 -8174 -15712 -9732 7888 18983 45444 SS 20240811T103420.8Z 8989.440518 56 1 50.39 2 82.68 76.29 150.91 30.50 0.00 1 0.00 1 0 17 5.618e-01 1.536e-02 3.485e-01 9.511e-03 8.426033e-01 5.459209e-03 9.540930e-03 -6.000000e+00 3.317282e-01 232.01 -2.00 3.54 -2.00 322.11 0.00e+00 5.866860e-03 3.529659e-03 4.813074e-03 -6.000000e+00 1.644909e-02 289.07 -2.00 20.00 -2.00 321.60 0.00e+00 7.240 0.007 302.00 328.00 3 7.2102e-01 2.3555e-02 8.8242e-02 -6.0000e+00 8.2828e-01 5.8006e-01 3.4081e-02 5.3121e-02 -6.0000e+00 8.9725e-01 -7.4357e-01 3.1910e-02 2.8802e-02 -6.0000e+00 5.3370e-01 2.8807e-01 1.4205e-02 9.5391e-03 -6.0000e+00 2.2519e-01 8.4918e-05 -2.2250e-04 2.6471e-04 1.8845e-04 -6.0000e+00 1.6245e-02 -1.3541e-03 0.0000e+00 12 9 8 11 4 0 -23.17 18.70 0.52 -0.00135 -0.00303 86 16 1 5 0 585.870 21.69 15.00 18.70 27.04 4.1 985.56 -205371 900000 -195722 900000 -200313 900000 -249587 -127323 -131866 -147484 -172438 900000 -161778 -163379 14135 -45498 153839 -76460 30637 -63319 9862 -98240 -35296 28373 -60732 -74354 900000 -53438 -72591 36550 -58155 18793 -28126 -4365 -40473 56848 -21848 25996 -16018 68961 -477 13961 7878 -11256 12682 9390 28782 -10653 52539 -1035 25026 8212 38943 10318 10984 9217 22606 15727 16584 5679 1640 17246 8154 18420 4940 12158 227 13705 2462 13317 10325 15592 6286 2920 2703 397 3098 -5765 970 -4101 4033 1491 5245 42 -493 1843 3233 -32 2218 816 1357 -1865 -6704 -396 -3379 -1616 -2283 -144 -751 -1010 -819 -2644 -2691 -1973 -2347 -2574 306 -2424 590 -1089 246 -1050 83 31 -405 -755 583 118 -63 635 557 1361 438 2403 287 1118 65 1632 228 501 78 453 -190 3 -392 -209 615 194 419 -639 667 -1749 -533 -2768 900000 -2803 900000 -2531 900000 -5257 -1180 -1222 -1503 -2179 900000 -2862 -3854 131 -548 1426 -1559 284 -1232 91 -2640 -523 263 -1294 -1860 900000 -1040 -1749 339 -1725 313 -860 -109 -1388 738 -688 602 -683 1470 -23 608 380 -668 599 470 1227 -711 1996 -74 1554 677 2598 904 1009 893 2137 1418 1568 589 169 1700 1017 2343 757 1731 37 2090 475 2637 2288 3363 1440 640 533 72 530 -1151 212 -1144 1227 534 1984 18 -225 869 1572 -16 1099 392 607 -820 -3089 -186 -1899 -1059 -1775 -127 -716 -958 -719 -2114 -1984 -1468 -1876 -2184 270 -2396 638 -1375 344 -1588 126 46 -579 -1060 829 177 -100 1022 874 2017 631 3290 388 1454 85 2285 376 944 164 937 -423 6 -1010 -561 1668 533 1133 -1656 1586 -3988 -1177 SS 20240811T104506.2Z 8989.447989 59 1 50.47 2 80.75 78.04 149.91 35.10 0.00 1 0.00 1 0 25 5.420e-01 9.161e-03 1.475e-01 3.170e-03 7.184707e-01 1.747464e-03 8.174365e-03 -6.000000e+00 3.173431e-01 232.01 -2.00 3.54 -2.00 321.68 0.00e+00 3.804457e-03 9.992511e-04 3.589402e-03 -6.000000e+00 1.425594e-02 289.07 -2.00 20.00 -2.00 321.09 0.00e+00 5.902 0.004 302.00 328.00 3 5.9633e-01 6.7134e-03 7.2148e-02 -6.0000e+00 7.9443e-01 1.8801e-01 9.5843e-03 4.4080e-02 -6.0000e+00 8.5993e-01 -2.4234e-01 9.2964e-03 2.3037e-02 -6.0000e+00 5.1254e-01 8.9556e-02 4.2596e-03 6.8689e-03 -6.0000e+00 2.1492e-01 4.0476e-04 1.6099e-04 9.0642e-05 1.0684e-04 -6.0000e+00 1.5309e-02 -1.8471e-03 0.0000e+00 11 9 0 11 4 0 8.49 18.72 0.44 -0.00185 -0.00064 212 40 1 5 0 238.040 21.69 15.00 18.72 27.37 4.1 987.73 -203158 -218019 -197145 -169527 -141134 -209697 -76747 -182744 -131151 -142673 -159427 -120902 -121128 -91908 -93849 -39200 -39971 -31704 -53785 -25868 -58970 -33842 -41469 -46423 -34232 -15128 -38186 -53046 -38123 -62289 -15981 -21468 3967 -25685 -3618 -23223 -10438 -5069 1499 921 8737 7463 11 3021 -169 12597 -3788 1786 3815 8037 2947 11590 5414 8063 6655 6065 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