File name: Pandora32s1_GreenbeltMD_20240313_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240314T052000.4Z 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_20240313_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: 20240313 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 20240313T120431.1Z 8838.503137 53 1 49.56 2 82.41 99.62 101.54 59.75 0.00 1 0.00 1 0 25 3.930e-01 2.523e-02 2.259e-01 1.187e-02 9.552488e-01 6.567339e-03 1.048213e-02 -6.000000e+00 2.230646e-01 226.30 -2.00 3.47 -2.00 322.00 0.00e+00 2.945911e-03 3.188858e-03 1.840378e-03 -6.000000e+00 9.692485e-03 277.99 -2.00 20.00 -2.00 321.55 0.00e+00 7.035 0.006 302.00 328.00 3 1.9228e+00 2.3171e-02 8.5883e-02 -6.0000e+00 5.5341e-01 1.2927e+00 2.8281e-02 5.0355e-02 -6.0000e+00 6.0135e-01 -1.7528e+00 2.1358e-02 2.6026e-02 -6.0000e+00 3.5771e-01 7.1454e-01 1.0752e-02 8.3030e-03 -6.0000e+00 1.5236e-01 2.5476e-05 -1.3307e-03 2.9721e-04 1.3193e-04 -6.0000e+00 1.0461e-02 1.0490e-02 -4.4906e-05 12 8 8 10 0 0 99.80 21.30 0.70 0.01049 0.00049 25 6 1 5 0 1982.080 25.90 20.00 21.30 16.20 4.4 964.71 -24318 -37717 -35022 31020 -21386 -67284 -19172 -76781 -46553 -75717 -66095 -91374 111355 -41318 47502 27951 -42053 72805 1538 152615 -31646 -4560 38795 -30079 103641 -28909 17251 -30397 -31138 -7945 5285 -26507 13297 29170 13436 5666 133308 11260 57407 66753 64010 112894 99910 134398 37802 79683 41335 85205 32021 35573 38353 35504 32813 37115 35236 36870 42849 38964 6554 20580 22414 -8688 35876 595 19516 1639 29006 20282 5802 34444 5252 3733 -987 15560 -5902 -9070 3274 -13230 -1953 -6594 -7055 12209 -4132 6208 3344 -2331 2418 -881 6997 -2764 1552 6482 374 -4008 -4655 4218 -5594 -1782 -2014 -115 333 -4943 -3945 -7711 -6269 -4229 -2913 87 -1582 -1827 -1970 822 88 -683 545 -1012 -458 -1151 913 125 940 2811 2545 3106 1259 2414 2074 1146 1024 1640 212 -900 -720 811 1499 188 -120 -948 452 -346 9 -740 -2083 -1034 -2017 -1816 768 -726 -3002 -505 -3557 -1647 -3528 -2718 -4954 1289 -2032 1205 994 -3192 1914 82 1828 -2135 -217 1151 -1760 1702 -1701 625 -1600 -1526 -318 216 -1767 698 1396 706 291 1983 604 2313 2843 3090 3578 3628 3457 2388 3296 2463 3400 2223 2533 2903 3071 3160 3689 3743 3954 4389 4041 870 2230 2336 -1284 3938 104 3125 314 4267 3348 1200 6193 1368 1025 -278 3497 -1456 -2032 603 -2890 -432 -1830 -2349 3937 -1737 2530 1475 -1136 1179 -455 3343 -1399 711 2688 161 -1881 -2501 2468 -4228 -1506 -1914 -111 309 -4339 -3057 -5946 -5008 -3523 -2523 79 -1616 -2145 -2646 1185 134 -1046 804 -1474 -664 -1748 1427 204 1497 4202 3644 4308 1736 3212 2695 1561 1586 2928 427 -1989 -1686 1997 3904 518 -337 -2692 1267 -942 23 -1758 -4738 SS 20240313T121511.5Z 8838.510550 56 1 48.45 2 80.37 101.35 99.77 61.50 0.00 1 0.00 1 0 17 5.284e-01 1.772e-02 2.390e-01 7.390e-03 8.201624e-01 4.024942e-03 9.575614e-03 -6.000000e+00 3.006299e-01 226.30 -2.00 3.47 -2.00 321.61 0.00e+00 9.940302e-03 2.041884e-03 4.413605e-03 -6.000000e+00 1.345398e-02 277.99 -2.00 20.00 -2.00 321.15 0.00e+00 5.704 0.003 302.00 328.00 3 2.7417e+00 1.3997e-02 7.2373e-02 -6.0000e+00 7.4488e-01 5.1439e-01 1.9014e-02 4.5808e-02 -6.0000e+00 8.0971e-01 -7.3893e-01 1.8944e-02 2.7841e-02 -6.0000e+00 4.8170e-01 3.1291e-01 8.9804e-03 1.2562e-02 -6.0000e+00 2.0493e-01 4.9026e-05 -1.2838e-03 1.9235e-04 2.0844e-04 -6.0000e+00 1.4125e-02 9.0089e-03 -9.4184e-05 12 8 8 10 0 0 98.91 21.33 0.49 0.00901 -0.00064 30 7 1 5 0 1614.670 25.90 20.00 21.33 17.06 4.4 968.63 -180577 -177883 -152119 -178223 -118942 -183301 -145350 -155643 -101379 -154259 -125631 -130331 25606 -143506 -51170 -60749 -105157 -50376 57431 62377 -32051 36341 8394 -50737 105614 -4066 900000 36932 -53539 -55075 -29474 -42461 44585 -1109 29120 -22849 -10733 -2335 -1069 50779 28010 30276 11983 42988 54042 48861 38157 38166 27919 23096 16607 33195 12249 17280 6594 22360 14719 852 14336 2658 10468 1252 10940 11856 4703 12652 10263 13222 2501 13894 4241 3485 3360 2172 1126 -2984 -849 -2641 -6517 1271 -1821 917 -1350 1249 656 -166 456 -702 -854 -17 -2116 3929 -4448 -4853 -1530 -1907 -1232 1104 -687 -605 -1290 -1275 -2606 -1763 -2029 -4066 -1649 -902 -1352 -603 -374 721 -428 -327 -415 -37 -144 126 877 597 176 1960 2430 1893 1755 695 808 593 -86 811 194 -612 172 754 696 -180 -124 -506 -294 -486 -60 -244 -849 -3569 -4156 -3024 -4475 -1520 -3912 -2120 -2628 -1081 -2831 -1781 -2101 184 -4428 -854 -1376 -4184 -1325 581 622 -796 453 135 -1473 761 -81 900000 484 -1644 -1841 -932 -1875 1028 -43 839 -1012 -438 -99 -53 1832 1404 1599 790 2184 2517 2442 2175 2267 1936 1793 1509 2892 1426 2079 928 2804 2025 132 1898 379 1402 198 1803 2226 1032 2624 2148 2773 629 3595 1334 1154 1110 687 328 -811 -210 -671 -1907 415 -725 410 -684 658 367 -99 283 -455 -555 -11 -1282 2132 -2511 -2833 -967 -1410 -1052 1060 -744 -676 -1395 -1251 -2327 -1517 -1840 -3981 -1657 -958 -1575 -783 -541 1114 -689 -522 -641 -55 -214 194 1401 993 291 3078 3652 2779 2517 977 1104 831 -135 1432 379 -1282 376 1728 1684 -459 -322 -1325 -769 -1237 -144 -555 -1853 SS 20240313T122253.3Z 8838.515895 61 1 14.44 2 78.91 102.62 98.47 62.74 0.00 1 0.00 1 0 17 5.722e-01 1.373e-02 2.524e-01 6.802e-03 7.535046e-01 3.632860e-03 8.656601e-03 -6.000000e+00 3.270890e-01 226.30 -2.00 3.47 -2.00 321.12 0.00e+00 5.684755e-03 1.656453e-03 3.219287e-03 -6.000000e+00 1.419648e-02 277.99 -2.00 20.00 -2.00 320.63 0.00e+00 5.015 0.002 302.00 328.00 3 2.4525e+00 1.1775e-02 6.4129e-02 -6.0000e+00 8.1126e-01 2.1672e-01 1.6274e-02 4.1948e-02 -6.0000e+00 8.8167e-01 -2.9130e-01 1.7056e-02 2.5181e-02 -6.0000e+00 5.2288e-01 1.1574e-01 8.2029e-03 1.0003e-02 -6.0000e+00 2.2203e-01 1.3874e-04 -9.0890e-04 1.7712e-04 1.3104e-04 -6.0000e+00 1.5317e-02 8.0825e-03 -5.4455e-05 12 9 9 12 1 1 80.95 21.35 0.51 0.00808 0.00125 11 9 1 5 0 1202.680 25.90 20.01 21.35 17.30 4.4 969.62 -166517 -217589 -195475 -197913 -202346 -229564 900000 -183003 -128507 -213096 -74510 -151817 -153453 -10738 -36182 -13533 -75225 -24049 -5898 -26387 77248 -33275 -37809 -60303 14907 29340 -20039 17862 -75727 -59138 99405 19265 40101 -770 29197 -20323 -17901 2698 -18424 3558 5149 12386 1206 9267 26598 13664 9359 8552 11269 11477 7305 22391 5526 10485 3090 10833 329 -549 11753 -724 5097 -533 3878 4559 5726 5850 -192 6007 1546 5081 2022 570 3923 1689 36 -154 -3221 -2590 -2207 -723 -2826 560 -652 -1577 885 -1687 -893 -1508 128 644 -65 2984 -2339 -2626 -549 -599 -759 -247 77 -1923 -302 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