File name: Pandora206s1_BuffaloNY_20240512_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T081430.4Z 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_20240512_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: 20240512 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 20240512T131103.3Z 8898.549344 132 1 24.01 2 55.91 96.40 92.34 49.49 0.00 1 0.00 1 0 25 2.930e-01 2.430e-02 2.556e-01 1.948e-02 3.878740e-01 9.875360e-03 4.758149e-03 -6.000000e+00 1.672010e-01 230.73 -2.00 3.55 -2.00 319.03 0.00e+00 1.861187e-03 2.316617e-03 1.197568e-03 -6.000000e+00 7.423019e-03 281.08 -2.00 20.00 -2.00 318.35 0.00e+00 1.779 0.000 302.00 328.00 3 7.9819e+00 2.7529e-02 2.8111e-02 -6.0000e+00 4.2036e-01 1.0723e-01 3.1813e-02 2.2739e-02 -6.0000e+00 4.5652e-01 5.0991e-04 2.3787e-02 1.0172e-02 -6.0000e+00 2.6909e-01 -1.4111e-02 1.2613e-02 3.8257e-03 -6.0000e+00 1.1333e-01 1.7153e-05 4.2234e-04 5.4804e-04 3.2340e-05 -6.0000e+00 7.5668e-03 -1.8789e-02 3.2924e-04 12 8 8 10 0 0 93.39 18.37 2.11 -0.01879 -0.01562 6 6 2 8 0 4000.000 15.00 18.37 18.93 21.79 21.79 21.9 1014.16 138 9004 124767 7224 27628 53577 40472 900000 31207 900000 203710 163436 -17795 109142 2812 505 45841 26723 -10536 3530 40420 2305 60495 1291 25393 16520 15600 -8708 -1740 -684 13585 2066 8711 14960 8798 29916 -16404 -2843 10584 8761 -10158 -5366 1486 -1747 -712 276 -12122 -13859 4758 -164 5343 -1674 -11604 4539 7095 72 4754 -611 -4315 -5092 -7630 15 -3006 1269 -1340 5026 -4030 -2738 2593 -2705 3304 4464 -1674 4438 5520 1459 2327 -3989 -13 90 -4078 2835 -2134 537 590 3406 2064 1649 -2808 -223 -2 -697 1580 -703 -56 -1982 4035 -3505 4471 1876 -159 1505 -1967 -1880 2872 -2575 -248 1071 183 947 1015 -486 -2274 208 -2380 1177 -352 -269 -3428 -492 1099 -3891 1323 -930 3652 -1407 1134 737 1478 704 2300 -1014 205 324 -3031 1634 -776 832 1253 232 384 -1455 11 4 281 2369 235 665 1017 871 900000 928 900000 3869 3104 -1101 2349 202 43 2640 1981 -1163 365 2971 244 3791 152 2473 1842 1787 -1206 -210 -83 1581 300 1323 2273 1320 3617 -3356 -589 2321 2335 -3509 -1853 499 -616 -256 99 -4748 -5646 1609 -59 1964 -719 -5675 2083 3303 36 2365 -319 -2271 -2661 -4202 9 -1885 807 -890 2999 -2483 -1640 1568 -1982 2432 3383 -1341 3293 3737 916 1314 -2305 -7 61 -3280 2379 -1961 500 588 3533 2275 1879 -3355 -249 -3 -680 1390 -618 -53 -2131 4587 -4684 5903 2491 -201 1761 -2192 -2143 3410 -3280 -322 1448 265 1467 1686 -812 -3874 325 -3500 1617 -490 -390 -5321 -785 1740 -6301 1978 -1402 4971 -1926 1433 947 2062 1072 3671 -1682 344 564 -5824 3145 -1558 1679 2526 453 715 -2639 20 SS 20240512T140622.5Z 8898.587761 164 1 26.02 2 46.02 107.56 84.52 58.40 0.00 1 0.00 1 0 17 1.502e-02 6.569e-03 1.442e-02 3.644e-03 2.901251e-01 1.816529e-03 3.509022e-03 -6.000000e+00 8.501257e-03 230.73 -2.00 3.55 -2.00 317.73 0.00e+00 -1.890577e-04 2.882881e-04 7.934697e-05 -6.000000e+00 3.689346e-04 281.09 -2.00 20.00 -2.00 317.01 0.00e+00 1.438 0.000 302.00 328.00 3 6.1139e+00 4.8654e-03 2.1083e-02 -6.0000e+00 2.1295e-02 1.8983e-02 5.4885e-03 1.5287e-02 -6.0000e+00 2.3107e-02 -1.0470e-03 3.3998e-03 7.4816e-03 -6.0000e+00 1.3716e-02 -2.7575e-03 1.7122e-03 2.0644e-03 -6.0000e+00 5.7935e-03 1.9144e-04 -1.7777e-04 1.0063e-04 2.1618e-05 -6.0000e+00 3.8290e-04 -1.6723e-02 1.4059e-04 11 8 0 10 0 0 99.75 18.36 0.45 -0.01672 -0.01806 17 17 2 8 0 1530.240 15.00 18.36 20.97 21.79 21.79 21.9 1027.27 -6825 1401 4742 166 1408 3001 -516 1898 2441 3631 1333 210 -3317 -1422 -912 -2184 1488 2372 -191 1735 3480 -1260 1230 3054 -313 -4063 -499 28 -4314 297 1288 1126 1459 1384 -2812 -3957 -2599 -982 409 -399 -473 -1443 -252 -1380 -381 -383 -2128 -3921 -729 -435 932 280 548 2128 991 1240 1456 766 756 900 7 1901 1250 1733 276 401 -426 -951 328 215 1439 107 618 612 414 -606 -527 -788 -525 -473 -1406 -442 -1736 -1460 -779 -539 -27 -264 346 -15 552 164 674 66 566 204 454 712 357 -221 -250 -552 -799 -539 -347 -768 -513 -676 -544 144 650 970 -111 97 -181 78 -477 -207 -195 49 -373 -440 288 120 659 467 940 957 506 429 438 293 -85 -148 201 -50 -508 228 -81 -283 -250 -43 -442 -604 126 429 15 108 217 -41 166 240 377 139 23 -418 -203 -149 -403 276 455 -39 363 732 -273 266 695 -78 -1093 -131 7 -1008 65 302 285 404 402 -783 -1075 -768 -331 164 -178 -232 -743 -133 -741 -201 -202 -1123 -2054 -364 -217 488 159 328 1329 648 822 987 520 501 588 5 1359 981 1457 236 313 -312 -682 246 185 1256 99 566 538 363 -479 -375 -533 -371 -381 -1286 -415 -1765 -1540 -877 -650 -32 -323 422 -19 632 172 690 65 557 224 553 905 484 -294 -312 -676 -913 -637 -448 -981 -683 -946 -798 225 1007 1519 -169 146 -249 107 -658 -278 -282 75 -586 -680 432 172 945 641 1213 1244 713 608 655 451 -133 -241 327 -85 -897 408 -146 -495 -421 -73 -742 SS 20240512T141156.5Z 8898.591627 167 1 27.08 2 45.05 108.82 83.69 59.26 0.00 1 0.00 1 0 17 1.063e-02 5.581e-03 3.991e-03 1.267e-03 2.782342e-01 6.335800e-04 3.345500e-03 -6.000000e+00 6.021649e-03 230.73 -2.00 3.55 -2.00 317.29 0.00e+00 5.404825e-04 9.034048e-05 6.371248e-05 -6.000000e+00 2.612991e-04 281.09 -2.00 20.00 -2.00 316.59 0.00e+00 1.414 0.000 302.00 328.00 3 4.3610e+00 1.6824e-03 2.0389e-02 -6.0000e+00 1.5084e-02 5.0341e-03 1.8900e-03 1.4590e-02 -6.0000e+00 1.6367e-02 -2.0067e-03 1.1386e-03 7.1304e-03 -6.0000e+00 9.7151e-03 -1.9869e-03 5.6100e-04 2.0140e-03 -6.0000e+00 4.1037e-03 1.1612e-03 1.2235e-04 3.4759e-05 2.0946e-05 -6.0000e+00 2.7118e-04 -1.6581e-02 1.6051e-04 10 0 0 10 0 0 99.96 18.36 0.29 -0.01658 -0.01566 58 58 2 8 0 466.740 15.00 18.36 21.39 21.79 21.79 22.2 1031.54 -341 -2354 -48 -3570 -2767 -5981 -917 -2191 -740 -861 -2177 -2567 -1343 -759 -118 629 -241 663 -32 1595 426 242 166 667 -190 849 -502 -418 -884 265 1945 549 2008 -669 -1658 -2764 -1654 -1667 -158 -618 -526 -764 -604 -677 -351 -247 -620 -377 -514 282 300 1061 841 1419 731 1220 921 689 666 237 1165 1201 1697 1485 516 -577 -284 -783 1 123 511 357 311 455 -134 -42 -184 -774 -404 -493 -1112 -798 -2011 -1572 -1148 -770 -397 -103 336 58 589 177 301 179 606 122 524 627 164 -253 85 -626 -655 70 -737 -742 -674 -446 -366 154 403 243 111 161 -192 160 -54 356 81 102 -181 -125 272 230 801 286 675 976 499 233 285 57 -191 99 105 70 -157 136 -207 -279 -221 -417 -472 -37 -284 -6 -426 -284 -605 -94 -254 -95 -118 -295 -354 -208 -135 -24 142 -52 147 -8 379 105 59 41 175 -53 243 -147 -114 -246 72 558 172 617 -221 -507 -908 -539 -628 -71 -329 -281 -426 -347 -393 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