File name: Pandora25s1_HoustonTX_20221011_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T160715.2Z 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 v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20221011_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: 20221011 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 20221011T130854.7Z 8319.547856 248 1 49.46 2 80.54 103.90 80.15 280.08 0.00 1 0.00 1 0 25 4.382e-01 2.256e-02 1.721e-01 2.861e-03 6.289533e-01 1.533772e-03 7.376093e-03 -6.000000e+00 2.526733e-01 227.17 -2.00 3.24 -2.00 321.13 0.00e+00 1.334702e-02 7.632463e-04 3.333715e-03 -6.000000e+00 1.204028e-02 291.63 -2.00 20.00 -2.00 320.46 0.00e+00 5.790 0.002 302.00 328.00 3 1.6970e+00 5.4057e-03 6.5293e-02 -6.0000e+00 6.2684e-01 1.9229e-01 7.1312e-03 3.1114e-02 -6.0000e+00 6.8129e-01 -3.4635e-01 6.3708e-03 2.1524e-02 -6.0000e+00 4.0481e-01 1.5076e-01 3.0759e-03 1.2597e-02 -6.0000e+00 1.7391e-01 1.6500e-04 -1.3468e-03 8.0953e-05 1.7805e-04 -6.0000e+00 1.2322e-02 -4.8910e-03 4.9475e-05 12 8 8 10 0 0 99.11 24.87 0.45 -0.00489 -0.01501 107 23 1 5 0 462.120 27.35 19.99 24.87 29.21 27.0 973.21 -281249 900000 -51740 900000 -64800 60230 900000 -65882 900000 -5722 -51338 30935 1449 7385 60370 21780 148649 216447 120718 84890 53813 77291 26163 84773 33340 33576 -19220 20448 17629 5725 98001 48171 38457 20137 24082 64860 40750 104643 20080 13876 18738 25722 39813 21512 32540 28729 19806 8386 31119 15694 25960 20970 14177 17290 11504 10817 5971 -1822 3495 4969 7416 3244 4718 8551 6118 6328 6286 3749 5120 3416 4406 1823 1667 -830 3896 1184 -6770 -2579 -1704 761 -1193 -1418 -2943 288 -3084 -3145 -1924 -1902 -1745 771 -633 -219 -1428 -1906 -3230 -1471 -759 -318 -238 -984 -105 -1550 -1050 -2239 -488 -1483 -1344 -1157 -60 -178 -243 351 273 -55 137 596 0 87 -456 193 236 1430 1570 918 1218 1538 754 1598 884 887 1123 631 259 650 -285 -368 -366 -64 -551 -556 -77 -730 -956 -20113 900000 -510 900000 -614 168 900000 -661 900000 -36 -532 166 14 88 541 320 740 604 938 981 847 939 501 996 626 643 -625 441 403 168 1503 1361 1373 895 971 1736 1530 2431 1218 1037 1466 2004 2852 1919 2682 2553 1988 984 3048 1925 3194 3008 2225 2822 2068 2003 1173 -381 678 954 1476 756 1243 2431 1853 1863 1830 1158 1734 1274 1775 779 698 -335 1364 407 -2381 -899 -635 330 -618 -837 -1820 183 -2165 -2356 -1498 -1524 -1394 578 -449 -145 -923 -1288 -2498 -1304 -739 -353 -273 -1134 -117 -1592 -990 -2168 -501 -1629 -1565 -1380 -78 -248 -374 567 441 -86 203 844 1 132 -740 311 395 2287 2422 1378 1753 2230 1070 2350 1408 1523 2110 1218 527 1397 -636 -865 -846 -150 -1300 -1314 -172 -1603 -2039 SS 20221011T131747.0Z 8319.554016 253 1 49.39 2 78.68 105.09 81.97 281.12 0.00 1 0.00 1 0 17 2.916e-01 1.267e-02 1.292e-01 4.257e-03 5.581055e-01 2.262970e-03 5.916346e-03 -6.000000e+00 1.688546e-01 227.17 -2.00 3.24 -2.00 320.72 0.00e+00 1.737580e-03 9.589697e-04 2.913114e-04 -6.000000e+00 7.961924e-03 291.63 -2.00 20.00 -2.00 319.98 0.00e+00 4.918 0.001 302.00 328.00 3 3.2394e+00 7.3792e-03 5.5632e-02 -6.0000e+00 4.1918e-01 1.9578e-02 9.6242e-03 2.7108e-02 -6.0000e+00 4.5592e-01 -5.5248e-02 8.5958e-03 1.3701e-02 -6.0000e+00 2.7087e-01 2.3581e-02 4.2396e-03 4.6871e-03 -6.0000e+00 1.1637e-01 8.8899e-05 -2.6973e-04 1.2450e-04 5.1463e-05 -6.0000e+00 8.2368e-03 -6.4732e-03 2.0241e-04 12 8 8 10 0 0 99.98 24.87 0.30 -0.00647 -0.00850 64 14 1 5 0 771.580 27.35 19.99 24.87 29.97 27.3 977.92 900000 46497 -121659 900000 -133692 -54819 900000 -101824 900000 -56419 -132578 7344 -71658 2287 -18945 900000 -5873 82032 -15259 18465 -12443 -12521 -28076 2945 636 -21405 -35939 -15936 -2724 -49234 95666 5028 18814 -16109 -23401 40956 -849 101304 -1920 -2903 -3691 18140 16058 7784 11214 12718 -3844 -3482 10645 -4031 13225 1079 2475 5566 5940 4287 4667 -9468 2784 -1454 976 -5266 -2161 1683 633 179 1139 -365 1780 2304 1844 3313 275 -1068 4549 2176 -7670 752 -1491 1901 -115 -1905 -2901 3596 -816 -2412 -190 -1304 -400 1265 1036 1709 155 -62 -1335 914 21 580 -124 -200 -57 -2185 -775 -2174 1069 -739 -526 -1269 430 110 407 368 553 -427 345 706 337 -457 -1419 -812 -748 1203 785 626 377 762 37 1316 101 342 -64 -29 -373 898 -252 -25 238 241 -346 -344 416 -814 -253 900000 193 -2348 900000 -2560 -516 900000 -1849 900000 -809 -3940 70 -1713 35 -419 900000 -146 1002 -479 450 -408 -415 -1131 98 23 -993 -1912 -687 -103 -3055 1875 256 952 -1158 -1727 1721 -58 3273 -189 -336 -475 2033 1915 1020 1447 1649 -590 -546 1521 -700 2160 217 533 1253 1400 1066 1185 -2727 701 -380 260 -1629 -727 600 234 64 399 -133 705 1029 898 1650 139 -521 1950 867 -3152 290 -651 931 -66 -1233 -2038 2516 -631 -2006 -162 -1150 -350 1053 814 1256 112 -46 -1094 828 22 658 -150 -241 -65 -2338 -773 -2237 1140 -839 -625 -1601 573 160 635 593 887 -667 510 1007 485 -687 -2262 -1336 -1228 1905 1216 945 552 1077 52 1859 157 577 -115 -54 -729 1814 -539 -56 537 553 -796 -772 894 -1697 -515 SS 20221011T132252.5Z 8319.557552 256 1 2.57 2 77.61 105.78 83.01 281.71 0.00 1 0.00 1 0 25 4.133e-01 1.112e-02 1.841e-01 7.613e-03 5.136603e-01 3.944938e-03 5.548333e-03 -6.000000e+00 2.363088e-01 227.17 -2.00 3.24 -2.00 320.00 0.00e+00 1.257112e-03 1.339869e-03 2.018652e-04 -6.000000e+00 1.135006e-02 291.63 -2.00 20.00 -2.00 319.19 0.00e+00 4.527 0.001 302.00 328.00 3 2.0823e+00 1.1806e-02 5.1226e-02 -6.0000e+00 5.8582e-01 -7.4093e-03 1.4516e-02 2.4851e-02 -6.0000e+00 6.3624e-01 -9.3614e-03 1.2135e-02 1.2202e-02 -6.0000e+00 3.8004e-01 -5.4935e-03 6.2630e-03 3.6834e-03 -6.0000e+00 1.6398e-01 4.3333e-04 -1.0201e-03 2.1806e-04 4.0523e-05 -6.0000e+00 1.1473e-02 -7.0307e-03 -8.1107e-05 12 9 9 12 1 1 -68.79 24.86 0.38 -0.00703 -0.01470 4 22 1 5 0 479.020 27.26 20.01 24.86 30.28 27.0 978.92 -127510 900000 -79374 900000 -107399 -64850 343437 -1186 900000 221618 -33639 -52996 74070 -27279 69914 -42422 42129 -8504 10796 -4173 -830 1779 -8702 2990 -21421 11485 -30781 21037 1746 7419 4364 6958 -1530 -4938 -9216 -3506 269 7641 4299 -6875 3967 1533 10640 -662 3656 -1995 1987 -7175 9014 -784 -578 2566 718 4450 684 -69 -2917 474 -1158 6499 -1577 493 692 3958 506 111 3601 -2030 4156 181 2672 -1786 2723 -2965 2471 331 -1649 -1834 -2318 348 -1324 -24 -1845 -1251 -2165 -1138 -631 -235 1026 474 370 594 2148 -893 485 -49 789 -404 523 -706 48 -1635 -300 -191 -278 -1068 -980 -194 107 29 498 1501 508 176 -549 714 -659 948 -698 -219 -1327 -623 32 1055 805 1133 236 -340 525 332 796 -396 -255 -12 372 290 -544 -181 242 -28 -212 -312 -232 -3566 900000 -1660 900000 -2582 -1063 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