File name: Pandora206s1_BuffaloNY_20230707_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T054748.9Z 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_20230707_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: 20230707 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 20230707T140520.6Z 8588.587044 234 1 28.01 2 44.97 101.02 85.61 250.44 0.00 1 0.00 1 0 17 2.756e-02 1.494e-02 2.421e-02 8.683e-03 2.147524e-01 4.380116e-03 2.510766e-03 -6.000000e+00 1.575201e-02 232.95 -2.00 3.55 -2.00 317.02 0.00e+00 2.612954e-04 5.813315e-04 6.883192e-05 -6.000000e+00 6.928606e-04 286.55 -2.00 20.00 -2.00 316.20 0.00e+00 1.411 0.000 302.00 328.00 3 7.7078e+00 1.1646e-02 1.7966e-02 -6.0000e+00 3.9603e-02 4.1206e-02 1.3058e-02 1.1212e-02 -6.0000e+00 4.2840e-02 3.0412e-02 7.7001e-03 5.4168e-03 -6.0000e+00 2.5467e-02 -2.1005e-02 3.7037e-03 1.4847e-03 -6.0000e+00 1.0776e-02 4.5207e-05 1.5160e-04 2.4060e-04 1.5151e-05 -6.0000e+00 7.0303e-04 -2.4063e-02 1.8985e-04 12 8 8 10 0 0 29.07 18.81 1.85 -0.02406 -0.02292 7 7 2 8 0 4000.000 14.99 18.81 29.97 22.19 22.19 18.2 1045.89 -10596 10067 2418 2058 4235 7821 5805 2746 -6496 -798 -2499 -795 -1795 861 -8787 -2048 6863 4782 848 2204 6796 -963 -632 2453 -1167 -744 -2137 -415 183 263 -289 -4351 1602 985 -389 -7777 -3024 -365 2093 212 736 -1378 -73 -1752 -1613 7397 -3273 -7200 -653 -2595 1279 -193 -225 3050 4132 2258 34 883 1583 -1534 -642 1917 1713 2319 217 22 -1710 -1948 -199 -190 969 77 2260 421 1384 516 872 -2367 -2245 -3494 -2630 585 -2345 -926 -241 -88 960 905 686 2387 -344 -674 -803 -1392 -744 -1331 96 951 2373 444 1245 -2282 -1683 -2264 -491 -1657 350 684 298 121 876 1437 -1467 -551 225 -1852 -2601 -754 -745 1514 106 895 1237 1207 1572 -787 -1733 -1128 1835 286 1361 -1212 399 42 -262 153 318 1369 813 446 158 -1658 -1862 -1548 1314 351 283 494 829 663 360 -1049 -130 -403 -125 -317 168 -2136 -515 1627 1190 228 604 1823 -274 -182 726 -374 -247 -725 -134 53 75 -87 -1438 539 348 -128 -2636 -1071 -145 942 115 434 -861 -47 -1144 -1043 4368 -2101 -4639 -383 -1530 762 -125 -152 2111 2915 1642 26 662 1153 -1141 -486 1516 1423 2043 194 18 -1343 -1473 -155 -168 906 76 2186 401 1257 423 659 -1724 -1680 -2884 -2407 572 -2438 -985 -274 -104 1182 1153 883 2906 -408 -730 -814 -1346 -749 -1484 113 1233 3125 582 1565 -2744 -1940 -2632 -617 -2216 478 945 430 185 1361 2238 -2318 -798 303 -2375 -3343 -992 -1056 2187 160 1317 1832 1707 2087 -1053 -2206 -1420 2395 390 1925 -1802 590 65 -415 254 541 2362 1424 762 262 -2703 -3055 SS 20230707T141811.0Z 8588.595960 239 1 28.92 2 42.67 103.73 87.72 252.65 0.00 1 0.00 1 0 17 1.166e-02 7.102e-03 6.467e-03 3.336e-03 1.953607e-01 1.693696e-03 2.352915e-03 -6.000000e+00 6.666224e-03 232.95 -2.00 3.55 -2.00 316.04 0.00e+00 2.582907e-04 1.794312e-04 5.725466e-05 -6.000000e+00 2.932007e-04 286.55 -2.00 20.00 -2.00 315.29 0.00e+00 1.358 0.000 302.00 328.00 3 6.4074e+00 4.4417e-03 1.6960e-02 -6.0000e+00 1.6760e-02 3.0388e-02 4.9464e-03 1.0309e-02 -6.0000e+00 1.8129e-02 5.9027e-03 2.8414e-03 4.9858e-03 -6.0000e+00 1.0777e-02 -6.8508e-03 1.3050e-03 1.3614e-03 -6.0000e+00 4.5608e-03 1.8411e-04 -7.2186e-05 9.0703e-05 1.5047e-05 -6.0000e+00 2.9750e-04 -2.4865e-02 1.7795e-04 12 9 1 12 1 1 99.99 18.81 0.64 -0.02486 -0.02541 7 8 1 8 0 3613.630 15.00 18.81 31.02 22.09 22.19 18.3 1053.38 6433 274 -465 -3258 -1029 -4498 -1034 167 1280 -12 -1199 -2080 -1877 -1297 -2474 749 1167 1310 -369 1544 2442 81 709 1798 18 260 360 -93 652 -1121 814 -141 2397 915 -1137 -2451 -1459 -2080 200 -229 -615 -942 -427 -688 -367 147 -669 -1394 -740 -848 402 1016 -606 -1564 580 1306 1111 722 706 -166 661 1232 1089 1765 981 -243 -39 -1092 -127 98 928 923 722 1039 271 -69 -594 -1104 -131 -755 -1515 -353 -2211 -1077 -698 -549 -16 438 590 181 724 142 144 -466 11 -564 691 792 460 137 124 -1220 -1095 -515 -631 -1150 -712 -82 -450 462 679 590 -286 -125 -277 -367 -737 -83 16 653 -95 806 242 229 603 31 207 279 668 221 568 -87 -269 -257 197 147 62 690 199 133 -269 -829 -1011 1241 61 -108 -731 -202 -857 -200 35 300 -3 -297 -513 -489 -378 -820 264 421 482 -137 582 932 31 273 723 8 114 159 -39 254 -428 319 -59 1045 407 -491 -1021 -658 -1043 113 -149 -437 -672 -312 -508 -267 106 -492 -995 -508 -572 280 751 -461 -1263 472 1065 925 602 576 -135 549 1052 1006 1671 931 -218 -33 -894 -107 91 914 951 749 1038 264 -63 -499 -867 -104 -656 -1434 -353 -2398 -1161 -805 -661 -20 554 751 230 866 160 152 -467 11 -627 813 1002 603 176 154 -1464 -1268 -594 -779 -1504 -939 -112 -626 674 1010 885 -414 -177 -366 -465 -932 -105 22 930 -136 1134 346 313 794 40 253 339 860 294 788 -121 -377 -371 294 225 97 1103 323 210 -414 -1275 -1519 SS 20230707T143114.7Z 8588.605031 241 1 4.01 2 40.37 106.67 89.90 254.87 0.00 1 0.00 1 0 17 8.257e-03 5.895e-03 2.397e-03 1.401e-03 1.789633e-01 7.134277e-04 2.166543e-03 -6.000000e+00 4.718611e-03 232.95 -2.00 3.55 -2.00 315.63 0.00e+00 3.240111e-04 6.942539e-05 2.434593e-05 -6.000000e+00 2.075863e-04 286.55 -2.00 20.00 -2.00 314.91 0.00e+00 1.311 0.000 302.00 328.00 3 2.9943e+00 1.8635e-03 1.6048e-02 -6.0000e+00 1.1863e-02 -1.0407e-02 2.0701e-03 9.4713e-03 -6.0000e+00 1.2834e-02 4.0018e-03 1.1833e-03 4.5764e-03 -6.0000e+00 7.6289e-03 -3.2350e-03 5.3206e-04 1.2609e-03 -6.0000e+00 3.2279e-03 6.1552e-03 -3.3477e-05 3.8018e-05 1.4768e-05 -6.0000e+00 2.1064e-04 -2.4645e-02 1.3030e-04 12 1 1 12 1 1 -23.80 18.81 0.37 -0.02465 -0.02490 23 87 1 8 0 160.170 14.99 18.81 32.66 22.09 22.19 18.4 1064.96 -910 -937 -171 -1909 -3519 -1935 -562 -482 1528 238 -1149 -1223 -1170 -411 192 877 -200 488 175 1832 626 772 901 878 -177 588 265 496 -456 865 1575 807 1753 315 -1726 -1855 -1878 -1244 -135 -374 -769 -938 -694 -745 -390 -401 -620 -278 -837 -271 646 676 650 912 779 1032 695 577 603 492 1251 1072 1308 1494 234 -347 -479 -795 350 344 435 129 418 501 -13 65 -193 -681 -396 -417 -1001 -927 -1912 -1526 -1097 -947 -358 -130 454 246 274 181 186 -23 481 231 556 694 184 -196 -90 -668 -584 20 -575 -714 -604 -781 -255 -23 354 180 171 362 -179 246 99 317 256 223 -234 179 307 168 768 424 628 805 722 324 287 -38 -139 -9 63 -25 -148 189 -98 -470 -244 -408 -593 -230 -257 -48 -507 -818 -456 -137 -118 411 69 -326 -341 -358 -140 73 362 -85 210 72 759 268 324 381 392 -83 283 129 224 -206 371 699 378 800 152 -846 -869 -883 -667 -86 -259 -582 -736 -519 -562 -290 -321 -484 -208 -608 -192 474 528 531 726 637 850 586 485 497 403 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