File name: Pandora206s1_BuffaloNY_20241124_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20241204T202429.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20241124_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20241124 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]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- 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 20241124T152652.8Z 9094.643667 325 1 24.01 2 67.39 155.88 55.94 239.87 0.00 1 0.00 1 0 17 2.078e-01 1.789e-02 1.809e-01 1.226e-02 3.871196e-01 6.038857e-03 4.754040e-03 -6.000000e+00 1.144236e-01 222.59 -2.00 3.55 -2.00 319.12 0.00e+00 3.459257e-04 1.440816e-03 1.166828e-03 -6.000000e+00 5.013341e-03 276.62 -2.00 20.00 -2.00 318.52 0.00e+00 2.580 0.000 302.00 328.00 3 6.1897e+00 1.6579e-02 3.2380e-02 -6.0000e+00 2.8175e-01 8.5071e-02 1.9248e-02 2.1085e-02 -6.0000e+00 3.0739e-01 -1.1809e-02 1.4831e-02 1.0194e-02 -6.0000e+00 1.8317e-01 4.9583e-04 7.9448e-03 3.0100e-03 -6.0000e+00 7.8719e-02 5.1401e-05 -4.1791e-04 3.4359e-04 3.1593e-05 -6.0000e+00 5.2850e-03 -6.3020e-03 0.0000e+00 12 8 8 10 0 0 99.95 17.92 0.93 -0.00630 -0.00944 6 6 2 8 0 4000.000 15.00 17.92 12.25 21.48 21.27 23.5 932.01 -33508 152623 50926 19193 12244 31325 16457 36084 50584 51388 108140 59340 14293 -10119 12224 16127 45192 2868 30085 -1661 20928 -6112 26670 4799 3892 -17100 14432 -25892 7366 10787 -30258 9203 1692 1121 -11728 -201 -1943 1769 14358 -259 7641 -4630 3515 -1143 2810 -2853 1089 -13902 977 -1652 -1559 -1069 -3701 1908 4738 2432 -135 311 -2087 -3347 4207 4312 1877 -1625 -1945 807 -2424 -1657 1570 -1797 3548 755 3285 195 3220 -284 1079 755 -3745 -2003 182 591 -4379 633 -1641 3280 1114 -134 -1531 2977 -2096 624 806 -1345 -807 -2285 1012 333 246 915 2675 269 412 -203 1232 -1459 -628 497 -244 328 870 639 -4441 1262 803 -2456 -639 -93 -1502 -1233 466 -472 603 343 885 -551 1019 354 1392 -1040 2159 465 831 -1079 896 -295 -432 492 1339 529 -333 -1208 -1347 -1305 1825 1076 543 327 649 420 848 1210 1290 1605 1468 621 -648 765 1088 2539 252 2206 -169 1810 -662 2189 513 447 -2552 1668 -4134 807 1131 -5088 1199 265 191 -2076 -31 -331 336 2907 -71 2169 -1568 1143 -397 933 -1010 369 -5410 328 -576 -581 -434 -1646 859 2176 1170 -68 157 -1050 -1672 1983 2182 1074 -1058 -1273 497 -1447 -964 928 -1260 2544 585 2487 146 2242 -183 619 428 -2249 -1357 138 500 -4100 588 -1664 3402 1242 -152 -1771 3285 -2247 597 735 -1211 -770 -2403 1158 419 337 1233 3326 324 452 -225 1471 -1892 -817 675 -353 510 1412 1076 -7702 2008 1184 -3488 -883 -133 -2316 -2017 762 -760 936 513 1284 -776 1340 467 1981 -1603 3445 789 1436 -1912 1660 -584 -873 1006 2743 1056 -638 -2234 -2480 SS 20241124T154951.1Z 9094.659619 336 1 26.91 2 65.86 161.49 59.67 244.84 0.00 1 0.00 1 0 17 1.496e-01 1.228e-02 8.659e-02 8.165e-03 3.500095e-01 3.992470e-03 4.273087e-03 -6.000000e+00 8.238049e-02 222.59 -2.00 3.55 -2.00 318.77 0.00e+00 1.416739e-03 8.667032e-04 3.459381e-04 -6.000000e+00 3.609773e-03 276.61 -2.00 20.00 -2.00 318.17 0.00e+00 2.429 0.000 302.00 328.00 3 5.9457e+00 1.0829e-02 2.9768e-02 -6.0000e+00 2.0285e-01 4.2921e-02 1.2451e-02 1.8321e-02 -6.0000e+00 2.2134e-01 1.3191e-02 9.0075e-03 9.0651e-03 -6.0000e+00 1.3189e-01 -1.3098e-02 4.8145e-03 3.0466e-03 -6.0000e+00 5.6655e-02 8.1280e-05 1.0676e-04 2.2825e-04 2.9713e-05 -6.0000e+00 3.8063e-03 -3.6994e-03 0.0000e+00 12 8 8 10 0 0 99.99 17.94 0.65 -0.00370 -0.00290 7 7 2 8 0 3843.500 14.99 17.94 12.91 21.48 21.38 23.5 935.74 -28422 49542 -3216 47679 -13740 36418 -4570 41803 -59 16743 132328 36701 -6918 12337 1050 -1031 17243 -9310 7001 -9493 14705 -11109 21768 -3120 6324 -16568 2942 208 -2011 190 -854 3326 1567 285 -9680 9104 -8730 877 -1438 -395 2470 -2794 -1505 496 -517 2213 -3697 -9141 4295 -2272 3588 214 3514 -1225 4539 415 1570 -910 1668 -2114 1108 2102 599 2415 -1742 2005 -2919 1867 609 818 1608 783 1488 946 1555 -1861 1393 -2575 -493 -6415 1283 -385 -1126 -2100 -704 497 676 -661 -363 1298 -700 1728 -628 862 -972 128 453 -1472 482 765 618 -407 -845 -725 1042 -1253 -452 45 765 -347 1000 2 1102 -921 -361 126 -511 -338 -748 -362 -270 -266 -836 469 16 722 -510 1170 967 209 1427 656 343 197 -326 -1099 585 -34 612 -870 385 -1087 182 -1365 1282 -145 1293 -587 915 -183 1175 -3 742 1967 1361 -446 804 88 -101 1510 -1123 759 -1267 1586 -1531 2264 -433 844 -2914 436 30 -286 26 -131 540 279 55 -1939 1482 -1797 189 -383 -125 847 -1062 -571 194 -204 856 -1508 -3884 1590 -906 1440 97 1636 -619 2263 220 843 -501 871 -1129 604 1188 378 1638 -1264 1304 -1867 1114 387 594 1249 643 1215 745 1166 -1292 871 -1593 -313 -4802 1011 -336 -1069 -2097 -721 540 773 -770 -437 1485 -754 1712 -586 788 -936 137 525 -1902 659 1031 804 -491 -966 -839 1263 -1640 -596 62 1111 -534 1633 4 1800 -1442 -531 172 -718 -479 -1139 -570 -432 -416 -1320 703 23 1003 -680 1534 1381 317 2279 1069 574 342 -589 -2116 1132 -67 1193 -1706 714 -2012 323 SS 20241124T155451.7Z 9094.663098 338 1 45.94 2 65.58 162.73 60.50 245.88 0.00 1 0.00 1 0 17 1.531e-02 4.804e-03 1.349e-02 1.818e-03 3.458152e-01 8.890486e-04 4.222243e-03 -6.000000e+00 8.428633e-03 222.59 -2.00 3.55 -2.00 318.72 0.00e+00 9.238945e-04 1.895485e-04 1.197961e-04 -6.000000e+00 3.693898e-04 276.61 -2.00 20.00 -2.00 318.10 0.00e+00 2.403 0.000 302.00 328.00 3 3.6472e+00 2.4093e-03 2.9374e-02 -6.0000e+00 2.0753e-02 9.3049e-03 2.7629e-03 1.7807e-02 -6.0000e+00 2.2649e-02 1.4983e-03 1.9687e-03 8.9776e-03 -6.0000e+00 1.3496e-02 -6.2932e-03 1.0475e-03 2.7623e-03 -6.0000e+00 5.7943e-03 8.5657e-04 -2.5255e-04 5.1050e-05 2.9326e-05 -6.0000e+00 3.8959e-04 -6.3668e-04 0.0000e+00 10 0 0 10 0 0 99.99 17.95 0.28 -0.00064 -0.00253 115 36 1 8 0 399.430 15.00 17.95 12.93 21.48 21.38 23.6 936.35 451 -4368 3476 -4111 -4065 -10378 -2157 -4686 -2805 -143 -1134 -1751 -5319 -1445 -2578 690 -514 -350 -1950 735 152 -784 500 1324 402 -792 -1469 -770 -1007 -1451 754 350 1465 -660 -1714 -2673 -2455 -650 -576 259 -276 -604 -1020 -1079 -581 -295 -896 -453 -805 -77 717 558 651 820 867 1000 801 302 645 5 834 860 1472 1639 694 -132 47 -50 482 57 652 297 429 628 73 -149 -186 -600 -200 -541 -656 -539 -1929 -1583 -1039 -575 -229 -84 336 617 241 413 296 243 603 18 448 908 237 -121 17 -599 -737 -297 -750 -738 -707 -579 -377 271 266 185 250 218 -135 100 169 344 -42 -164 -441 -176 78 125 606 388 373 1036 769 322 310 -30 -387 -113 -71 -51 -108 176 -54 -115 -77 -268 -227 17 -196 153 -189 -164 -420 -85 -212 -141 -8 -61 -97 -351 -109 -230 68 -55 -39 -236 91 19 -100 64 180 58 -122 -234 -116 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