File name: Pandora32s1_GreenbeltMD_20250325_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250326T052241.5Z 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 v1.8.75 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250325_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: 20250325 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 20250325T113448.2Z 9215.482502 96 1 49.23 2 84.55 91.82 69.23 144.93 0.00 1 0.00 1 0 25 5.170e-01 3.942e-02 2.854e-01 2.260e-02 1.190051e+00 1.311375e-02 1.321536e-02 -6.000000e+00 2.954950e-01 227.12 -2.00 3.47 -2.00 322.23 0.00e+00 -1.453989e-02 4.565818e-03 3.195893e-03 -6.000000e+00 1.283428e-02 279.04 -2.00 20.00 -2.00 321.77 0.00e+00 9.213 0.014 302.00 328.00 3 2.0986e-01 4.3125e-02 1.1338e-01 -6.0000e+00 7.3582e-01 2.3785e+00 4.9888e-02 7.4152e-02 -6.0000e+00 8.0052e-01 -2.8264e+00 2.8315e-02 2.9747e-02 -6.0000e+00 4.7407e-01 1.0582e+00 1.7225e-02 1.5223e-02 -6.0000e+00 2.0112e-01 1.2097e-05 -3.9461e-04 5.3577e-04 1.8188e-04 -6.0000e+00 1.3769e-02 6.1973e-03 -1.7811e-04 12 8 8 10 0 0 -71.41 20.62 2.04 0.00620 0.00323 27 6 1 5 0 1822.790 25.68 19.93 20.62 14.65 5.6 950.69 163130 92188 40259 10070 55374 -57863 159085 -17917 10044 -27205 -31073 82039 21410 42895 39987 19515 -11790 30632 38885 69841 68843 -46686 30767 -20321 83913 105619 24111 30786 -1184 -59849 44990 -47824 900000 -30503 -9804 -50194 -22621 61774 -23983 180800 51603 151744 53025 74505 169410 7642 294295 68563 10799 3576 -27449 55731 29211 900000 32297 14069 3663 33135 50642 -8636 32139 -44983 -25078 1181 -26426 50054 20675 69805 -2249 45087 22726 -425 58262 6063 -14657 -19531 -10172 32335 -15853 28940 -16474 15081 -8699 -8006 59562 -1508 23096 368 -2371 14739 -6300 33925 -2428 -8739 2125 4436 8612 -169 13104 -4682 882 -7212 -9148 -6075 -8073 2708 -8811 -3232 -2932 819 2811 1439 461 -300 3245 -1042 -1380 867 -2045 562 1011 1309 5015 -493 2118 -1865 -3133 -862 -1846 4608 -223 3325 -2816 -933 -144 406 622 -2741 1404 255 726 299 -105 6862 7755 5080 1392 3660 -9620 3505 -1974 865 -3379 -3859 3286 1715 3093 3284 2111 -1771 2945 3271 3917 3447 -6452 1849 -2157 3362 3385 1594 1603 -71 -6114 1802 -5652 900000 -3421 -805 -5429 -1812 2586 -2546 3984 3308 4012 3622 3776 3733 623 6484 2870 833 315 -3629 3561 2639 900000 3202 1736 509 3285 3794 -1028 2337 -7235 -3702 154 -4949 4411 2460 5383 -396 5662 3906 -95 6932 1095 -2810 -3357 -1457 3135 -2864 4081 -4428 3489 -2894 -2840 11286 -548 6768 137 -888 4417 -2165 7400 -765 -3196 824 2043 4573 -116 8922 -3961 671 -5244 -5885 -3587 -5105 1635 -6309 -2386 -2468 794 2889 1707 592 -397 4094 -1345 -1797 1153 -2945 808 1391 1667 6365 -586 2641 -2363 -3935 -1130 -2656 7550 -447 7205 -7101 -2525 -420 1248 1945 -8885 4307 749 1931 718 -235 SS 20250325T114740.1Z 9215.491436 99 1 48.73 2 82.05 93.86 67.84 147.69 0.00 1 0.00 1 0 17 5.499e-01 2.075e-02 1.184e-01 3.884e-03 1.000740e+00 2.171782e-03 1.098065e-02 -6.000000e+00 3.132657e-01 227.12 -2.00 3.47 -2.00 322.00 0.00e+00 1.225608e-02 1.189215e-03 1.358822e-03 -6.000000e+00 1.362476e-02 279.04 -2.00 20.00 -2.00 321.57 0.00e+00 6.758 0.005 302.00 328.00 3 3.5139e-01 8.0061e-03 8.7546e-02 -6.0000e+00 7.7838e-01 9.8058e-01 1.1124e-02 6.1843e-02 -6.0000e+00 8.4499e-01 -1.3151e+00 1.0667e-02 2.9286e-02 -6.0000e+00 5.0262e-01 5.3677e-01 4.9461e-03 1.6085e-02 -6.0000e+00 2.1409e-01 1.5187e-04 -1.6692e-03 9.3810e-05 1.9568e-04 -6.0000e+00 1.4640e-02 3.9111e-03 -1.3289e-04 12 8 8 10 0 0 -0.49 20.71 0.61 0.00391 -0.00863 119 28 1 5 0 409.450 25.68 20.15 20.71 14.86 5.6 952.45 -38943 -168162 -128929 -127769 -164308 -183315 -200748 -158421 -166165 -148781 -165454 -191268 -116373 -130851 -31025 -56574 -55261 -18762 -46968 56474 -50931 -24399 -27664 -65080 -23914 -64443 65734 -54556 -29167 -46550 -28970 28749 15343 31230 2088 13606 13961 1539 7053 34883 54673 47258 19050 66767 20736 49037 21324 62696 30788 15011 41608 33396 57827 37180 46393 37555 29094 27785 15761 20980 17943 25422 25944 21855 27623 15751 21791 19738 16120 19589 13701 14695 10652 12491 5441 1410 24 -1278 -1581 -72 3877 2816 -122 2176 -349 1278 387 1284 361 331 2432 -784 -2158 -4738 -4481 -2608 -3770 -1350 -2575 -1755 -1044 -2406 -1855 -3247 -2594 -4051 -2584 -1906 -1503 -1109 -1257 -595 -110 -448 -21 -780 75 -172 395 638 1144 2055 2034 2234 1370 1073 1813 999 1130 534 1190 732 447 157 -123 130 -252 96 -115 -184 -22 -1032 -1754 -241 -4574 -2530 -2376 -3791 -4419 -5392 -2782 -3204 -2649 -3133 -5071 -2072 -3379 -435 -1286 -1444 -377 -1334 578 -1485 -508 -566 -1947 -480 -1928 523 -1384 -563 -1164 -757 544 401 769 66 356 365 51 259 1136 1636 1629 909 2023 997 1802 1066 2185 1586 984 2332 2302 3461 2971 3585 3257 2777 2631 1594 1907 1672 2378 2801 2626 3519 2332 3054 2950 2748 3716 3076 3421 2542 2714 1130 268 4 -236 -337 -19 1176 1018 -51 964 -167 636 203 689 195 173 1172 -367 -1001 -2372 -2584 -1636 -2886 -1197 -2637 -1871 -1058 -2201 -1473 -2466 -2048 -3462 -2297 -1820 -1604 -1273 -1685 -888 -172 -708 -32 -1166 111 -267 644 1075 1878 3146 2933 3113 1873 1429 2324 1342 1761 926 2358 1610 990 376 -318 354 -705 270 -321 -495 -54 -2347 -4016 SS 20250325T120428.5Z 9215.503108 104 1 48.59 2 78.80 96.55 66.18 151.42 0.00 1 0.00 1 0 25 6.152e-01 1.091e-02 3.598e-02 1.193e-03 7.840439e-01 6.362413e-04 8.781123e-03 -6.000000e+00 3.504933e-01 227.12 -2.00 3.47 -2.00 321.04 0.00e+00 5.325908e-03 2.862418e-04 1.380540e-03 -6.000000e+00 1.524213e-02 279.04 -2.00 20.00 -2.00 320.53 0.00e+00 4.969 0.002 302.00 328.00 3 4.0060e-01 2.0439e-03 6.4096e-02 -6.0000e+00 8.7088e-01 1.9072e-01 2.8197e-03 4.1635e-02 -6.0000e+00 9.4535e-01 -2.5807e-01 2.9475e-03 2.3732e-02 -6.0000e+00 5.6232e-01 1.0329e-01 1.4207e-03 9.8976e-03 -6.0000e+00 2.3957e-01 1.0849e-03 -8.8063e-04 3.0271e-05 1.1044e-04 -6.0000e+00 1.6375e-02 2.9070e-03 -1.2091e-04 12 8 8 10 0 0 -10.55 20.87 0.33 0.00291 -0.00371 340 80 1 5 0 142.890 25.79 20.06 20.87 15.76 5.6 957.41 -202751 -198456 -205290 -187171 -194677 -217309 -197789 -202338 -171084 -178134 -176245 -161102 -141981 -104186 -96959 -61787 -68660 -49016 -41133 -37027 -44365 -48389 -37076 -40443 -38278 -34365 -37765 -33629 -46461 -42249 -25754 -24513 -5814 -9413 -8654 -15216 -10773 -3700 -2353 4062 1972 5530 402 6612 8945 7319 6960 5490 5648 4937 7485 8739 8067 9844 6675 6220 6191 3985 3582 1972 4058 4137 5649 6648 5191 4789 3175 3054 2500 3202 2621 1610 1306 613 -308 -848 -1769 -1978 -2074 -665 -965 -1012 -2023 -2251 -972 -1070 -349 -141 144 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