File name: Pandora32s1_GreenbeltMD_20240617_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240618T220232.8Z 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_20240617_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: 20240617 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 20240617T103639.4Z 8934.442123 114 1 49.18 2 81.30 66.86 136.76 293.73 0.00 1 0.00 1 0 25 3.719e-01 2.812e-02 1.796e-01 1.066e-02 7.491675e-01 5.754809e-03 8.876855e-03 -6.000000e+00 2.162162e-01 232.80 -2.00 3.47 -2.00 321.57 0.00e+00 4.317529e-03 2.677094e-03 6.265860e-03 -6.000000e+00 9.550463e-03 287.67 -2.00 20.00 -2.00 320.97 0.00e+00 6.237 0.004 302.00 328.00 3 2.8001e+00 2.0125e-02 7.9593e-02 -6.0000e+00 5.4308e-01 8.1628e-01 2.4879e-02 5.5573e-02 -6.0000e+00 5.8636e-01 -1.2270e+00 1.7705e-02 2.3192e-02 -6.0000e+00 3.4897e-01 5.1408e-01 8.7144e-03 5.4779e-03 -6.0000e+00 1.4791e-01 3.0384e-05 -9.6611e-04 2.8835e-04 1.1694e-04 -6.0000e+00 9.9196e-03 1.2662e-02 -8.6090e-05 12 8 8 10 0 0 33.92 22.10 1.42 0.01266 0.00540 20 5 1 5 0 2458.520 26.51 20.00 22.10 25.59 4.6 1014.07 44906 21180 -60512 -36694 -95112 -53841 13905 -28283 7054 -83873 -78916 -114812 -16900 -63689 4099 -14918 -45816 96509 -3657 104255 -3277 -35860 35096 -50544 73568 -19996 213772 -11119 -3739 -12928 14793 -4194 22415 26758 36470 -3349 1569 -17129 -4691 68736 16737 82125 71848 84617 62186 40367 82130 67313 28956 21250 22056 51825 38639 22740 26809 20142 22257 21310 21819 27085 23071 8606 21200 8692 15044 20625 7129 27230 1863 17423 3108 6639 5715 3227 453 -8862 -10452 -7501 -1938 -4490 -9291 3445 -4210 -356 3986 482 -794 -1357 -1722 -733 4317 5497 -3573 -3290 -6314 -2251 -5756 131 -2144 -3113 -3218 -4572 -4890 -6042 -2159 -2428 -1653 -1279 -1848 -756 -728 437 903 342 1260 -836 1140 -1413 219 1827 405 2242 3757 2652 719 1152 2216 -152 816 947 1854 60 526 1314 -603 759 -380 -1406 556 -445 3 -1369 -1689 806 540 -3544 -1560 -6110 -1984 250 -802 147 -4358 -3802 -8134 -580 -3911 155 -789 -3592 2106 -204 2167 -194 -2507 1276 -4011 1911 -1330 2221 -612 -179 -685 676 -275 1281 1557 1819 -230 104 -1549 -444 3643 1652 4437 4405 4572 4136 3314 4438 4267 2768 2296 2567 4954 4577 3379 4011 3307 3631 3454 3355 3771 3332 1538 3767 1978 3455 4436 1704 5404 517 4743 1085 2345 2019 1100 144 -2744 -3009 -2089 -564 -1596 -4113 1550 -2068 -180 2045 273 -480 -854 -1090 -446 2345 3033 -1880 -1766 -3907 -1567 -4872 122 -2271 -3435 -3387 -4392 -4245 -5199 -1909 -2305 -1646 -1362 -2178 -1002 -1091 644 1363 511 1943 -1265 1691 -2250 335 2886 649 3395 5859 4062 1087 1675 3076 -222 1333 1633 3538 126 1162 3072 -1543 1873 -975 -3691 1430 -1119 8 -3270 -3850 SS 20240617T105002.7Z 8934.451420 119 1 48.65 2 78.89 68.80 139.05 296.89 0.00 1 0.00 1 0 17 4.206e-01 1.049e-02 6.947e-02 2.944e-03 6.574486e-01 1.578498e-03 7.633187e-03 -6.000000e+00 2.445561e-01 232.80 -2.00 3.47 -2.00 320.93 0.00e+00 3.831013e-03 7.011447e-04 2.732500e-03 -6.000000e+00 1.080136e-02 287.68 -2.00 20.00 -2.00 320.28 0.00e+00 5.005 0.002 302.00 328.00 3 2.1268e+00 5.1967e-03 6.1655e-02 -6.0000e+00 6.1426e-01 1.4721e-01 6.8401e-03 3.7733e-02 -6.0000e+00 6.6318e-01 -2.7493e-01 6.2880e-03 1.9537e-02 -6.0000e+00 3.9468e-01 1.1178e-01 3.0512e-03 5.9072e-03 -6.0000e+00 1.6733e-01 2.2444e-04 -7.4673e-04 7.9970e-05 8.5069e-05 -6.0000e+00 1.1217e-02 1.1194e-02 -9.5873e-05 12 8 8 10 0 0 -18.83 22.12 0.70 0.01119 0.00558 80 19 1 5 0 608.100 26.51 20.00 22.12 26.21 4.6 1017.69 -159117 -163768 -128855 -121432 -149940 -134724 -115918 -137783 -140977 -106887 -128774 -106750 -89363 -55384 -63397 -30361 -28896 -5236 -12566 -5629 -34108 -34509 -14965 -28490 -17731 -20736 10228 -10246 -27469 -23183 -24205 -10846 -2158 -2067 -3896 -545 -13703 -7138 -2484 10910 7342 8320 -743 12376 9103 4065 5176 8110 2728 310 5791 10643 4959 7927 5230 3856 3659 1478 1265 2066 2882 3500 5654 5922 4248 2432 3330 2369 1406 3466 1640 605 1900 769 -123 -1454 -2998 -2064 -3305 -1055 -1967 -1189 -1358 -1613 -488 -153 -535 137 482 945 -274 1200 -368 -901 -1117 -494 -625 469 -91 -767 -1002 -1393 -1155 -950 -1800 -1826 -984 -506 -188 372 412 239 504 104 289 482 81 116 358 43 27 527 941 459 494 296 453 709 540 139 306 -149 75 135 -149 -142 -150 -51 29 -208 -101 -11 -690 -2559 -3339 -2035 -1778 -2669 -1934 -1431 -2374 -2834 -1657 -2588 -1870 -1617 -922 -1456 -610 -655 -104 -292 -129 -1077 -1090 -395 -924 -560 -714 264 -318 -986 -832 -1022 -486 -104 -110 -207 -27 -818 -467 -190 883 704 858 -80 1336 1030 449 578 906 335 41 807 1589 866 1463 1058 826 813 337 282 446 627 822 1477 1751 1378 798 1052 767 500 1394 754 273 848 362 -54 -577 -1109 -749 -1329 -490 -1000 -691 -878 -1117 -356 -119 -443 117 412 783 -216 869 -257 -638 -875 -446 -606 517 -112 -976 -1216 -1532 -1148 -928 -1897 -2059 -1159 -633 -237 522 645 376 803 173 456 723 121 181 593 71 44 892 1523 723 750 434 636 1012 860 236 574 -300 148 284 -337 -320 -348 -121 67 -480 -234 -23 -1437 SS 20240617T105547.7Z 8934.455413 122 1 48.73 2 77.85 69.62 140.02 298.32 0.00 1 0.00 1 0 17 3.366e-01 8.656e-03 4.709e-02 2.064e-03 6.074229e-01 1.093770e-03 6.939461e-03 -6.000000e+00 1.957061e-01 232.80 -2.00 3.47 -2.00 320.62 0.00e+00 3.419088e-03 4.409347e-04 1.840858e-03 -6.000000e+00 8.643735e-03 287.68 -2.00 20.00 -2.00 319.94 0.00e+00 4.608 0.002 302.00 328.00 3 1.9778e+00 3.4659e-03 5.6197e-02 -6.0000e+00 4.9156e-01 6.3691e-02 4.4221e-03 3.3129e-02 -6.0000e+00 5.3071e-01 -1.5716e-01 3.9661e-03 1.7272e-02 -6.0000e+00 3.1584e-01 6.1233e-02 1.9715e-03 5.5466e-03 -6.0000e+00 1.3391e-01 4.0301e-04 -6.8661e-04 5.6784e-05 6.9448e-05 -6.0000e+00 8.9762e-03 1.1339e-02 -8.3266e-05 11 8 0 10 0 0 -1.52 22.14 0.52 0.01134 0.00618 114 27 1 5 0 427.400 26.51 20.01 22.14 26.40 4.6 1018.56 -141770 -113730 -116602 -95425 -121102 -133878 -106645 -109033 -62631 -89745 -77967 -86768 -82177 -45210 -54055 -12462 -17591 -13075 -27190 -15536 -22450 -21684 5776 -17361 -13245 -15178 -13091 -13665 -17337 -16031 -12602 -10558 -5479 -6864 -1979 -4402 -8653 -25 -3763 1755 -610 5502 -4425 7987 3124 3030 4780 4143 2104 2337 3017 5792 4606 5537 3350 3344 2760 1217 2013 -923 3712 3725 5414 4144 2358 1356 525 1394 1475 3047 1240 673 667 196 3 -871 -2397 -1752 -3026 -1577 -1730 -1108 -1523 -1601 -888 -1124 -362 46 256 564 587 823 -740 -209 -824 -381 -59 610 -180 -881 -262 -1151 -1012 -234 -1123 -1549 -588 -435 -11 487 347 341 272 171 303 419 271 205 20 161 -140 582 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