File name: Pandora25s1_HoustonTX_20241214_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20241215T062408.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20241214_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20241214 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20241214T144614.5Z 9114.615446 313 1 3.06 2 73.16 130.38 112.00 321.32 0.00 1 0.00 1 0 25 3.818e-01 1.506e-02 1.464e-01 9.885e-03 4.056237e-01 4.997976e-03 4.545769e-03 -6.000000e+00 2.174654e-01 224.27 -2.00 3.24 -2.00 318.73 0.00e+00 4.794997e-04 1.113047e-03 4.207862e-04 -6.000000e+00 9.797209e-03 286.30 -2.00 20.00 -2.00 317.97 0.00e+00 3.398 0.000 302.00 328.00 3 3.6311e+00 1.3629e-02 3.8870e-02 -6.0000e+00 5.3569e-01 2.9050e-02 1.5727e-02 1.9407e-02 -6.0000e+00 5.8167e-01 -3.1415e-02 1.1188e-02 9.6137e-03 -6.0000e+00 3.4830e-01 1.5349e-02 5.9557e-03 2.7529e-03 -6.0000e+00 1.5053e-01 2.9435e-04 -2.0335e-04 2.8347e-04 3.1192e-05 -6.0000e+00 1.0353e-02 -5.4522e-02 3.4967e-04 12 9 9 12 1 1 999.00 28.53 0.54 -0.05452 -0.05605 1 7 1 5 0 1527.760 30.21 20.00 28.53 26.97 32.7 1066.19 98660 395174 -58262 -15315 -59775 31231 71918 71184 72829 21507 -51261 26775 3544 -9384 -7123 900000 10770 31623 11931 -3349 14404 -14738 3298 6496 7892 -10564 -287 2644 8825 -11524 -882 7438 -12467 -250 -6113 7472 19074 -8073 3704 -5331 -3412 5578 2629 1345 2227 3075 -2588 -3498 5391 -3685 2655 -282 2943 -818 -1784 4255 1865 -2325 2659 -1782 -1738 -3645 75 3355 834 2928 -1286 2232 1927 2211 2113 34 803 -1245 2493 681 -2141 -3060 -1293 380 708 -2385 -904 -1533 -483 -1077 354 68 -279 -149 1523 929 -1264 -1365 -110 1025 -1800 1927 184 393 -1311 -1459 -2179 -2433 609 -192 236 -530 -412 -396 -147 660 1085 874 590 -339 -159 652 165 -1035 -219 383 133 -705 1319 1706 -457 2496 -719 1097 889 866 -187 686 -1011 -881 -757 294 556 -664 167 -1518 546 1253 3809 -3885 -663 -3562 758 1259 1415 1605 828 -3966 1048 199 -703 -616 900000 971 2495 1194 -403 1513 -2020 393 803 1030 -1713 -43 373 1119 -1763 -133 1162 -2575 -49 -1220 1284 3160 -1958 960 -1738 -1208 1934 968 509 841 1160 -1025 -1393 2004 -1507 1090 -128 1381 -418 -955 2230 1017 -1317 1425 -978 -969 -2182 47 2208 575 1925 -836 1398 1265 1593 1649 28 662 -1016 1885 484 -1447 -2017 -872 278 573 -2146 -855 -1514 -495 -1163 394 78 -321 -168 1633 947 -1245 -1318 -110 1093 -2121 2393 244 526 -1719 -1811 -2581 -2876 738 -244 309 -723 -583 -589 -229 1054 1723 1351 874 -486 -225 937 247 -1622 -346 601 205 -1073 1928 2421 -639 3404 -1043 1669 1418 1424 -315 1178 -1815 -1637 -1431 560 1065 -1269 309 -2770 963 SS 20241214T145120.4Z 9114.618986 316 1 48.34 2 72.32 131.24 112.65 322.26 0.00 1 0.00 1 0 25 5.547e-01 5.582e-02 1.869e-01 9.164e-03 3.935436e-01 4.766205e-03 4.438504e-03 -6.000000e+00 3.223375e-01 224.27 -2.00 3.24 -2.00 319.26 0.00e+00 -2.570665e-03 1.172317e-03 3.848735e-04 -6.000000e+00 1.503715e-02 286.30 -2.00 20.00 -2.00 318.50 0.00e+00 3.247 0.000 302.00 328.00 3 6.0943e+00 1.3287e-02 3.7246e-02 -6.0000e+00 7.9881e-01 1.2450e-01 1.5586e-02 1.8737e-02 -6.0000e+00 8.7029e-01 -1.3685e-01 1.1220e-02 9.6280e-03 -6.0000e+00 5.1382e-01 7.9933e-02 5.8449e-03 3.5004e-03 -6.0000e+00 2.2356e-01 2.8376e-05 1.7506e-04 2.7831e-04 3.8611e-05 -6.0000e+00 1.5830e-02 -5.0737e-02 7.4538e-04 12 9 8 11 40 0 99.97 28.54 2.57 -0.05074 -0.04942 19 4 1 5 0 2543.660 30.21 20.00 28.54 27.32 32.7 1068.36 900000 900000 -64863 255849 -73383 -34777 900000 316157 900000 900000 -47681 220971 -54485 214398 48908 37160 87426 900000 46691 -8596 2660 -2844 2672 91740 -22100 51463 -30492 14954 130951 -17332 68964 36441 24684 -422 8369 47 240661 900000 13847 -10324 -11259 24156 -417 6082 41804 49595 -9246 -13502 47145 -944 14616 -8230 12797 6389 -6766 448 18284 2811 13971 -17361 373 4478 -4774 -7857 -9174 3096 282 16182 9051 5254 3515 -498 -2638 -9631 12373 23113 -16684 5879 -3694 4848 5188 -5160 -5769 7880 -3707 -7056 6268 -22 -290 -1093 -583 3878 5176 -5365 -531 6514 -3321 582 -3699 928 6287 -3570 -5336 -14262 8906 27 -821 1296 8974 841 -3185 734 4023 816 -1600 234 116 -4250 -3503 -6744 4143 3966 3236 990 -3248 4315 -2333 3406 -2276 1369 -101 -1674 2997 11267 -1649 -3095 338 1965 2599 -4050 3205 -9464 4755 900000 900000 -5510 2283 -5820 -1815 900000 2822 900000 900000 -4101 1972 -5708 2045 2594 2458 3868 900000 3302 -1053 299 -335 305 4896 -3664 4528 -5830 1785 4930 -2543 4807 3791 3147 -72 1266 7 4209 900000 2799 -3090 -3796 6199 -139 1926 9438 10374 -3322 -4987 9865 -314 4446 -3357 4595 2588 -3243 207 7359 1314 5763 -9364 173 2113 -2676 -4910 -6004 1736 153 7448 4667 3146 2363 -366 -1992 -7518 7437 11448 -10848 2966 -2104 2852 3449 -4194 -5099 6481 -3575 -7471 6204 -23 -318 -1179 -591 3514 4334 -4783 -474 6009 -3713 695 -4947 1209 7495 -4305 -6096 -17471 9465 33 -1051 1704 11615 1247 -5213 1208 6413 1284 -2419 329 160 -6234 -5362 -11199 6430 6116 4900 1485 -4853 5813 -3192 4381 -3239 2040 -163 -2834 5001 18079 -3083 -6139 668 3898 5173 -8380 6032 -18994 8219 SS 20241214T153606.6Z 9114.650076 345 1 50.01 2 65.49 139.47 117.67 331.15 0.00 1 0.00 1 0 17 8.438e-03 4.998e-03 5.472e-04 1.983e-04 2.895677e-01 9.987263e-05 3.283786e-03 -6.000000e+00 4.790222e-03 224.27 -2.00 3.24 -2.00 316.94 0.00e+00 2.054505e-04 1.347023e-05 5.291363e-05 -6.000000e+00 2.164618e-04 286.29 -2.00 20.00 -2.00 316.18 0.00e+00 2.394 0.000 302.00 328.00 3 6.0698e-01 2.6037e-04 2.7426e-02 -6.0000e+00 1.1794e-02 -1.2638e-02 2.9239e-04 1.3699e-02 -6.0000e+00 1.2803e-02 2.3125e-03 1.7393e-04 6.7688e-03 -6.0000e+00 7.6647e-03 -2.2463e-03 8.5967e-05 1.9342e-03 -6.0000e+00 3.3162e-03 1.9018e-02 -5.5643e-04 5.6635e-06 2.3018e-05 -6.0000e+00 2.2889e-04 -5.1183e-02 2.0018e-04 10 0 0 10 0 0 99.96 28.57 0.27 -0.05118 -0.05536 1454 308 1 5 0 34.040 30.21 20.00 28.57 28.91 32.8 1076.09 -2377 -1533 -1604 -1837 -3330 -3101 -2436 -1072 -282 -335 -1580 -1920 -1488 -1030 -153 -259 211 516 649 752 885 344 637 382 180 362 328 123 200 288 829 1141 1196 346 -1421 -1611 -1817 -937 -563 -717 -762 -584 -491 -519 -203 -150 -395 -297 -386 -148 368 690 792 915 691 754 780 652 540 523 687 872 1075 1257 767 6 -196 -370 150 455 64 138 -10 113 219 -4 -237 -454 -363 -471 -754 -913 -1507 -1596 -1138 -784 -450 -128 50 243 337 429 354 518 679 418 502 543 239 -178 -276 -641 -521 -161 -412 -819 -600 -527 -299 260 166 238 145 103 -36 228 250 208 92 38 -412 -208 -63 152 298 576 396 931 855 636 447 160 55 72 61 -6 -278 23 -135 -295 -302 -327 -469 -303 -199 -215 -254 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