File name: Pandora206s1_BuffaloNY_20241107_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20241108T051257.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 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_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20241107_L1_smca1c1d20220512p1-8.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: 20241107 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20241107T150402.3Z 9077.627804 139 1 24.00 2 65.12 149.49 118.05 100.91 0.00 1 0.00 1 0 17 4.910e-01 3.993e-02 2.200e-01 2.516e-02 2.965276e-01 1.244855e-02 3.620004e-03 -6.000000e+00 2.730557e-01 223.35 -2.00 3.55 -2.00 318.41 0.00e+00 -3.100660e-03 2.451911e-03 8.880140e-04 -6.000000e+00 1.253428e-02 278.63 -2.00 20.00 -2.00 317.75 0.00e+00 2.362 0.000 302.00 328.00 3 7.6460e+00 3.3533e-02 2.7508e-02 -6.0000e+00 6.7217e-01 6.9642e-02 3.8664e-02 1.5168e-02 -6.0000e+00 7.3234e-01 1.7690e-02 2.6873e-02 8.4954e-03 -6.0000e+00 4.3631e-01 -1.0888e-03 1.4037e-02 3.4779e-03 -6.0000e+00 1.8965e-01 1.6984e-05 6.8313e-04 7.2017e-04 2.7683e-05 -6.0000e+00 1.2623e-02 -1.8396e-02 3.6293e-04 12 8 8 10 0 0 42.76 18.45 4.73 -0.01840 -0.01326 6 6 2 8 0 4000.000 15.00 18.45 18.26 21.88 21.79 23.9 956.45 -1013 900000 158482 900000 -11416 900000 8934 441863 -102805 102459 158232 110813 24705 50839 23179 7920 134666 43488 27782 9161 60748 -2463 74397 17274 26313 -26556 14261 14423 17555 15629 16925 -1266 4812 31159 17627 20341 -11464 15620 21533 3498 4838 8758 -11656 2708 6965 2059 -4900 -21794 10524 -6645 5752 3860 2540 1969 7409 460 2517 2016 840 -9692 -559 4695 -5979 -482 -6958 3431 -9446 1855 -1379 732 3088 2373 -1703 846 3187 19495 8406 -6005 1108 -9213 -1315 47 -5948 -375 -1826 4928 3746 1371 -2448 966 -2137 1623 1137 -4141 -1924 -2297 2728 2399 1911 848 1698 -1089 -1824 -1493 1869 -1219 -3 -433 202 -1634 1157 2617 -3938 -1242 -356 239 -2475 324 -3724 -130 1426 -1 1649 1168 493 2616 420 2510 2605 -349 1566 191 -1929 -3617 -79 937 1163 3054 1240 432 1427 -5222 -1330 -58 900000 3886 900000 -735 900000 473 10836 -20397 3183 3880 3170 1778 3217 2200 959 5174 4162 3253 1299 5478 -402 5885 2624 3934 -6899 2617 2510 2680 2312 2597 -251 978 5250 3221 3379 -2820 3373 5297 1248 1861 3519 -5752 1172 2942 910 -2287 -11340 4021 -2996 2407 1786 1264 1048 3921 267 1473 1194 491 -6156 -327 2771 -4276 -354 -5603 2315 -6680 1133 -897 532 2450 2001 -1511 708 2443 11776 5078 -3912 684 -6872 -1027 40 -5886 -366 -1925 5239 4252 1652 -3100 1148 -2424 1620 1079 -3926 -1862 -2387 2997 2957 2563 1142 2135 -1297 -2080 -1705 2190 -1563 -4 -603 293 -2575 1896 4344 -6795 -1954 -509 325 -3398 447 -5533 -200 2219 -1 2463 1741 698 3460 536 3089 3434 -510 2378 305 -3196 -6071 -137 1688 2142 5637 2361 806 2607 -9488 -2320 SS 20241107T164500.1Z 9077.697918 197 1 21.62 2 59.65 176.14 101.17 115.56 0.00 1 0.00 1 0 17 9.807e-03 5.324e-03 1.216e-03 3.893e-04 2.454827e-01 1.904768e-04 3.043508e-03 -6.000000e+00 5.424050e-03 223.34 -2.00 3.55 -2.00 317.36 0.00e+00 4.270209e-04 2.753028e-05 5.444318e-05 -6.000000e+00 2.388531e-04 278.62 -2.00 20.00 -2.00 316.70 0.00e+00 1.971 0.000 302.00 328.00 3 9.0910e-01 4.9851e-04 2.2944e-02 -6.0000e+00 1.3369e-02 -1.5270e-02 5.6146e-04 1.2632e-02 -6.0000e+00 1.4566e-02 -2.5596e-03 3.4188e-04 6.2973e-03 -6.0000e+00 8.6844e-03 -1.8871e-03 1.7188e-04 1.8442e-03 -6.0000e+00 3.7388e-03 2.3797e-02 8.0271e-05 1.0766e-05 1.9979e-05 -6.0000e+00 2.4944e-04 -2.1701e-02 4.9528e-05 12 1 1 12 1 1 100.00 18.43 0.30 -0.02170 -0.02110 1272 848 2 8 0 16.690 15.00 18.43 19.83 21.88 21.79 24.2 966.84 -2179 -1663 -1557 -2352 -4213 -3328 -2218 -1102 -481 -1042 -2189 -3356 -1037 -1351 -141 -206 -3 -8 539 1231 962 87 738 680 -141 417 -72 27 -1147 142 1212 822 1617 473 -1843 -2036 -1784 -1209 -560 -254 -522 -822 -473 -806 -166 -432 -199 -314 -595 -233 811 744 802 1230 643 1121 885 678 485 671 851 1147 1247 1665 528 -180 -162 -664 322 368 323 301 149 391 211 -140 -53 -774 -314 -549 -979 -864 -1890 -1616 -1258 -792 -467 -292 252 316 298 419 170 471 576 234 371 777 243 -229 -136 -564 -539 -37 -411 -881 -691 -644 -336 159 308 219 164 191 -27 160 214 321 179 171 -315 -125 153 211 549 471 371 1106 750 389 347 -47 -72 -23 3 -47 -238 184 -95 -292 -209 -382 -433 -239 -204 -199 -293 -466 -335 -230 -125 -61 -144 -304 -463 -154 -232 -27 -45 -1 -2 131 308 248 22 189 185 -41 125 -22 8 -309 36 322 235 497 157 -589 -608 -573 -441 -221 -119 -275 -453 -269 -468 -95 -249 -113 -173 -321 -124 445 440 500 808 443 779 630 486 340 464 598 858 1015 1336 438 -151 -125 -494 243 317 285 280 140 356 181 -118 -40 -549 -224 -443 -895 -803 -1919 -1701 -1409 -955 -547 -355 309 377 356 457 169 441 560 252 443 952 324 -305 -170 -711 -628 -44 -532 -1125 -918 -899 -489 244 468 342 248 290 -38 207 271 422 252 260 -498 -195 234 310 760 624 503 1467 983 548 517 -73 -113 -37 5 -80 -414 326 -172 -518 -358 -631 -695 SS 20241107T165023.0Z 9077.701655 200 1 2.46 2 59.60 177.64 100.31 116.37 0.00 1 0.00 1 0 17 9.842e-03 5.562e-03 3.123e-03 1.142e-03 2.452402e-01 5.583613e-04 3.032414e-03 -6.000000e+00 5.442491e-03 223.34 -2.00 3.55 -2.00 317.02 0.00e+00 6.370001e-04 7.501939e-05 6.306439e-05 -6.000000e+00 2.396758e-04 278.62 -2.00 20.00 -2.00 316.37 0.00e+00 1.968 0.000 302.00 328.00 3 1.1187e+00 1.4553e-03 2.2889e-02 -6.0000e+00 1.3415e-02 -1.4435e-02 1.6401e-03 1.2569e-02 -6.0000e+00 1.4616e-02 -5.4249e-03 9.8189e-04 6.2709e-03 -6.0000e+00 8.7143e-03 1.9515e-04 4.8372e-04 1.8625e-03 -6.0000e+00 3.7512e-03 1.9348e-02 -8.4820e-05 3.1439e-05 1.9944e-05 -6.0000e+00 2.5033e-04 -2.1096e-02 3.7808e-05 12 1 1 12 1 1 98.59 18.43 0.28 -0.02110 -0.02173 61 357 2 8 0 39.670 15.00 18.43 20.41 21.98 21.79 24.6 972.57 -1691 -1906 -991 -2132 -3619 -4157 -2104 -1479 -255 -342 -1523 -3386 -2072 -1348 -154 596 -517 748 758 1509 985 128 364 935 192 296 664 -334 -1047 -225 1030 493 1063 262 -1856 -2304 -1623 -1490 -345 -302 -563 -902 -412 -643 -74 -121 -65 25 -818 -175 805 919 729 1108 724 978 731 642 642 460 993 1247 1393 1671 596 -247 -124 -664 266 239 390 391 190 461 146 -6 -257 -926 -281 -735 -1063 -763 -2009 -1494 -1338 -815 -588 -297 266 79 125 185 130 237 530 265 364 630 221 -133 -199 -606 -729 -256 -446 -929 -594 -568 -333 258 261 439 146 202 -27 252 104 300 190 197 -248 28 242 129 672 563 584 1040 719 294 351 7 -84 -14 -10 -35 -347 175 -79 -261 -262 -497 -479 -219 -277 -149 -314 -471 -499 -257 -198 -38 -55 -247 -550 -367 -272 -35 138 -127 187 197 404 272 35 100 271 59 94 216 -104 -331 -68 322 151 351 93 -633 -737 -555 -582 -159 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