File name: Pandora206s1_BuffaloNY_20240216_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T072922.0Z 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_20240216_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: 20240216 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 20240216T141859.0Z 8812.596516 126 1 24.00 2 70.37 130.06 101.73 44.33 0.00 1 0.00 1 0 17 3.242e-01 1.889e-02 2.854e-01 1.593e-02 5.174553e-01 8.242758e-03 6.167748e-03 -6.000000e+00 1.819643e-01 224.73 -2.00 3.55 -2.00 320.14 0.00e+00 9.477890e-03 2.713432e-03 2.449165e-03 -6.000000e+00 9.394829e-03 272.54 -2.00 20.00 -2.00 319.67 0.00e+00 2.945 0.000 302.00 328.00 3 6.6244e+00 2.3693e-02 4.3292e-02 -6.0000e+00 4.5286e-01 1.3708e-01 2.9002e-02 3.7254e-02 -6.0000e+00 4.9635e-01 -3.3753e-02 2.8293e-02 1.4906e-02 -6.0000e+00 2.9029e-01 6.3990e-03 1.4802e-02 1.2707e-02 -6.0000e+00 1.2675e-01 1.8695e-05 -6.3466e-05 4.4557e-04 7.2700e-05 -6.0000e+00 8.6781e-03 -9.2880e-03 1.6965e-04 12 8 8 10 0 0 66.70 17.57 1.01 -0.00929 -0.00976 6 6 2 8 0 4000.000 15.00 17.57 4.51 21.17 20.96 19.4 941.99 900000 900000 -38948 900000 84768 900000 -100537 900000 89632 900000 900000 900000 -30060 900000 143717 12642 158593 27951 -6705 28316 54926 13350 182493 27502 99552 9069 32209 40299 -3295 48493 -10202 -7732 -8981 15195 -7948 24990 -1605 30415 32962 -8392 -12933 7224 19369 557 12018 -8556 -13860 -18553 18435 -10616 13481 1805 -2964 9136 5054 576 2758 -2144 3154 -2318 -7320 5827 -7408 -2908 -3882 -1510 -5347 -737 -1068 -740 6532 1833 3447 -414 3352 -6909 -6513 -2372 -3716 -30 2162 2349 -3225 2984 475 3379 1645 846 573 2525 -623 -1206 -1398 -517 -430 -1103 849 1953 1980 -290 2364 -1947 -195 -2123 784 -3736 387 -723 -439 74 695 65 -838 -212 -852 1244 -1375 -350 -1902 370 -865 -1671 -40 1152 2926 331 1106 1745 1772 43 2109 179 -737 -540 -1329 -841 619 -783 77 1861 940 -1026 -847 900000 900000 -604 900000 1315 900000 -2485 900000 1390 900000 900000 900000 -677 900000 2229 355 2460 826 -302 947 1484 518 2831 1018 1905 418 1241 1391 -168 1650 -722 -622 -845 1201 -736 1676 -150 2388 3036 -1341 -2389 1191 2995 104 2109 -1846 -3212 -4605 3351 -2610 2954 474 -878 2577 1542 187 889 -716 1001 -750 -2601 2008 -3291 -1379 -1916 -688 -2453 -325 -512 -408 3666 1116 2030 -239 1699 -3452 -3094 -1076 -1895 -17 1368 1674 -2618 2374 403 2964 1535 817 555 2292 -553 -994 -1087 -401 -369 -1093 916 2372 2507 -379 2795 -2162 -200 -2266 858 -4468 466 -938 -611 109 1115 109 -1381 -328 -1270 1720 -1969 -519 -2964 589 -1380 -2591 -61 1655 3927 451 1429 2325 2561 69 3503 318 -1362 -1045 -2693 -1771 1304 -1705 164 3742 1855 -1956 -1562 SS 20240216T144654.0Z 8812.615903 140 1 34.16 2 66.64 136.20 98.08 49.41 0.00 1 0.00 1 0 17 4.561e-02 5.268e-03 4.055e-02 2.824e-03 4.520062e-01 1.399187e-03 5.348938e-03 -6.000000e+00 2.519370e-02 224.73 -2.00 3.55 -2.00 319.40 0.00e+00 1.189693e-03 3.641450e-04 2.585365e-04 -6.000000e+00 1.081452e-03 272.54 -2.00 20.00 -2.00 318.88 0.00e+00 2.503 0.000 302.00 328.00 3 4.6774e+00 3.8688e-03 3.3867e-02 -6.0000e+00 6.2402e-02 3.1486e-02 4.5301e-03 2.3380e-02 -6.0000e+00 6.8159e-02 -9.0075e-03 3.7196e-03 1.1776e-02 -6.0000e+00 4.0451e-02 -3.7054e-03 1.9837e-03 3.6631e-03 -6.0000e+00 1.7140e-02 2.3520e-04 -4.9922e-04 7.7188e-05 3.6089e-05 -6.0000e+00 1.1623e-03 -4.6066e-03 2.4200e-05 12 1 1 12 1 1 99.98 17.57 0.32 -0.00461 -0.00836 34 15 1 8 0 974.060 15.00 17.57 5.24 21.17 20.96 19.5 947.16 -27837 -3075 -19380 -4864 -1661 -9009 -10263 -13885 -10090 -8857 -4522 27412 -5983 -5034 -4256 -1685 -423 959 447 -4455 871 2402 1867 -3159 -2837 -1061 -2242 -2043 -5678 -634 -266 -805 1129 -2594 2487 -4854 -5669 -1692 663 -269 -2130 -762 1020 -1751 551 -303 -1708 -1199 1362 637 540 1301 478 1413 618 619 459 470 389 1204 2697 1461 -227 1410 393 1306 -325 -2007 302 -162 1321 293 271 751 324 -93 -822 -558 -693 -577 -703 -653 -2303 -378 -1032 -632 -181 261 599 612 -67 518 647 -139 483 71 1024 721 351 -99 -188 -722 -720 -103 -786 -709 -867 -493 -627 -61 358 163 17 101 -234 212 -375 463 -81 188 -231 -256 578 126 642 71 685 818 466 89 222 36 -215 32 -279 -203 115 229 65 -339 -100 -87 -287 -633 -62 -487 -100 -29 -169 -212 -337 -268 -250 -123 585 -216 -219 -222 -99 -27 64 32 -350 66 178 146 -282 -268 -104 -225 -194 -529 -59 -28 -96 150 -376 318 -658 -866 -292 137 -63 -560 -208 286 -512 158 -89 -507 -355 399 195 181 474 189 594 273 281 215 218 175 530 1210 726 -128 812 232 755 -184 -1158 185 -109 958 223 203 531 211 -57 -469 -313 -426 -390 -543 -566 -2067 -348 -1028 -670 -200 295 673 656 -67 498 582 -127 479 76 1228 931 485 -133 -237 -871 -802 -118 -990 -886 -1140 -686 -889 -94 594 265 29 158 -340 305 -546 701 -126 305 -374 -403 878 192 929 99 906 1117 707 142 376 64 -374 59 -547 -397 227 463 132 -687 -193 -159 -513 SS 20240216T145640.6Z 8812.622693 145 1 7.29 2 65.43 138.45 96.74 51.13 0.00 1 0.00 1 0 17 8.404e-02 9.951e-03 1.246e-01 1.034e-02 4.446758e-01 5.080063e-03 5.307873e-03 -6.000000e+00 4.643872e-02 224.73 -2.00 3.55 -2.00 318.95 0.00e+00 1.103373e-03 1.163877e-03 1.978203e-04 -6.000000e+00 1.993089e-03 272.54 -2.00 20.00 -2.00 318.42 0.00e+00 2.389 0.000 302.00 328.00 3 5.4064e+00 1.3852e-02 3.2805e-02 -6.0000e+00 1.1502e-01 5.6946e-02 1.5983e-02 2.2931e-02 -6.0000e+00 1.2562e-01 -4.3715e-03 1.2273e-02 1.1514e-02 -6.0000e+00 7.4551e-02 -1.0278e-02 6.5809e-03 3.5439e-03 -6.0000e+00 3.1602e-02 1.2533e-04 -1.1608e-04 2.7918e-04 3.5074e-05 -6.0000e+00 2.1413e-03 -6.1226e-03 7.6796e-05 12 9 9 12 1 1 999.00 17.56 0.48 -0.00612 -0.00699 1 7 1 8 0 3644.490 14.99 17.56 5.62 21.17 20.96 19.6 950.01 -51612 41495 12330 12515 -2303 -48978 16749 5433 1794 -25041 11837 -3509 -8304 -17268 -14299 4451 8672 -3264 -11816 -4432 1190 -2869 2380 405 2653 5300 -8804 4720 -4674 2326 -6463 1546 1792 -2946 -3754 -7713 3556 -4986 4232 -2525 1799 2038 4323 -26 347 -3392 -2919 -3474 4825 3928 2629 1835 1459 2229 -458 352 -763 -928 -2125 1875 1946 470 -804 158 3063 -717 -1149 -1091 1861 142 1728 518 1363 883 267 -1847 -898 -1399 -1097 -108 -2148 29 -2139 -1415 -1566 1061 -232 -982 577 1725 533 813 439 -788 1496 180 1324 197 1 -434 416 -467 -1568 -63 -1328 -1986 -1115 -648 -426 1039 1211 -17 228 152 -774 -127 322 404 -273 -507 72 -575 408 -387 1054 752 1735 1203 731 -77 956 -819 -37 71 85 -829 -211 -48 213 581 -143 147 -1231 -1882 697 294 283 -53 -1780 353 141 55 -1078 354 -132 -396 -1092 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