File name: Pandora206s1_BuffaloNY_20240430_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T081200.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240430_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240430 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240430T111838.8Z 8886.471282 154 1 28.01 2 78.70 79.95 70.03 188.55 0.00 1 0.00 1 0 17 5.270e-01 6.622e-02 3.793e-01 4.707e-02 6.714418e-01 2.798978e-02 7.988574e-03 -6.000000e+00 3.202373e-01 229.65 -2.00 3.55 -2.00 321.15 0.00e+00 1.160596e-02 1.217849e-02 9.156491e-04 -6.000000e+00 2.124819e-02 279.71 -2.00 20.00 -2.00 320.61 0.00e+00 4.930 0.002 302.00 328.00 3 5.8713e+00 9.2584e-02 6.0689e-02 -6.0000e+00 8.1904e-01 8.1252e-01 1.1479e-01 3.7845e-02 -6.0000e+00 9.0471e-01 -9.9925e-01 9.7797e-02 2.0113e-02 -6.0000e+00 5.2028e-01 4.4323e-01 4.8578e-02 1.1507e-02 -6.0000e+00 2.2208e-01 4.4578e-06 -3.7445e-03 1.4300e-03 1.3255e-04 -6.0000e+00 1.5573e-02 -1.8475e-02 3.9781e-04 12 8 8 10 0 0 93.45 18.49 1.60 -0.01848 -0.04661 7 7 4 8 0 4000.000 15.00 18.49 18.34 21.88 21.88 21.6 1021.76 -74789 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 44699 900000 900000 13954 900000 900000 900000 900000 900000 900000 900000 900000 900000 107388 143370 900000 -43002 900000 57192 900000 130437 900000 106912 900000 900000 -86101 900000 134852 900000 26653 164866 72310 900000 60329 -4919 -61967 176106 91547 215378 89697 59156 39357 99722 25970 35077 59811 -4169 -10270 -14064 155152 8404 9348 9799 42447 10892 18071 55939 -21898 21834 3970 16696 2059 20025 14077 49425 8694 885 14839 2164 23092 27480 -7604 876 5471 -3832 -863 -22520 -1473 -10306 -3002 5182 -1388 -64 -4575 3336 -464 2225 -598 5932 -1073 -326 -9241 8173 -11211 3099 4054 -3372 -4255 2592 4273 -10585 -585 -2644 8159 -6603 2325 -4578 2365 6340 -2268 3491 5812 7960 -1207 6350 3290 1773 -2474 5210 539 677 -1744 2761 -2253 -3059 2558 -220 2782 1093 -3568 -3668 -5940 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 2037 900000 900000 790 900000 900000 900000 900000 900000 900000 900000 900000 900000 4894 6534 900000 -3741 900000 2606 900000 5944 900000 4872 900000 900000 -18811 900000 6145 900000 3075 7513 5740 900000 5410 -827 -18056 8026 6460 9815 7648 7077 6109 9089 4808 5945 8001 -974 -2457 -3525 8249 2047 2556 2861 8644 2932 4555 10526 -9647 7121 1563 5897 789 5818 3829 8864 2241 270 4692 912 9044 11388 -4547 510 3241 -2609 -587 -19157 -985 -7192 -1800 2716 -779 -39 -3414 2675 -435 2264 -634 5562 -977 -270 -8133 6530 -11162 2890 4018 -3800 -5412 3454 6007 -17438 -846 -3684 9958 -9036 3034 -6796 3439 8835 -3295 4757 7450 9512 -1525 7117 3861 2384 -3925 8429 949 1244 -3445 5571 -5035 -7000 5596 -496 5802 2227 -7114 -6927 SS 20240430T144922.8Z 8886.617625 266 1 24.00 2 41.38 121.43 88.37 231.36 0.00 1 0.00 1 0 17 6.562e-02 2.219e-02 4.847e-02 1.585e-02 2.232021e-01 7.878066e-03 2.663581e-03 -6.000000e+00 3.701977e-02 229.67 -2.00 3.55 -2.00 317.32 0.00e+00 -2.029574e-03 1.096285e-03 5.620817e-05 -6.000000e+00 1.602954e-03 279.72 -2.00 20.00 -2.00 316.60 0.00e+00 1.331 0.000 302.00 328.00 3 8.4399e+00 2.0902e-02 1.7594e-02 -6.0000e+00 9.2538e-02 7.9868e-03 2.3538e-02 1.1734e-02 -6.0000e+00 1.0050e-01 1.1702e-02 1.4146e-02 5.7515e-03 -6.0000e+00 5.9661e-02 5.6196e-04 6.9094e-03 2.2042e-03 -6.0000e+00 2.5237e-02 2.3679e-05 -3.0980e-04 4.4379e-04 1.9401e-05 -6.0000e+00 1.6725e-03 -1.8943e-02 1.7759e-04 12 8 8 10 0 0 -1355.35 18.45 1.07 -0.01894 -0.02127 6 6 2 8 0 4000.000 15.00 18.45 21.60 21.88 21.88 21.8 1042.77 -10722 13184 14764 10871 -1631 -4478 18791 17140 607 1138 24897 -45290 -16721 13525 7374 6218 13492 -1535 -728 -1109 9568 -520 8788 5734 2368 2460 3446 4293 -10297 -195 -919 3098 -2371 5838 5313 -3083 -8550 -1203 10179 -1386 707 -112 -423 1191 2103 1146 -5132 -12928 649 -1229 1988 -115 -1529 1354 7557 64 1781 1822 -626 -1915 -1747 2055 -1806 -962 542 910 836 -3158 -376 -1919 1031 1140 1847 2670 2725 1778 -4383 -3351 -3461 -1862 -1441 2038 -1280 -3714 -457 309 1775 672 642 163 1257 -409 1944 -228 603 -1966 1351 -341 1375 1064 1291 -2194 -2179 -309 2184 -1843 -815 1785 -312 1095 653 2744 -1655 -490 -1830 1147 -2480 -1844 -505 -232 -536 167 907 1482 2340 -5856 -232 1346 1359 64 1350 -707 378 -1571 -389 733 -1407 1285 1188 1327 636 -1383 -1000 -1461 1541 1740 1250 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5.584376e-04 279.73 -2.00 20.00 -2.00 316.13 0.00e+00 1.188 0.000 302.00 328.00 3 7.9510e+00 1.2678e-02 1.6537e-02 -6.0000e+00 3.2231e-02 8.2366e-02 1.4229e-02 1.1499e-02 -6.0000e+00 3.5006e-02 -8.3762e-03 8.3430e-03 5.6290e-03 -6.0000e+00 2.0781e-02 -7.0184e-03 3.9834e-03 1.6614e-03 -6.0000e+00 8.7899e-03 4.3028e-05 -4.6856e-04 2.6621e-04 1.7319e-05 -6.0000e+00 5.8268e-04 -2.0412e-02 8.4454e-05 12 8 8 10 0 0 69.53 18.43 0.96 -0.02041 -0.02393 6 6 2 8 0 4000.000 15.00 18.43 20.59 21.88 21.88 21.6 1034.78 2276 -1040 2517 2329 3932 -3133 4581 -588 2975 4957 5715 -1499 -6772 1357 1936 -3783 3951 5481 -1807 1735 1839 3600 2245 184 -637 984 1107 813 -6396 -1970 4957 -421 2670 1860 -2880 -5939 -6242 -4937 4583 -2897 1244 -1417 93 -869 -642 -607 -2825 -4241 -874 -1590 -316 2158 -712 898 1187 2514 1282 -1212 -325 -1787 971 1795 551 1654 1869 55 -507 -1958 653 -2310 2034 847 2767 1836 1676 -200 -1440 2187 -3491 -1313 -1721 158 -2780 -639 -632 106 1820 224 733 1507 1050 -1955 602 -2993 675 -1454 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