File name: Pandora206s1_BuffaloNY_20240913_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240914T051457.0Z 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 v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240913_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: 20240913 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 20240913T115945.4Z 9022.499832 64 1 47.30 2 78.70 95.82 159.58 313.78 0.00 1 0.00 1 0 17 4.188e-01 2.294e-02 2.920e-01 1.095e-02 6.073993e-01 5.956994e-03 7.226603e-03 -6.000000e+00 2.407630e-01 229.17 -2.00 3.55 -2.00 321.09 0.00e+00 1.674081e-02 2.670320e-03 4.431082e-04 -6.000000e+00 1.152679e-02 285.51 -2.00 20.00 -2.00 320.46 0.00e+00 4.930 0.002 302.00 328.00 3 4.3387e+00 1.9939e-02 6.0285e-02 -6.0000e+00 6.0068e-01 3.3900e-01 2.5593e-02 4.2240e-02 -6.0000e+00 6.5262e-01 -4.7638e-01 2.2735e-02 2.2094e-02 -6.0000e+00 3.8642e-01 1.9606e-01 1.1071e-02 2.1005e-02 -6.0000e+00 1.6547e-01 2.7147e-05 -8.2717e-04 3.0943e-04 1.9693e-04 -6.0000e+00 1.1181e-02 -1.5818e-02 1.0949e-04 12 8 8 10 0 0 -10.79 18.35 1.42 -0.01582 -0.02203 14 4 2 8 0 3378.400 14.99 18.35 24.38 21.27 21.38 24.1 969.60 -208041 900000 -114928 70148 900000 900000 24307 900000 -32855 -54650 900000 -59445 -113970 45833 900000 -35842 900000 65726 114103 -1162 170582 -4113 28553 24802 27611 -68429 9129 -6149 -37168 236148 1832 34853 23506 120950 15772 28313 22013 50388 51189 26833 30434 -1197 18053 -9096 22135 6374 19720 -17918 22534 10035 21802 14906 -7924 -1777 6391 17650 5413 10156 4631 -2875 -9499 18454 -300 7562 2057 7338 1799 3477 5348 -1134 7318 3464 6370 3978 9518 -4383 15867 -5937 3195 -4654 -1912 4553 -4557 -6042 -4819 5079 1258 12 -2434 908 -1514 -417 293 -1310 -3282 -3766 288 -2631 -334 1239 -912 -574 1365 -3192 2506 386 -656 354 -987 -2178 -360 -702 -3203 -1151 -753 1722 -880 1359 565 917 995 581 690 2224 2222 -560 1680 640 1788 -929 2038 538 1368 -916 832 216 -716 608 -28 -355 348 -2114 -1016 -12308 900000 -3567 748 900000 900000 259 900000 -351 -742 900000 -865 -3648 489 900000 -1147 900000 1052 1217 -41 1820 -145 701 635 678 -4380 273 -210 -1705 2519 74 1227 1078 2323 824 1208 1057 2043 2403 1889 2305 -132 1733 -1203 2196 768 2146 -2925 2548 1338 2814 2290 -1649 -373 1296 3220 1126 1994 929 -613 -2240 3623 -81 2154 667 2192 549 1050 1678 -437 2896 1493 2657 1609 3341 -1576 4266 -1964 1057 -1991 -936 2395 -2903 -4100 -3434 3517 953 10 -2007 706 -1123 -283 186 -846 -2381 -3194 248 -2710 -375 1387 -987 -562 1290 -3095 2492 378 -683 392 -1205 -2998 -544 -1135 -5340 -1815 -1116 2356 -1236 1953 874 1494 1627 920 1057 3240 3088 -773 2176 850 2642 -1592 3725 1069 2817 -2026 1779 492 -1682 1437 -67 -823 823 -4843 -2201 SS 20240913T120612.8Z 9022.504315 67 1 45.22 2 77.53 96.95 160.35 317.03 0.00 1 0.00 1 0 21 4.151e-01 1.144e-02 2.948e-01 7.054e-03 5.749270e-01 3.711058e-03 6.560094e-03 -6.000000e+00 2.345503e-01 229.17 -2.00 3.55 -2.00 320.96 0.00e+00 4.064674e-03 1.628403e-03 7.067703e-04 -6.000000e+00 1.091750e-02 285.51 -2.00 20.00 -2.00 320.34 0.00e+00 4.500 0.002 302.00 328.00 3 4.0810e+00 1.2276e-02 5.4146e-02 -6.0000e+00 5.8481e-01 4.0226e-02 1.6153e-02 3.2840e-02 -6.0000e+00 6.3410e-01 -1.2468e-01 1.5485e-02 1.6271e-02 -6.0000e+00 3.7762e-01 4.4915e-02 7.5680e-03 8.0016e-03 -6.0000e+00 1.6187e-01 6.0250e-05 3.3398e-07 1.9548e-04 6.7203e-05 -6.0000e+00 1.0681e-02 -1.6063e-02 5.1183e-05 12 8 8 10 0 0 8.83 18.35 0.92 -0.01606 -0.01606 24 7 4 8 0 1883.970 15.00 18.35 24.74 21.27 21.38 24.1 972.60 -190171 -36273 -115828 124147 -65993 16127 3807 83915 67359 -88895 900000 -52262 -2013 -95130 30147 -57406 326040 -939 30801 -46784 44827 19824 5576 41664 -16960 -49207 -5611 24145 -33555 54571 -44079 3494 -16218 19236 -7171 -4235 -6950 3468 34219 -890 14539 -3180 1935 -11790 8920 -3646 5244 -15807 6096 620 6505 6226 -2178 352 -824 8423 -1067 9164 -1677 536 -1494 4965 2766 4553 1742 998 730 -875 3085 -1624 4586 241 2875 -926 5460 -2535 3537 -2521 2325 -1493 -1867 2473 -3173 -917 -2259 2210 -319 -167 -1552 1639 -1026 519 -91 741 -617 -1934 1045 -353 562 -1066 988 -477 591 -1840 651 -1377 -236 -643 -879 -562 422 121 -1619 45 -53 833 -675 148 -722 810 -651 214 517 318 1087 193 1018 705 1218 -15 633 -13 717 -391 84 49 -437 137 68 539 -175 -987 -554 -4162 -249 -1593 854 -495 111 26 577 463 -1167 900000 -575 -17 -2320 290 -1619 2242 -19 487 -1705 678 382 127 716 -560 -2369 -181 565 -1339 938 -2395 139 -915 847 -395 -216 -397 208 1836 -83 1320 -370 226 -1638 1018 -484 649 -2468 792 89 971 1045 -433 74 -188 1808 -260 2030 -403 124 -360 1223 788 1444 606 338 240 -296 1076 -689 2053 108 1384 -441 2253 -1013 1219 -909 868 -686 -1007 1463 -1996 -594 -1588 1599 -249 -135 -1287 1279 -764 353 -65 523 -441 -1614 975 -385 670 -1299 1113 -496 549 -1742 656 -1501 -267 -782 -1159 -819 676 189 -2577 75 -82 1206 -992 225 -1183 1382 -1132 356 835 496 1606 279 1392 984 1895 -26 1113 -25 1399 -812 187 116 -1057 335 168 1282 -397 -2139 -1150 SS 20240913T121134.8Z 9022.508042 69 1 45.61 2 76.56 97.90 160.96 319.90 0.00 1 0.00 1 0 17 3.357e-01 9.971e-03 2.176e-01 4.978e-03 5.534986e-01 2.597035e-03 6.376992e-03 -6.000000e+00 1.896944e-01 229.17 -2.00 3.55 -2.00 320.74 0.00e+00 3.912415e-04 1.057372e-03 3.611687e-04 -6.000000e+00 8.473806e-03 285.51 -2.00 20.00 -2.00 320.07 0.00e+00 4.197 0.001 302.00 328.00 3 3.7969e+00 8.1889e-03 5.0570e-02 -6.0000e+00 4.7275e-01 1.3550e-02 1.0637e-02 2.9865e-02 -6.0000e+00 5.1243e-01 -8.8565e-02 9.9671e-03 1.5138e-02 -6.0000e+00 3.0562e-01 2.9800e-02 4.9447e-03 4.5759e-03 -6.0000e+00 1.3139e-01 1.0950e-04 -4.1828e-04 1.3995e-04 4.7710e-05 -6.0000e+00 8.5618e-03 -1.5838e-02 4.9806e-05 12 8 8 10 0 0 7.09 18.35 0.70 -0.01584 -0.01898 37 11 2 8 0 1232.530 15.00 18.35 25.11 21.27 21.38 24.1 975.11 -174931 900000 -69229 179283 -84200 122799 -81808 22708 -62519 -30974 73738 -62142 -45913 -64074 -18860 -37278 123516 -20447 38824 -27421 81148 -21061 3479 -2538 -7856 -29156 -20123 3441 -36045 52819 -26205 15653 -4272 26437 -4627 -671 -10854 12658 9208 161 3398 -4259 4875 -3652 5986 -2520 8286 -10037 5055 -237 6493 682 2945 1934 1159 2737 326 5074 -369 2187 -2784 6097 -588 4722 -1733 6227 -1736 -1505 2793 3068 2689 -1662 -646 -1362 4368 687 5509 -5349 -2081 -688 1490 1336 -3750 -3322 -2409 338 -32 650 17 1302 58 1254 298 988 -243 -639 -5 213 34 -117 403 -931 -235 -1668 -105 -1793 -159 -626 11 -435 736 41 -109 -31 -41 427 -278 640 -423 122 -339 485 -68 561 343 269 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