File name: Pandora32s1_GreenbeltMD_20240704_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240705T051858.5Z 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_20240704_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: 20240704 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 20240704T103421.4Z 8951.440525 102 1 47.36 2 82.71 66.48 65.47 73.36 0.00 1 0.00 1 0 17 7.426e-01 3.856e-02 3.188e-01 2.114e-02 8.113611e-01 1.200852e-02 9.915981e-03 -6.000000e+00 4.436115e-01 232.73 -2.00 3.47 -2.00 321.79 0.00e+00 7.704565e-03 5.083128e-03 8.343260e-03 -6.000000e+00 2.002823e-02 289.25 -2.00 20.00 -2.00 321.19 0.00e+00 7.262 0.007 302.00 328.00 3 2.5728e+00 4.1478e-02 9.2795e-02 -6.0000e+00 1.1110e+00 1.2967e+00 4.9690e-02 6.3378e-02 -6.0000e+00 1.1990e+00 -1.7520e+00 3.0762e-02 2.4330e-02 -6.0000e+00 7.1521e-01 7.1932e-01 1.6020e-02 5.8659e-03 -6.0000e+00 3.0556e-01 1.2090e-05 -4.8315e-04 5.7859e-04 1.4939e-04 -6.0000e+00 2.0184e-02 1.0286e-02 7.4194e-06 12 8 8 10 0 0 19.61 22.23 1.87 0.01029 0.00665 12 3 1 5 0 3946.480 26.62 20.00 22.23 26.71 4.7 1018.95 161685 31126 32742 34403 -61658 12308 900000 3582 331429 -2371 -7123 -94806 513958 89555 136565 75284 121446 106758 84318 900000 59471 33140 900000 31816 238017 30084 141562 -9702 900000 -77402 3523 -31834 900000 -6049 44531 32517 21094 -4547 -11235 88402 47478 163585 900000 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1932 -669 -4205 -3401 624 8614 -2997 -1182 2511 1922 -7396 1966 -3701 628 -5063 -6915 -3686 -6487 -2744 2303 -347 1118 -5352 -1531 1755 825 3052 -3796 4096 2355 3406 -2878 2567 -1783 2805 -89 7305 7661 269 -919 37 -1322 -4848 3631 4635 -4487 -4214 3571 -268 3629 782 -6599 1477 733 -1287 -240 -739 SS 20240704T104523.4Z 8951.448187 105 1 26.56 2 80.73 68.09 63.47 74.74 0.00 1 0.00 1 0 17 4.191e-01 2.649e-02 2.608e-01 1.403e-02 7.101797e-01 7.700702e-03 8.074048e-03 -6.000000e+00 2.453905e-01 232.73 -2.00 3.47 -2.00 321.39 0.00e+00 -3.299373e-03 3.607332e-03 4.011082e-03 -6.000000e+00 1.110669e-02 289.26 -2.00 20.00 -2.00 320.75 0.00e+00 5.894 0.004 302.00 328.00 3 3.1546e+00 2.6874e-02 7.3601e-02 -6.0000e+00 6.1576e-01 5.4207e-01 3.4935e-02 5.1344e-02 -6.0000e+00 6.6472e-01 -8.8303e-01 2.7583e-02 2.0012e-02 -6.0000e+00 3.9488e-01 3.8812e-01 1.3064e-02 7.3506e-03 -6.0000e+00 1.6743e-01 3.2135e-05 -1.1107e-03 3.8857e-04 6.4877e-05 -6.0000e+00 1.1253e-02 1.0325e-02 -1.0796e-05 12 9 9 12 1 1 86.00 22.25 0.84 0.01032 0.00198 7 4 1 5 0 3319.610 26.62 20.00 22.25 27.18 4.7 1021.52 5857 -15981 -106517 -63339 -82629 -75562 900000 -90200 -40282 -70973 -117879 -135095 900000 -51068 -39581 -7558 208498 54728 8509 66611 -17253 -19857 47994 34866 64023 -52437 79493 35526 -6384 -73076 83046 -16373 81404 23999 -5305 14410 8797 26186 6607 139057 32225 82335 77534 64001 37255 21964 71562 72944 45150 73280 5268 30383 48347 39908 31710 9021 28478 5476 -2731 15422 18067 4912 14797 11000 -6078 2222 -2228 12952 3046 8748 2559 3190 -2671 2399 2895 4724 -12097 -4956 374 43 -4093 3783 -263 -8223 4030 -2601 -804 900 -2292 -2251 2115 8174 -1786 -1189 -2813 766 -4074 -1700 -522 -1578 -2476 -3461 -5456 -399 -938 -973 -2857 1451 -2000 -892 -594 -889 -368 1471 3753 -414 895 -298 352 1101 -77 639 1858 2401 1626 2058 -678 572 -2 1935 451 -1039 -816 807 977 1239 -322 -1965 470 -1067 215 -436 -762 80 -303 -5002 -1856 -2552 -1963 900000 -3024 -925 -2334 -6182 -8661 900000 -2002 -1648 -266 2851 1219 310 1409 -820 -937 1170 1033 1549 -4084 1731 1114 -278 -5960 1668 -1001 2219 1223 -346 732 488 1410 518 3646 2661 4503 4562 4300 3174 2140 4341 4394 3651 4737 707 3569 5238 5055 4612 1698 4605 1100 -573 2604 2959 965 2951 2551 -1771 597 -606 3101 866 2688 932 1213 -1078 880 976 1407 -3878 -1466 114 15 -1779 1749 -140 -5017 2339 -1704 -545 623 -1640 -1575 1343 4624 -1062 -712 -1880 568 -3619 -1681 -562 -1770 -2692 -3477 -5100 -352 -880 -974 -3045 1582 -2425 -1189 -873 -1401 -592 2297 5527 -607 1296 -451 558 1812 -129 1031 2872 3603 2389 2922 -956 810 -3 3334 859 -2125 -1742 1785 2280 3022 -814 -5082 1196 -2680 509 -983 -1656 SS 20240704T105535.4Z 8951.455271 110 1 48.82 2 78.88 69.57 61.61 76.02 0.00 1 0.00 1 0 17 3.690e-01 1.085e-02 7.981e-02 2.870e-03 6.254100e-01 1.536700e-03 7.168477e-03 -6.000000e+00 2.145524e-01 232.73 -2.00 3.47 -2.00 320.86 0.00e+00 3.763584e-03 6.636043e-04 2.121243e-03 -6.000000e+00 9.541320e-03 289.26 -2.00 20.00 -2.00 320.18 0.00e+00 5.000 0.002 302.00 328.00 3 2.1650e+00 5.0296e-03 6.0100e-02 -6.0000e+00 5.3850e-01 1.0604e-01 6.5433e-03 3.4626e-02 -6.0000e+00 5.8120e-01 -2.2221e-01 5.9125e-03 1.8163e-02 -6.0000e+00 3.4625e-01 9.0865e-02 2.8925e-03 5.8516e-03 -6.0000e+00 1.4710e-01 2.2656e-04 -6.5132e-04 7.9315e-05 7.9170e-05 -6.0000e+00 9.8404e-03 1.0027e-02 -6.9531e-05 12 8 8 10 0 0 92.73 22.27 0.63 0.01003 0.00513 72 17 1 5 0 677.960 26.73 20.00 22.27 27.57 4.7 1024.09 -151758 -66644 -140045 -87426 -164284 -132924 -38392 -127522 -74471 -131804 -85366 -132741 -47736 -58862 -26010 -21338 -43385 -3378 -25702 36107 -18087 -44382 7710 -39196 -1382 -38236 17693 -5911 -25605 -18915 -23106 5823 17045 -65 -1781 -17245 -6918 -13950 496 8376 65 13610 -7703 10673 3748 11090 8680 8589 7147 -3000 7546 6704 10415 8802 4508 5568 1882 3769 512 1498 5346 2097 6470 2988 3917 674 1699 3642 810 3716 547 1277 646 -311 56 -2370 -371 -3805 -2344 -2427 -843 -413 -3282 -1279 -811 -242 -50 509 1226 276 842 1372 -630 -659 -1021 252 -707 273 -738 -834 -606 -1341 -749 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