File name: Pandora206s1_BuffaloNY_20240912_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20241204T195740.7Z 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_20240912_L1_smca1c6d20240814p1-8.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: 20240912 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 20240912T115836.3Z 9021.499031 61 1 45.64 2 78.72 95.27 165.66 349.70 0.00 1 0.00 1 0 17 3.960e-01 9.417e-03 2.796e-01 5.905e-03 6.646363e-01 3.148402e-03 7.527252e-03 -6.000000e+00 2.246370e-01 229.26 -2.00 3.55 -2.00 321.27 0.00e+00 1.713813e-03 1.522184e-03 6.869172e-04 -6.000000e+00 1.007211e-02 285.59 -2.00 20.00 -2.00 320.67 0.00e+00 4.934 0.002 302.00 328.00 3 2.8906e+00 1.0822e-02 6.0272e-02 -6.0000e+00 5.6141e-01 1.0483e-01 1.5071e-02 3.7105e-02 -6.0000e+00 6.0937e-01 -1.8272e-01 1.5145e-02 1.8999e-02 -6.0000e+00 3.6144e-01 6.8794e-02 7.2114e-03 6.5942e-03 -6.0000e+00 1.5399e-01 1.1795e-04 -1.0093e-03 1.6101e-04 6.3352e-05 -6.0000e+00 1.0174e-02 -7.0393e-03 0.0000e+00 12 8 8 10 0 0 -35.73 18.30 0.69 -0.00704 -0.01462 37 11 4 8 0 1233.330 15.00 18.30 23.54 21.17 21.38 24.0 965.59 -211225 -89520 -153381 -147968 -78740 -163258 -155859 -4809 900000 -13828 -34693 -37053 -139677 -7004 -74932 15333 42804 -56379 -30559 -30376 900000 -8532 -15278 -19559 -13801 -66978 -28590 -44657 -33800 -37418 -440 -18736 80479 22725 17451 -813 -5268 -46 24542 9624 4791 -12729 937 -1985 469 3331 730 -12428 3304 4832 2705 8392 7813 2214 2903 3668 2884 4133 3047 -3496 -789 411 99 2612 1511 1242 2345 2280 4218 -297 3532 3268 2020 1854 1800 28 1804 -2391 -698 -834 -2190 224 -2876 -2151 -1484 1076 726 559 781 661 1145 -178 1069 -451 153 -1506 191 146 -397 -482 168 -420 -838 -1851 433 -1316 -1847 -386 -798 -85 -41 307 -909 -366 118 480 732 76 9 112 236 -598 577 558 1821 -809 877 478 763 194 911 -133 173 -615 22 151 -543 442 119 -46 -101 -560 -290 -3095 -515 -1685 -1549 -453 -1709 -1631 -28 900000 -80 -200 -213 -2558 -48 -1294 132 320 -1266 -580 -612 900000 -142 -281 -417 -302 -2660 -806 -1439 -934 -1120 -11 -669 1251 706 552 -29 -218 -2 1088 609 367 -1253 85 -192 45 314 72 -1445 344 526 335 1111 1142 376 526 688 568 809 584 -696 -155 87 24 705 445 358 656 655 1284 -100 1292 1265 793 692 679 9 557 -765 -241 -345 -985 113 -1673 -1314 -963 731 521 415 585 481 770 -113 640 -277 104 -1208 175 154 -470 -577 189 -431 -772 -1696 421 -1381 -2047 -453 -1023 -122 -61 481 -1455 -565 172 719 1093 120 14 180 378 -928 933 872 2688 -1185 1212 677 1221 324 1666 -265 359 -1361 53 378 -1292 1059 289 -115 -240 -1257 -621 SS 20240912T120458.9Z 9021.503460 64 1 45.47 2 77.56 96.39 165.81 355.04 0.00 1 0.00 1 0 17 3.347e-01 6.562e-03 2.030e-01 3.876e-03 6.156988e-01 2.043929e-03 7.063633e-03 -6.000000e+00 1.890814e-01 229.26 -2.00 3.55 -2.00 320.96 0.00e+00 6.453514e-05 9.060170e-04 4.553528e-04 -6.000000e+00 8.386320e-03 285.59 -2.00 20.00 -2.00 320.34 0.00e+00 4.509 0.002 302.00 328.00 3 2.6390e+00 6.7109e-03 5.5160e-02 -6.0000e+00 4.7130e-01 2.4535e-02 9.0139e-03 3.3563e-02 -6.0000e+00 5.1093e-01 -8.1136e-02 8.8783e-03 1.7230e-02 -6.0000e+00 3.0450e-01 2.6474e-02 4.3226e-03 5.0833e-03 -6.0000e+00 1.3010e-01 2.4090e-04 -8.9038e-04 1.0609e-04 5.6420e-05 -6.0000e+00 8.5287e-03 -6.5722e-03 0.0000e+00 11 8 0 10 0 0 -23.41 18.30 0.50 -0.00657 -0.01326 58 18 4 8 0 783.890 14.99 18.30 23.98 21.17 21.38 24.0 968.33 -188139 -52606 214029 -84964 -100119 -7508 -61828 -54480 -115008 -97079 -16719 -71429 -63515 -53985 -39305 -26490 36279 -20897 -7914 -5598 -3322 -5313 14834 3940 -13314 -32524 -29136 -24439 -33993 -2244 -18455 1737 -12900 14579 -5093 -2048 -6865 837 6410 5692 2054 6 823 -2346 3014 4395 -245 -4221 185 1775 3796 3781 268 -88 401 4894 1681 3692 611 -1124 -2103 -656 -193 3093 -416 898 -642 1836 4151 490 2249 1218 1443 800 1076 -2358 417 -2703 -513 -964 -2209 -221 -1013 -1770 -863 -30 -593 519 637 -33 562 350 654 609 439 -623 354 424 551 -150 -11 -1086 -186 -797 -582 -1258 -718 -814 -341 -285 456 557 -251 405 -183 492 -357 -38 340 50 -341 133 357 626 877 -255 193 606 439 -2 289 -204 76 -296 -226 -112 -258 567 -184 -157 38 -285 66 -2715 -258 809 -642 -795 -28 -351 -329 -1478 -1174 -95 -756 -768 -755 -594 -431 357 -403 -147 -108 -65 -106 252 83 -367 -1168 -1057 -822 -1195 -59 -677 62 -619 595 -244 -91 -353 47 419 463 200 1 92 -280 343 503 -30 -549 24 239 555 625 50 -18 89 1079 399 867 144 -262 -503 -168 -56 983 -134 303 -215 611 1456 189 958 554 657 349 432 -961 151 -1000 -203 -453 -1121 -127 -648 -1206 -624 -23 -484 434 536 -27 427 248 439 410 327 -542 351 484 638 -176 -14 -1204 -184 -784 -622 -1434 -855 -1038 -430 -400 707 920 -420 650 -279 702 -514 -58 539 84 -574 215 558 941 1256 -357 281 893 668 -4 544 -413 159 -609 -499 -262 -619 1375 -453 -371 85 -601 143 SS 20240912T121014.7Z 9021.507114 66 1 45.94 2 76.60 97.31 165.85 359.50 0.00 1 0.00 1 0 17 2.726e-01 6.262e-03 9.484e-02 2.790e-03 5.799123e-01 1.466820e-03 6.735549e-03 -6.000000e+00 1.540357e-01 229.26 -2.00 3.55 -2.00 320.75 0.00e+00 1.336280e-03 6.059009e-04 3.896934e-04 -6.000000e+00 6.831873e-03 285.59 -2.00 20.00 -2.00 320.11 0.00e+00 4.210 0.001 302.00 328.00 3 2.3908e+00 4.6992e-03 5.1650e-02 -6.0000e+00 3.8395e-01 1.0742e-02 6.1048e-03 3.1410e-02 -6.0000e+00 4.1622e-01 -5.3384e-02 5.7968e-03 1.5995e-02 -6.0000e+00 2.4806e-01 1.3390e-02 2.8692e-03 5.0344e-03 -6.0000e+00 1.0599e-01 4.2104e-04 -6.9327e-04 7.6942e-05 5.4696e-05 -6.0000e+00 6.9475e-03 -6.9762e-03 0.0000e+00 10 0 0 10 0 0 -0.14 18.30 0.51 -0.00698 -0.01219 88 27 4 8 0 522.020 14.99 18.30 24.36 21.17 21.38 24.0 970.88 -132260 -104896 -60284 -99230 -47070 -120594 -85442 -66589 -74161 -78782 -20983 -69765 -88662 -38287 -35440 -17205 -17397 -2266 -22600 -10101 -5934 -7215 -8037 -1010 -10735 -22202 -13745 -14372 -10073 -6752 5193 -11118 581 -1685 -611 -9388 -5660 3210 6606 -4688 196 452 -2127 1662 1356 3936 -2906 -507 -3185 2641 866 3115 796 738 1388 3311 3711 1281 728 -1373 1485 1575 2316 2539 2564 1838 1130 -588 693 286 1457 936 793 1103 147 -24 -742 -811 -1723 -817 -1427 -374 -2115 -1665 -1459 -288 148 -208 512 176 1001 108 1125 -478 977 -225 435 488 265 -163 100 -478 -1209 -285 -1055 -1169 -1001 -584 -631 408 255 356 -82 236 16 309 256 43 39 -90 -184 -96 361 -1 797 110 549 609 657 326 413 -135 -261 -192 -134 -60 -340 354 -153 -29 128 -261 -189 -1619 -1170 -476 -1161 -295 -1509 -814 -598 -827 -1029 -160 -930 -1761 -583 -656 -323 -369 -46 -609 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