File name: Pandora25s1_HoustonTX_20221023_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T160837.4Z 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 v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20221023_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: 20221023 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 20221023T131700.9Z 8331.553482 104 1 49.72 2 80.70 109.05 57.73 111.29 0.00 1 0.00 1 0 25 3.801e-01 1.183e-02 1.561e-01 3.765e-03 6.274096e-01 2.040914e-03 6.649410e-03 -6.000000e+00 2.195968e-01 226.48 -2.00 3.24 -2.00 321.04 0.00e+00 3.105427e-03 9.769800e-04 6.671599e-04 -6.000000e+00 1.081835e-02 290.63 -2.00 20.00 -2.00 320.37 0.00e+00 5.880 0.002 302.00 328.00 3 2.0660e+00 7.0362e-03 6.5639e-02 -6.0000e+00 5.4474e-01 8.2510e-02 9.5655e-03 3.0746e-02 -6.0000e+00 5.9314e-01 -7.2617e-02 9.1229e-03 1.6300e-02 -6.0000e+00 3.5228e-01 2.3893e-02 4.3887e-03 6.2218e-03 -6.0000e+00 1.5333e-01 1.0521e-04 -4.8769e-04 1.0904e-04 6.9806e-05 -6.0000e+00 1.0740e-02 -7.8332e-03 1.9671e-04 12 8 8 10 0 0 99.99 24.88 0.31 -0.00783 -0.01150 80 17 1 5 0 621.330 27.35 20.00 24.88 29.08 26.9 972.99 900000 900000 -152142 900000 -214767 -143090 900000 -5775 900000 -4326 -153139 900000 -66908 -19074 -75132 900000 16274 90128 -14558 44518 -10158 1438 11637 42285 -32836 9097 -39980 -18357 -18969 -70570 154165 42729 11299 -7348 -37134 20954 11656 105886 -15818 -2961 638 12771 23014 7843 10132 13258 -7851 -7229 19168 -5598 17976 1178 4099 5616 10232 6016 6891 -7493 4151 -5965 1994 -4159 -1012 3562 -868 3285 1816 1481 1713 3165 2140 2737 1062 -1900 4953 1446 -6066 -910 584 733 643 -2907 -3161 2354 344 -2470 -643 -894 -941 1472 -125 611 -54 -1339 -823 254 -12 786 -219 -628 1024 -1733 -1292 -1443 810 -638 -573 -1049 602 -492 478 695 895 298 376 520 -229 -490 -807 -452 -833 706 513 588 -77 607 -6 1364 44 484 414 -328 -159 569 -379 -201 -60 140 -424 -76 416 -742 222 900000 900000 -2029 900000 -4587 -1597 900000 -22 900000 -20 -2998 900000 -868 -201 -1647 900000 202 619 -286 535 -207 27 208 623 -1032 206 -1430 -528 -551 -3594 1184 1088 436 -351 -2241 759 513 2355 -1280 -250 58 1108 1910 765 988 1288 -949 -901 1969 -773 2224 189 697 1018 1875 1193 1391 -1719 837 -1314 426 -1039 -278 1039 -274 974 542 460 589 1221 907 1195 465 -811 1832 502 -2138 -314 223 326 329 -1725 -2032 1522 241 -1877 -502 -717 -754 1118 -91 416 -36 -931 -631 219 -12 853 -255 -734 1118 -1780 -1239 -1404 822 -689 -648 -1262 771 -696 726 1098 1413 459 554 743 -331 -737 -1277 -737 -1358 1108 785 876 -112 852 -8 1923 69 826 758 -633 -319 1183 -834 -459 -140 330 -1002 -174 913 -1577 459 SS 20221023T133322.4Z 8331.564843 115 1 3.30 2 77.37 111.32 54.57 114.24 0.00 1 0.00 1 0 17 1.195e-01 5.899e-03 6.242e-02 3.276e-03 4.883582e-01 1.666731e-03 5.258620e-03 -6.000000e+00 6.797257e-02 226.48 -2.00 3.24 -2.00 319.62 0.00e+00 3.884784e-04 5.027145e-04 2.086311e-04 -6.000000e+00 3.118855e-03 290.63 -2.00 20.00 -2.00 318.80 0.00e+00 4.447 0.001 302.00 328.00 3 1.0147e+00 4.8172e-03 4.9884e-02 -6.0000e+00 1.6790e-01 -2.4412e-03 5.7943e-03 2.3514e-02 -6.0000e+00 1.8228e-01 6.7531e-03 4.6624e-03 1.1467e-02 -6.0000e+00 1.0922e-01 -9.1849e-03 2.4406e-03 3.2908e-03 -6.0000e+00 4.6874e-02 1.3889e-03 -5.5973e-04 9.2628e-05 3.5674e-05 -6.0000e+00 3.2511e-03 -7.2212e-03 5.4423e-05 12 1 1 12 1 1 93.99 24.86 0.38 -0.00722 -0.01143 16 57 1 5 0 183.850 27.26 20.00 24.86 29.71 26.9 976.25 -53764 17137 -58470 20477 -59386 -4742 -7732 -16121 -12180 -21689 -24537 -1029 -7214 -16525 3045 78941 7769 -3698 678 -11037 6252 -5414 -698 -5048 -6068 2660 -9034 3347 -10843 559 -2366 6027 -2994 3816 -5393 1954 155 3316 -239 -303 -1335 -1041 802 -1832 2601 -485 -425 -2349 -157 -2331 1764 1659 24 950 425 1761 799 520 -936 746 -767 579 999 1376 933 1128 -66 545 1351 -32 931 1251 183 -249 948 -847 -460 -1104 335 -1326 -933 -1568 -1339 -672 -1220 -549 -812 124 12 1327 920 1138 252 988 735 -87 -270 502 289 -387 -251 -751 -162 -578 -263 -1017 -276 -653 -355 581 254 292 169 112 -332 412 -273 190 15 101 -739 -85 170 304 270 516 -175 385 342 489 446 -169 85 242 206 -483 20 14 -218 -96 -65 -240 -72 -1059 204 -1416 232 -1265 -65 -111 -292 -240 -502 -607 -23 -207 -642 118 1639 360 -209 36 -697 368 -334 -44 -362 -476 201 -770 241 -879 43 -216 584 -358 440 -649 222 20 506 -43 -64 -318 -263 207 -495 679 -133 -117 -669 -45 -674 540 560 9 377 178 758 334 217 -387 322 -329 270 520 780 508 622 -36 301 770 -21 630 877 128 -176 607 -497 -266 -644 201 -940 -716 -1289 -1188 -628 -1168 -558 -829 129 12 1370 886 1068 226 896 699 -95 -320 636 375 -500 -316 -906 -182 -669 -313 -1291 -366 -884 -496 884 403 462 275 172 -501 589 -395 287 23 164 -1213 -135 261 468 399 762 -250 564 529 802 759 -293 152 458 399 -960 40 29 -453 -194 -128 -454 -138 SS 20221023T140225.2Z 8331.585014 128 1 37.80 2 71.59 115.63 49.15 120.12 0.00 1 0.00 1 0 17 1.297e-01 9.698e-03 2.011e-02 2.778e-03 3.526809e-01 1.401803e-03 3.835361e-03 -6.000000e+00 7.389187e-02 226.48 -2.00 3.24 -2.00 318.51 0.00e+00 8.114264e-05 2.948923e-04 1.050633e-04 -6.000000e+00 3.404898e-03 290.63 -2.00 20.00 -2.00 317.64 0.00e+00 3.126 0.000 302.00 328.00 3 4.4039e+00 3.8186e-03 3.5238e-02 -6.0000e+00 1.8253e-01 3.2013e-02 4.4005e-03 1.6807e-02 -6.0000e+00 1.9809e-01 1.6112e-02 2.9751e-03 8.2032e-03 -6.0000e+00 1.1871e-01 -1.1188e-02 1.5610e-03 2.3420e-03 -6.0000e+00 5.1362e-02 1.8894e-04 1.2098e-03 8.0889e-05 2.5307e-05 -6.0000e+00 3.5452e-03 -1.0530e-02 3.7891e-04 12 9 9 12 9 1 99.99 24.88 0.30 -0.01053 -0.00144 23 7 1 5 0 1567.370 27.35 20.00 24.88 30.76 27.0 981.30 900000 11233 -2138 18341 -30510 -5247 51799 -2761 24558 7204 -26997 11083 -14629 5949 -7574 126724 41 10855 4425 4135 6759 -3118 2601 42 -2833 308 -2105 -2485 -496 -9392 444 4225 -910 -2559 -10302 -603 -3648 9519 -5050 -1606 -2884 2190 1235 1021 634 1973 -2184 -2989 1587 -2675 2155 -826 1395 879 1923 352 1875 -2398 1794 -1415 2403 -444 403 1249 -434 138 -318 461 -320 1451 1104 1204 390 102 1384 707 -2030 -839 201 -266 -779 -1928 -1923 -132 -646 -1403 242 -477 96 921 426 700 448 144 -410 1255 92 1210 520 -286 5 -1522 -820 -881 164 -342 -567 -1034 212 -551 903 265 807 -117 -290 -64 75 -190 -491 -653 -300 -15 423 454 704 398 -310 1453 288 486 -30 -56 -628 565 -87 183 129 316 -367 -349 113 -816 127 900000 489 -108 717 -1709 -232 1478 -147 1130 408 -2111 655 -1267 498 -829 4435 5 1238 561 548 888 -449 371 7 -483 53 -369 -414 -78 -1634 77 782 -192 -559 -2290 -123 -849 2304 -1650 -582 -1142 868 508 424 265 819 -932 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