File name: Pandora206s1_BuffaloNY_20241101_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T093905.9Z 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_20241101_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: 20241101 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 20241101T151804.1Z 9071.637548 145 1 24.01 2 62.17 152.28 66.00 153.33 0.00 1 0.00 1 0 17 1.508e-01 2.531e-02 9.492e-02 1.744e-02 2.664992e-01 8.558190e-03 3.311610e-03 -6.000000e+00 8.360478e-02 223.89 -2.00 3.55 -2.00 317.93 0.00e+00 2.012764e-03 1.443229e-03 2.409993e-04 -6.000000e+00 3.684215e-03 279.39 -2.00 20.00 -2.00 317.27 0.00e+00 2.131 0.000 302.00 328.00 3 7.7263e+00 2.2772e-02 2.4974e-02 -6.0000e+00 2.0627e-01 1.0570e-01 2.5798e-02 1.4229e-02 -6.0000e+00 2.2457e-01 1.0028e-02 1.6491e-02 6.9122e-03 -6.0000e+00 1.3390e-01 -1.0173e-02 8.5861e-03 2.6568e-03 -6.0000e+00 5.7650e-02 2.0028e-05 -7.4088e-04 4.8751e-04 2.5381e-05 -6.0000e+00 3.8348e-03 -5.1391e-02 2.5647e-04 12 8 8 10 0 0 92.58 18.50 2.61 -0.05139 -0.05696 6 6 2 8 0 4000.000 14.99 18.50 17.39 21.98 21.79 23.8 947.52 1992 72422 7972 18262 8688 54444 -10875 44850 35959 80590 8038 70574 4709 8336 -2617 6337 31433 9594 10313 -8790 18499 -37918 36061 15015 9776 -22396 3512 -2549 2543 6593 6660 10636 -4361 4225 773 9014 -28254 11822 -800 2507 197 1572 1874 423 -5087 -1883 -6940 -9603 2554 3124 -1393 271 3711 2056 7273 2187 121 144 -625 -3005 -3547 1544 1347 1978 -2342 5056 -3866 560 31 -1106 4986 8350 1901 1017 2527 555 138 -7080 -3492 -5427 1166 -206 -3384 763 -82 478 893 -538 101 -502 -1014 597 1516 -2665 -2342 -3143 500 2118 1633 1249 818 1330 -1670 -1409 -1519 -679 4749 -259 144 -1126 1056 471 -1347 -881 -1553 937 -1867 -1471 -2030 -662 505 192 353 43 1641 166 -472 2634 990 465 933 989 -414 -1483 641 -4 709 -1178 595 675 602 -1427 -583 152 3217 690 1397 642 2389 -913 2435 2386 3837 763 3640 504 1001 -392 990 4189 1596 1781 -1906 3247 -11202 5222 2825 2027 -6438 824 -610 532 1273 1359 2258 -1167 1119 201 1997 -9686 3087 -282 1022 89 736 906 212 -2684 -998 -3833 -5304 1225 1470 -713 148 2058 1225 4284 1372 79 95 -403 -1952 -2354 1038 989 1565 -1930 3716 -2841 377 22 -874 4149 7085 1741 910 2093 422 97 -4983 -2393 -4117 937 -186 -3426 769 -88 554 1055 -669 127 -617 -1199 633 1451 -2578 -2260 -3370 574 2674 2180 1670 1068 1595 -1897 -1592 -1880 -888 6113 -369 206 -1737 1701 783 -2221 -1352 -2268 1231 -2471 -2002 -2965 -1026 802 302 542 64 2255 229 -617 3263 1328 652 1378 1513 -652 -2419 1085 -7 1305 -2186 1103 1258 1078 -2517 -984 SS 20241101T152336.3Z 9071.641393 148 1 7.84 2 61.71 153.71 65.59 154.66 0.00 1 0.00 1 0 17 1.111e-02 6.519e-03 9.098e-03 3.127e-03 2.523349e-01 1.534601e-03 3.119342e-03 -6.000000e+00 6.158136e-03 223.89 -2.00 3.55 -2.00 317.11 0.00e+00 6.813752e-04 2.100423e-04 5.185393e-05 -6.000000e+00 2.713871e-04 279.39 -2.00 20.00 -2.00 316.45 0.00e+00 2.100 0.000 302.00 328.00 3 4.2994e+00 4.0082e-03 2.4193e-02 -6.0000e+00 1.5193e-02 4.0216e-03 4.5109e-03 1.3013e-02 -6.0000e+00 1.6542e-02 -2.9711e-03 2.7121e-03 6.4613e-03 -6.0000e+00 9.8631e-03 -6.7147e-04 1.3483e-03 1.9351e-03 -6.0000e+00 4.2459e-03 6.9455e-04 2.0859e-04 8.5887e-05 2.0824e-05 -6.0000e+00 2.8248e-04 -4.9561e-02 3.0064e-04 12 9 1 12 1 1 98.88 18.49 0.26 -0.04956 -0.04799 8 31 2 8 0 870.870 15.00 18.49 17.51 21.98 21.79 23.9 948.54 -3795 -821 -2608 -2248 -5085 -2617 -869 -2185 -730 213 -3002 -1503 -990 -1794 510 924 190 -412 391 848 566 -515 1410 1740 116 984 -737 561 -683 164 322 229 552 1029 -2357 -1339 -3285 -1322 894 -1223 -1173 -747 -464 -311 -86 -14 -411 -573 -269 -337 733 672 528 1494 883 1010 1028 884 132 625 909 2002 1044 1831 1434 438 -490 -1031 546 170 92 -2 141 399 54 328 54 -1357 -172 -940 -1214 -906 -2185 -1687 -1645 -558 -466 -434 -87 330 566 778 -112 30 793 359 4 665 490 -242 -158 -212 -674 -341 -208 -876 -734 -736 -519 274 851 114 108 48 -70 86 547 747 106 -49 -524 -174 20 48 629 271 612 1583 833 162 500 60 -146 131 160 -79 -169 227 -44 -553 -420 -391 -426 -456 -108 -353 -304 -619 -285 -96 -271 -100 31 -456 -221 -160 -336 103 211 46 -104 102 227 157 -142 383 499 36 311 -243 174 -196 45 93 71 184 367 -818 -429 -1152 -502 397 -624 -669 -431 -276 -189 -51 -8 -253 -343 -157 -194 437 420 348 1033 622 721 750 649 95 443 655 1522 849 1554 1252 367 -391 -794 425 147 86 -2 138 376 49 277 42 -1028 -130 -785 -1087 -876 -2254 -1799 -1824 -646 -569 -539 -109 402 669 859 -116 30 801 391 4 833 650 -322 -203 -258 -780 -397 -258 -1139 -993 -1023 -737 401 1290 179 164 70 -98 113 724 999 149 -73 -792 -259 30 69 867 367 800 2063 1113 229 725 90 -225 202 256 -132 -288 387 -76 -945 -705 -648 -685 SS 20241101T152819.3Z 9071.644668 150 1 46.58 2 61.34 154.93 65.25 155.81 0.00 1 0.00 1 0 17 9.969e-03 5.506e-03 4.860e-04 1.660e-04 2.503076e-01 8.137676e-05 3.091911e-03 -6.000000e+00 5.526485e-03 223.89 -2.00 3.55 -2.00 317.19 0.00e+00 4.400171e-04 1.141417e-05 5.381279e-05 -6.000000e+00 2.435905e-04 279.39 -2.00 20.00 -2.00 316.53 0.00e+00 2.075 0.000 302.00 328.00 3 3.4980e-01 2.1305e-04 2.3937e-02 -6.0000e+00 1.3635e-02 -1.9313e-02 2.4007e-04 1.2896e-02 -6.0000e+00 1.4846e-02 -5.9991e-03 1.4425e-04 6.4172e-03 -6.0000e+00 8.8520e-03 4.4645e-04 7.1594e-05 1.8757e-03 -6.0000e+00 3.8100e-03 3.7558e-02 4.0833e-05 4.5643e-06 2.0237e-05 -6.0000e+00 2.5358e-04 -4.9525e-02 2.4773e-04 10 0 0 10 0 0 29.31 18.49 0.33 -0.04953 -0.04922 3398 1050 2 8 0 13.490 15.00 18.49 17.66 21.98 21.79 24.0 950.49 -1913 -1939 -1197 -2666 -3873 -3639 -2512 -1387 -700 -1104 -2662 -2858 -1892 -1474 -325 65 -161 405 562 1143 886 342 740 684 151 308 139 -150 -903 -201 1088 696 1693 402 -1737 -2116 -1865 -1452 -574 -180 -501 -618 -459 -583 -125 -203 -220 -113 -446 -104 803 825 759 1114 774 1017 946 664 616 561 867 1061 1277 1611 590 -175 -180 -699 250 366 245 293 66 417 199 -14 -107 -743 -323 -535 -951 -809 -1944 -1725 -1307 -941 -514 -402 198 181 308 379 212 500 592 226 322 719 264 -218 -152 -502 -537 -11 -475 -863 -699 -654 -392 114 253 186 95 116 -7 216 294 303 221 175 -287 -92 211 150 590 523 429 1171 831 430 384 14 -67 19 -13 -26 -277 139 -164 -321 -239 -456 -440 -225 -256 -164 -360 -461 -397 -281 -170 -96 -165 -402 -425 -307 -274 -68 15 -40 103 136 284 228 96 207 185 43 92 42 -44 -267 -56 318 219 520 134 -557 -699 -661 -532 -249 -93 -267 -345 -265 -343 -73 -119 -127 -64 -268 -61 490 498 484 750 545 725 690 488 443 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