File name: Pandora206s1_BuffaloNY_20230910_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T061437.8Z 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_20230910_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: 20230910 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 20230910T142633.2Z 8653.601773 251 1 24.01 2 52.81 124.17 18.33 194.73 0.00 1 0.00 1 0 17 1.120e-01 2.292e-02 5.675e-02 1.549e-02 2.270487e-01 7.713647e-03 2.689442e-03 -6.000000e+00 6.319329e-02 229.52 -2.00 3.55 -2.00 317.33 0.00e+00 2.333498e-03 1.119053e-03 1.981129e-04 -6.000000e+00 2.806994e-03 285.83 -2.00 20.00 -2.00 316.53 0.00e+00 1.650 0.000 302.00 328.00 3 8.0608e+00 2.0501e-02 2.0116e-02 -6.0000e+00 1.5758e-01 9.1673e-02 2.3108e-02 1.2265e-02 -6.0000e+00 1.7096e-01 1.9260e-02 1.3894e-02 5.7917e-03 -6.0000e+00 1.0187e-01 -1.9929e-02 6.8587e-03 2.5012e-03 -6.0000e+00 4.3369e-02 2.4242e-05 -3.9294e-04 4.3134e-04 2.2222e-05 -6.0000e+00 2.8549e-03 -2.0494e-02 2.1029e-04 12 8 8 10 0 0 45.62 18.12 1.67 -0.02049 -0.02345 6 6 2 8 0 4000.000 15.00 18.12 27.70 21.58 21.58 19.2 995.22 -13502 116992 -564 632 -1258 17419 5962 -16162 9615 17145 27840 -3362 -6847 3904 1387 -461 10565 445 2941 1579 6877 1963 1193 8887 4978 -823 -485 3020 -5003 -606 -1026 -7383 6013 -2695 5208 -2146 3713 1093 662 -6903 853 -5662 2280 -694 5909 -5480 -6336 -13256 -3379 4850 -1109 2383 -2016 4209 375 1751 -296 231 -4010 -1592 413 5837 1522 2550 896 -648 439 -6933 2569 -4225 5588 -1145 5345 2878 2450 8756 -2378 -581 -1904 -1018 157 1353 -1785 -486 824 1679 -268 1290 262 323 -95 656 -2222 -2847 166 -2482 2408 -21 1993 130 3624 -2886 -127 -2758 -82 -2342 -1200 185 -1093 -930 1603 1169 -2455 -707 -2864 140 -2043 -771 -2438 1348 -209 1272 625 1764 3320 -1012 750 290 1480 -1607 2217 -1401 439 499 -644 1179 1104 1904 -406 715 -825 -606 -2647 -1785 4949 -75 79 -138 1536 616 -2220 1171 2055 2917 -480 -1138 670 270 -102 2175 105 701 395 1723 506 312 2261 1363 -247 -146 828 -1368 -155 -280 -2292 1770 -906 1487 -629 1120 388 282 -3737 467 -3325 1320 -419 3326 -3469 -3968 -8618 -1938 2531 -645 1433 -1328 2745 261 1214 -213 165 -2912 -1119 293 4213 1245 2209 789 -527 324 -5298 1864 -3743 4937 -1129 4947 2631 2097 6504 -1771 -398 -1362 -815 135 1265 -1837 -511 918 1994 -330 1621 335 397 -111 694 -2264 -2774 165 -2701 2764 -27 2719 176 4452 -3487 -143 -3199 -101 -3127 -1652 263 -1591 -1433 2538 1878 -3914 -1059 -3991 177 -2614 -1015 -3512 2009 -323 1916 927 2469 4454 -1352 928 359 1937 -2308 3217 -2092 651 762 -1061 2006 1922 3373 -743 1257 -1422 -1007 -4365 SS 20230910T145335.8Z 8653.620553 266 1 45.50 2 48.90 131.25 20.31 211.91 0.00 1 0.00 1 0 17 8.994e-03 5.760e-03 4.359e-03 1.937e-03 1.929928e-01 9.652464e-04 2.346589e-03 -6.000000e+00 5.073038e-03 229.52 -2.00 3.55 -2.00 316.59 0.00e+00 3.954873e-04 1.166109e-04 4.274245e-05 -6.000000e+00 2.254292e-04 285.83 -2.00 20.00 -2.00 315.81 0.00e+00 1.518 0.000 302.00 328.00 3 5.4960e+00 2.5318e-03 1.7990e-02 -6.0000e+00 1.2650e-02 1.1407e-02 2.8388e-03 1.0109e-02 -6.0000e+00 1.3726e-02 5.3604e-03 1.6479e-03 4.9273e-03 -6.0000e+00 8.1788e-03 -4.7750e-03 7.7813e-04 1.3874e-03 -6.0000e+00 3.4806e-03 4.0151e-04 1.4028e-04 5.3451e-05 1.5203e-05 -6.0000e+00 2.2929e-04 -1.9269e-02 1.5535e-04 10 0 0 10 0 0 99.99 18.12 0.20 -0.01927 -0.01821 64 20 1 8 0 710.880 15.00 18.12 28.57 21.58 21.58 19.5 1002.33 -1910 523 -1026 -3264 -3292 -397 -1342 238 2034 908 -537 -1996 -2268 -534 56 -300 367 38 403 555 1875 -44 689 -58 46 30 36 498 -755 811 760 1328 1819 493 -2125 -1970 -2034 -791 -117 -362 -741 -855 -164 -947 115 -850 -639 -976 -758 -402 1216 541 829 974 976 1236 804 601 451 376 569 1267 1558 1614 61 -21 -369 -886 173 204 454 699 383 527 422 -431 -821 -894 -686 -757 -1062 -575 -1973 -1284 -1088 -546 -181 -55 263 245 413 309 -47 -8 145 45 513 643 334 -326 -7 -710 -444 -236 -713 -774 -575 -531 -170 51 492 404 59 -22 -311 88 -299 125 111 209 -271 251 399 396 924 283 723 762 616 283 371 -50 -181 4 60 140 -152 301 86 -284 -370 -589 -636 -336 98 -199 -604 -525 -60 -218 42 395 181 -110 -410 -496 -129 15 -89 111 12 129 183 622 -14 230 -21 17 12 14 177 -258 264 259 475 697 190 -801 -712 -808 -343 -60 -212 -474 -566 -111 -651 77 -578 -422 -623 -467 -253 791 363 581 717 738 941 627 468 344 285 444 1051 1340 1477 56 -18 -293 -679 137 179 435 698 384 511 382 -365 -652 -663 -523 -626 -983 -562 -2078 -1395 -1223 -657 -229 -70 333 309 478 337 -49 -8 149 49 592 822 438 -433 -9 -853 -500 -276 -890 -1017 -788 -734 -243 77 753 622 89 -31 -414 112 -384 161 154 301 -403 368 573 561 1229 375 898 946 817 385 526 -73 -267 5 94 230 -248 502 145 -467 -611 -944 -995 SS 20230910T145857.9Z 8653.624281 268 1 6.42 2 48.17 132.75 20.85 214.93 0.00 1 0.00 1 0 17 8.365e-03 6.164e-03 5.104e-03 2.830e-03 1.892160e-01 1.420906e-03 2.324717e-03 -6.000000e+00 4.718395e-03 229.52 -2.00 3.55 -2.00 315.81 0.00e+00 5.108835e-05 1.452467e-04 2.556340e-05 -6.000000e+00 2.096752e-04 285.83 -2.00 20.00 -2.00 315.10 0.00e+00 1.497 0.000 302.00 328.00 3 4.5993e+00 3.6884e-03 1.7713e-02 -6.0000e+00 1.1766e-02 5.7263e-03 4.1174e-03 9.9251e-03 -6.0000e+00 1.2766e-02 3.8283e-03 2.3619e-03 4.8428e-03 -6.0000e+00 7.6071e-03 -2.5554e-03 1.0799e-03 1.3401e-03 -6.0000e+00 3.2372e-03 1.0164e-03 1.2539e-04 7.6803e-05 1.5936e-05 -6.0000e+00 2.1327e-04 -1.8950e-02 1.5962e-04 12 1 1 12 1 1 90.55 18.12 0.29 -0.01895 -0.01801 6 15 1 8 0 916.160 15.00 18.12 29.18 21.58 21.69 19.6 1007.15 -2097 -569 91 -1849 -2554 -838 -543 -504 1629 517 -466 -2284 -391 -557 617 307 -103 579 -225 637 -122 842 -433 1372 134 512 529 806 -928 335 1262 644 2311 -556 -688 -2777 -1565 -1175 -238 -142 -763 -1101 -420 -830 -521 -706 1057 -540 -804 183 887 904 346 1745 331 1448 712 985 -404 466 831 843 1502 1213 351 -261 -283 -1198 664 176 471 -658 138 789 -44 -64 -610 -598 -677 -847 -846 -851 -2188 -1274 -876 -895 -325 122 431 250 549 400 388 27 867 335 380 696 200 -160 -94 -715 -145 -593 -546 -982 -537 -458 9 172 246 251 116 -24 -408 231 164 215 96 14 57 -314 430 -90 615 442 570 997 813 447 483 -41 -40 94 -87 -81 53 254 -56 -98 -531 -456 -777 -494 -144 23 -450 -564 -172 -117 -121 408 139 -122 -603 -112 -179 211 115 -40 226 -92 265 -52 349 -184 606 60 236 245 361 -384 138 517 279 1058 -271 -307 -1216 -743 -614 -142 -96 -545 -815 -318 -635 -393 -533 763 -395 -570 127 639 670 270 1412 269 1178 595 818 -332 391 691 750 1387 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