File name: Pandora25s1_HoustonTX_20220926_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T155145.1Z 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_20220926_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: 20220926 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 20220926T130638.2Z 8304.546275 61 1 33.17 2 79.01 97.98 87.20 94.23 0.00 1 0.00 1 0 25 2.345e-01 5.665e-03 1.166e-01 1.918e-03 5.944873e-01 1.009501e-03 6.311392e-03 -6.000000e+00 1.356893e-01 227.95 -2.00 3.24 -2.00 320.55 0.00e+00 1.371767e-03 4.178849e-04 3.150863e-04 -6.000000e+00 6.273857e-03 292.74 -2.00 20.00 -2.00 319.79 0.00e+00 5.054 0.001 302.00 328.00 3 1.4955e+00 3.2372e-03 5.7766e-02 -6.0000e+00 3.3723e-01 -2.1259e-02 4.2404e-03 2.9088e-02 -6.0000e+00 3.6602e-01 -1.6955e-03 3.8936e-03 1.4425e-02 -6.0000e+00 2.1744e-01 -6.1872e-03 1.9347e-03 4.9668e-03 -6.0000e+00 9.2723e-02 4.3619e-04 -4.3990e-04 5.3862e-05 5.0775e-05 -6.0000e+00 6.4896e-03 -1.0228e-02 1.4390e-04 12 1 1 12 9 1 79.10 25.01 0.34 -0.01023 -0.01353 99 32 1 5 0 329.900 27.45 20.00 25.01 32.73 27.7 991.65 -151335 64541 -90166 44402 -110809 -76935 900000 -64052 900000 -46203 -74180 -12107 -37861 -18320 -27949 22836 -2098 13238 -4580 2774 -1661 -15882 -34477 10319 -4641 -2726 -17534 -10231 -7214 -17826 10611 6979 4705 121 -10199 2338 2718 19356 -1357 -2719 -2126 1857 2643 -353 4276 3202 -780 -2028 1660 -1144 2116 292 934 1114 945 1225 1548 -3169 15 -1832 -604 -448 610 2195 1013 25 760 -302 931 1292 1028 504 496 393 1415 542 -1953 -1140 -1870 -693 -699 -1191 -1934 -134 -810 -850 390 522 571 1095 1156 828 579 -2 43 343 150 248 296 -124 -129 -1037 -462 -751 -312 -1103 -824 -752 -309 385 331 332 249 167 273 248 163 0 -289 -343 -331 -57 151 -30 85 327 198 656 670 340 475 -173 -258 139 -209 -21 -265 160 -100 -208 3 -75 31 -2122 132 -843 113 -1140 -628 900000 -599 900000 -448 -925 -103 -484 -246 -514 299 -40 237 -106 64 -41 -458 -1284 272 -155 -95 -716 -376 -256 -772 412 333 244 7 -619 127 167 1220 -130 -316 -275 248 368 -48 611 474 -114 -310 256 -196 391 62 215 278 250 338 439 -940 4 -520 -177 -146 208 820 396 9 286 -119 404 643 529 272 264 211 688 239 -830 -490 -909 -368 -433 -842 -1414 -102 -667 -749 358 464 506 982 966 649 437 -2 37 325 165 293 376 -158 -153 -1187 -487 -807 -360 -1287 -1013 -988 -420 577 520 548 410 265 406 372 246 1 -465 -576 -554 -92 236 -46 129 478 281 960 1042 567 863 -322 -503 274 -441 -44 -583 358 -223 -450 6 -151 64 SS 20220926T131238.6Z 8304.550447 64 1 48.50 2 77.72 98.77 85.95 94.98 0.00 1 0.00 1 0 25 3.072e-01 1.614e-02 7.741e-02 4.246e-03 5.402140e-01 2.251118e-03 5.800830e-03 -6.000000e+00 1.785289e-01 227.95 -2.00 3.24 -2.00 320.36 0.00e+00 2.276582e-03 8.476006e-04 6.444868e-04 -6.000000e+00 8.570353e-03 292.74 -2.00 20.00 -2.00 319.57 0.00e+00 4.563 0.001 302.00 328.00 3 3.7273e+00 6.9996e-03 5.2188e-02 -6.0000e+00 4.4373e-01 8.0122e-02 8.8864e-03 2.6148e-02 -6.0000e+00 4.8221e-01 -8.1703e-02 7.6499e-03 1.3359e-02 -6.0000e+00 2.8669e-01 3.1654e-02 3.8529e-03 4.4552e-03 -6.0000e+00 1.2431e-01 7.4723e-05 -6.1025e-04 1.2344e-04 4.9846e-05 -6.0000e+00 8.6782e-03 -1.0742e-02 2.2396e-04 12 9 8 11 8 0 99.69 25.01 0.43 -0.01074 -0.01533 23 5 1 5 0 2108.570 27.45 20.00 25.01 32.92 27.6 992.94 900000 900000 -92029 900000 -168933 -85583 900000 -87070 900000 -72380 -73536 -53252 -42652 50882 -33461 900000 33513 112239 35430 62776 20350 -8764 -52541 51133 -24091 -224 -50042 -806 11410 -40000 44010 40808 11497 -2687 -10069 35040 32945 118378 4413 -4518 -2529 21643 14296 5979 13997 14424 -4388 -9374 7380 -1500 10359 456 4255 6762 9290 7960 2791 -10681 3103 -1965 2788 -1945 -3173 1087 -1988 -709 2016 1423 3188 2117 3464 2423 1266 -991 5251 889 -6361 -2242 -3554 1075 -868 -1114 -3724 -1654 -1553 -2098 212 -80 -85 460 1700 -339 343 -1442 -1180 1211 -1310 82 1338 -640 671 -3130 -607 -2635 2489 -50 -491 -1451 1217 587 493 1054 1194 350 -11 642 -429 -467 -635 -965 -430 845 671 201 -338 38 296 1221 28 465 230 -394 -433 1095 -769 -417 -264 827 -150 -182 779 -964 -283 900000 900000 -1925 900000 -6347 -1481 900000 -1889 900000 -1625 -1730 -1165 -1035 636 -1111 900000 757 1321 911 1315 644 -364 -3447 1388 -1403 -11 -3913 -39 480 -2897 1688 1860 775 -215 -827 1903 2024 3899 505 -657 -399 2895 2136 983 2167 2262 -831 -1898 1319 -308 2087 111 1079 1797 2528 2271 854 -3681 923 -608 858 -683 -1256 453 -875 -298 807 586 1414 1070 1879 1374 718 -548 2546 408 -2922 -998 -1757 586 -547 -783 -2867 -1314 -1307 -1875 194 -75 -80 416 1437 -274 265 -1150 -1021 1148 -1415 97 1657 -802 791 -3523 -632 -2826 2720 -58 -600 -1876 1642 858 771 1695 1909 544 -16 919 -621 -699 -997 -1575 -701 1337 1038 304 -497 54 409 1712 42 766 402 -721 -817 2121 -1580 -885 -571 1797 -330 -390 1600 -1932 -553 SS 20220926T131713.9Z 8304.553633 67 1 6.19 2 76.74 99.37 84.99 95.56 0.00 1 0.00 1 0 25 9.243e-02 6.193e-03 7.735e-02 3.253e-03 5.059464e-01 1.668458e-03 5.416576e-03 -6.000000e+00 5.294015e-02 227.95 -2.00 3.24 -2.00 319.78 0.00e+00 1.280080e-03 5.312660e-04 3.034106e-04 -6.000000e+00 2.434578e-03 292.74 -2.00 20.00 -2.00 318.94 0.00e+00 4.249 0.001 302.00 328.00 3 1.7621e+00 4.9106e-03 4.8654e-02 -6.0000e+00 1.3113e-01 -1.7151e-02 5.9710e-03 2.4402e-02 -6.0000e+00 1.4209e-01 4.4619e-04 4.8600e-03 1.2086e-02 -6.0000e+00 8.5154e-02 -6.0958e-03 2.5309e-03 3.8201e-03 -6.0000e+00 3.6565e-02 7.7910e-04 2.5490e-04 9.2174e-05 4.0285e-05 -6.0000e+00 2.5146e-03 -1.2311e-02 2.1119e-04 12 1 1 12 1 1 -11.65 25.01 0.32 -0.01231 -0.01040 19 35 1 5 0 300.540 27.45 20.00 25.01 33.04 27.4 993.02 2848 -4060 -27987 12505 -34401 -16010 32700 -44634 16725 -38344 -28755 -34476 979 -8879 -4388 -37512 6711 6513 -661 3727 -5378 -2706 -15612 890 -7729 5198 -12924 6132 -2060 -4761 5135 1369 2877 -1608 -3542 -2495 2146 1705 1482 -4234 352 -275 866 -2184 2753 -345 -454 -1867 -1095 1372 44 2456 -1654 2436 1293 2139 1192 -1533 -78 566 40 -939 2090 1968 1287 -717 1219 -744 1764 360 1467 214 1239 -469 1361 -393 -1825 -956 -2269 172 -868 -691 -1550 -1227 -1480 -350 166 542 273 911 835 710 641 280 30 199 21 318 255 -589 0 -1102 -483 -527 -76 -1233 -517 -754 -378 571 147 571 357 147 -279 198 216 194 -130 -190 -630 -14 381 -161 560 350 355 680 790 77 72 -254 -112 384 49 -96 -286 106 -5 -74 -215 20 -340 28 -48 -444 126 -509 -199 277 -871 217 -851 -603 -866 21 -264 -152 -2096 265 281 -33 187 -303 -150 -1044 55 -524 351 -978 396 -142 -360 378 121 284 -173 -370 -261 241 231 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