File name: Pandora32s1_GreenbeltMD_20240621_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240624T135909.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240621_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20240621 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20240621T102813.2Z 8938.436264 183 1 47.98 2 82.93 65.47 106.93 246.69 0.00 1 0.00 1 0 25 3.661e-01 2.351e-02 1.962e-01 1.084e-02 8.470121e-01 5.993023e-03 9.629805e-03 -6.000000e+00 2.129814e-01 232.79 -2.00 3.47 -2.00 321.97 0.00e+00 6.097170e-03 3.140496e-03 4.099914e-03 -6.000000e+00 9.420302e-03 288.05 -2.00 20.00 -2.00 321.42 0.00e+00 7.457 0.007 302.00 328.00 3 1.4197e+00 2.2592e-02 8.8129e-02 -6.0000e+00 5.3486e-01 1.0774e+00 2.8244e-02 4.8482e-02 -6.0000e+00 5.7732e-01 -1.5030e+00 2.0234e-02 2.4350e-02 -6.0000e+00 3.4367e-01 6.0996e-01 9.9137e-03 7.5020e-03 -6.0000e+00 1.4583e-01 3.3426e-05 -1.2156e-03 2.8501e-04 1.4227e-04 -6.0000e+00 9.7630e-03 1.0012e-02 -5.4195e-06 12 8 8 10 0 0 10.13 22.21 1.26 0.01001 0.00088 34 8 1 5 0 1410.900 26.62 20.00 22.21 27.21 4.7 1023.21 -19958 -44325 -43102 -9000 -76290 -102348 -19129 -75433 -36476 -66092 -94079 -111278 -44483 -32910 -12187 6251 -6226 18095 62845 65880 -34585 -6576 29597 -31965 97789 -10570 169483 -1663 -39248 -43182 2736 -29035 66135 -8272 -369 -12953 8842 -10222 -331 29454 16175 63856 35204 70442 39735 79350 51396 166866 31851 8011 24683 65570 28381 21949 34250 15918 19455 13552 24920 5863 40695 21395 27951 36393 11245 19150 17778 20098 5738 12004 6521 13906 4824 7736 550 -4206 837 8710 -6322 1771 7347 3224 2577 -2171 3690 2109 -3359 -1807 -2487 619 495 6952 -6171 -4573 -5752 -801 -3946 1561 -4550 -4600 -940 -4680 -2158 -4093 -2401 -3565 -2332 -2419 -2192 -644 -647 -27 289 -604 873 205 -1568 -639 42 1692 219 1852 2658 2491 2314 1610 2467 299 -504 1313 1128 158 -137 1226 -303 1039 -100 -861 -286 227 214 -1100 -2058 -614 -1960 -1906 -260 -3593 -5312 -405 -2828 -947 -2287 -4160 -5990 -1454 -1202 -445 222 -275 661 1510 1520 -2094 -278 908 -1659 1551 -447 1792 -63 -2033 -2374 110 -1758 1958 -551 -21 -781 430 -670 -23 1775 1231 3173 2382 3352 2521 3356 2880 2999 2290 771 2192 4298 2941 2599 3766 2154 2571 1863 2898 781 3786 2579 3576 4887 2116 3341 3083 3485 1250 2818 1636 3735 1275 2045 141 -996 173 1667 -1571 489 2299 1113 1003 -949 1614 995 -1763 -966 -1341 314 236 2920 -2853 -2149 -3096 -487 -2936 1287 -4505 -4745 -895 -4157 -1668 -3120 -1911 -3077 -2105 -2355 -2364 -786 -906 -38 421 -883 1215 303 -2360 -916 63 2641 345 2749 4075 3718 3361 2283 3360 430 -835 2287 2227 343 -320 3027 -754 2712 -272 -2384 -788 600 571 -2750 -4909 SS 20240621T103857.2Z 8938.443717 186 1 48.36 2 81.02 67.04 108.77 248.07 0.00 1 0.00 1 0 17 4.821e-01 1.564e-02 8.139e-02 3.514e-03 7.382597e-01 1.912048e-03 8.648274e-03 -6.000000e+00 2.803999e-01 232.79 -2.00 3.47 -2.00 321.42 0.00e+00 5.044405e-03 9.745993e-04 4.799788e-03 -6.000000e+00 1.240367e-02 288.05 -2.00 20.00 -2.00 320.83 0.00e+00 6.065 0.004 302.00 328.00 3 1.2416e+00 6.8234e-03 7.4952e-02 -6.0000e+00 7.0417e-01 3.7478e-01 9.1575e-03 4.8139e-02 -6.0000e+00 7.6015e-01 -5.7791e-01 8.1826e-03 2.4119e-02 -6.0000e+00 4.5250e-01 2.3690e-01 3.8604e-03 6.6785e-03 -6.0000e+00 1.9196e-01 1.8087e-04 -9.8372e-04 9.3418e-05 1.2122e-04 -6.0000e+00 1.2858e-02 1.0391e-02 -6.6215e-05 12 8 8 10 0 0 8.38 22.25 0.63 0.01039 0.00300 94 22 1 5 0 514.410 26.62 20.00 22.25 27.96 4.7 1027.32 -90513 -155746 -135160 -164506 -133276 -170017 -136068 -141959 -160897 -131646 -164395 -139756 -130391 -101250 -89865 -71259 -17808 -45529 -15321 -6096 -27575 -54779 -30886 -17219 -44403 -4861 -7969 -38058 -27814 -48904 -10348 -29014 2356 5085 -507 23239 -28325 16946 -8356 11485 18632 20969 -586 16543 19605 11325 14382 25091 12894 11637 7548 24849 16944 17039 17500 11087 11717 6936 12337 7174 9825 11444 10168 14330 7459 5980 5149 4962 6393 4730 6210 1731 2522 2570 1144 481 -2885 833 -4143 -1237 -606 -1744 -504 -2675 61 -795 -719 -256 -82 1498 -1010 1175 -2228 -2719 -2223 -1007 -1050 -658 -999 -1166 -1803 -1845 -1842 -1300 -2443 -2299 -940 -1167 -392 -360 376 207 311 185 126 295 -213 664 72 448 358 917 2029 869 1006 479 728 1008 347 353 547 266 -175 15 -20 -155 233 -161 254 -249 -193 -514 -1199 -806 -3202 -2455 -3946 -2101 -3554 -2051 -2481 -3749 -2436 -4337 -3113 -3262 -2463 -2494 -2002 -336 -1248 -336 -127 -728 -1858 -825 -425 -1537 -118 -202 -1265 -810 -1843 -312 -1292 90 209 -22 741 -1582 697 -538 728 1251 1487 -54 1326 1538 982 1237 2003 1219 1188 887 2767 2053 2245 2448 1723 1865 1158 1891 1122 1512 1879 1929 2982 1810 1475 1254 1238 1717 1492 2166 668 966 933 386 146 -831 231 -1336 -463 -268 -906 -265 -1538 36 -511 -488 -180 -58 1011 -658 700 -1314 -1643 -1492 -781 -956 -693 -1090 -1317 -1954 -1953 -1755 -1203 -2441 -2454 -1046 -1286 -471 -490 573 319 491 287 187 451 -326 1052 114 737 590 1447 3266 1373 1534 709 1036 1465 572 621 1074 527 -368 34 -47 -372 572 -405 637 -609 -473 -1174 -2631 SS 20240621T105042.5Z 8938.451881 191 1 48.57 2 78.91 68.74 110.81 249.57 0.00 1 0.00 1 0 17 3.880e-01 8.738e-03 3.878e-02 1.566e-03 6.297647e-01 8.372043e-04 7.241716e-03 -6.000000e+00 2.256676e-01 232.79 -2.00 3.47 -2.00 320.73 0.00e+00 3.381233e-03 3.499620e-04 1.900363e-03 -6.000000e+00 9.982434e-03 288.05 -2.00 20.00 -2.00 320.06 0.00e+00 5.010 0.002 302.00 328.00 3 1.0450e+00 2.6905e-03 6.0235e-02 -6.0000e+00 5.6672e-01 7.3159e-02 3.4872e-03 3.4656e-02 -6.0000e+00 6.1177e-01 -1.5079e-01 3.1943e-03 1.8062e-02 -6.0000e+00 3.6418e-01 5.8889e-02 1.5720e-03 5.7517e-03 -6.0000e+00 1.5450e-01 6.8361e-04 -7.0199e-04 4.2848e-05 7.5875e-05 -6.0000e+00 1.0349e-02 9.9172e-03 -8.0469e-05 11 8 0 10 0 0 -11.82 22.29 0.43 0.00992 0.00464 204 48 1 5 0 238.070 26.62 20.01 22.29 28.81 4.7 1032.42 -134919 -145180 -129051 -118587 -143136 -128609 -120414 -120335 -117097 -92374 -106941 -115475 -73232 -70842 -43446 -33319 -33494 -29650 -23304 -11686 -29467 -21061 -12847 -27397 -19064 -25443 -10234 -21991 -20767 -21838 -17089 -6757 -7749 -2429 -5564 -7296 -6373 -1419 -1194 1461 2681 2381 -1013 5273 2911 2802 3811 5328 3618 1641 3517 5844 5841 5029 4953 4636 2749 1087 1006 2509 2482 3836 3957 4476 3204 1637 1318 987 1219 1980 1155 1449 983 755 -405 -914 -2713 -2355 -2677 -1236 -1202 -1261 -1867 -1635 -758 -607 -196 385 600 906 254 270 -645 -775 -293 -740 -131 185 -20 -474 -706 -1191 -878 -698 -1110 -1461 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