File name: Pandora32s1_GreenbeltMD_20240701_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240702T051919.1Z 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_20240701_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: 20240701 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 20240701T102017.4Z 8948.430757 162 1 47.80 2 84.93 64.28 42.09 108.02 0.00 1 0.00 1 0 33 2.437e-01 4.133e-02 1.618e-01 2.595e-02 1.027269e+00 1.460637e-02 1.128842e-02 -6.000000e+00 1.417037e-01 232.74 -2.00 3.47 -2.00 321.66 0.00e+00 -1.719764e-02 4.040047e-03 3.297587e-03 -6.000000e+00 6.293694e-03 288.98 -2.00 20.00 -2.00 320.91 0.00e+00 9.703 0.016 302.00 328.00 3 -5.9894e-02 4.5800e-02 1.1500e-01 -6.0000e+00 3.5570e-01 2.2429e+00 5.3593e-02 7.4241e-02 -6.0000e+00 3.8392e-01 -2.4225e+00 2.9264e-02 2.4845e-02 -6.0000e+00 2.2868e-01 8.3827e-01 1.6590e-02 1.7661e-02 -6.0000e+00 9.7125e-02 1.1791e-05 1.6247e-03 6.3903e-04 2.1693e-04 -6.0000e+00 6.4984e-03 9.5022e-03 -7.2582e-05 12 8 8 10 0 0 -10.83 21.74 2.30 0.00950 0.02171 25 6 1 5 0 1911.710 26.21 20.00 21.74 21.91 4.7 992.62 54011 66164 27166 7666 -2748 -44570 20400 6857 -2636 21458 -4292 -39972 6107 20673 39689 114574 -10156 50734 11909 57955 -29449 -21052 16167 -10598 27395 32848 747 -1598 -55746 -55706 -18924 -40931 59282 -26541 11991 -10858 -30951 -6349 -12646 29852 -4470 24690 43557 53192 35264 15263 -8817 53409 19669 4389 -23945 -5347 30363 1262 20252 14661 5075 -6316 15703 -11444 38904 -9276 12358 -5847 24859 -29840 -21871 37381 -2602 61044 14015 -8091 15231 -19554 -11992 -14762 -29138 -11916 -28100 -2050 -7647 22345 -2908 14691 28430 5227 19063 4831 8748 13954 9358 21125 -14177 -4859 4567 17512 -5284 4886 2287 -1083 460 -8057 -6411 -7068 -86 780 -2786 1553 2268 2071 -311 2576 -754 954 152 -986 1388 -501 -1518 -3156 -5041 4358 1877 3346 4751 -1970 344 -5368 -96 2199 -268 -4272 -1619 334 1259 2069 1522 -3115 1761 158 1181 -1165 -267 6834 7307 4000 1129 -348 -7280 1737 726 -327 2123 -533 -7081 731 2330 4018 5799 -1799 4786 1589 4533 -5014 -2954 1525 -1414 2710 3098 89 -165 -8337 -7818 -2003 -6121 3546 -3786 1048 -1074 -3774 -686 -1746 3159 -730 3067 4740 4846 3480 1700 -1183 3785 1991 544 -4302 -880 3765 224 3126 2486 963 -1295 2345 -1998 3840 -1526 1814 -1154 3838 -7854 -5258 5203 -599 8497 3405 -2519 3623 -5988 -2974 -3250 -6784 -2382 -7467 -503 -2361 5938 -1111 5019 8922 2169 7140 2115 3609 5191 3387 6415 -6063 -2029 2011 8066 -3611 3511 1881 -943 372 -6280 -4364 -4723 -57 545 -2129 1230 2014 2159 -385 3448 -996 1244 214 -1370 1900 -732 -2155 -4691 -7434 6067 2551 4378 5987 -2587 431 -7621 -152 3683 -527 -9643 -3859 850 3449 5968 4522 -9797 5239 456 3106 -2871 -622 SS 20240701T103212.6Z 8948.439034 165 1 48.50 2 82.83 66.05 39.93 110.65 0.00 1 0.00 1 0 17 4.128e-01 2.094e-02 9.324e-02 4.685e-03 8.820628e-01 2.617168e-03 1.016840e-02 -6.000000e+00 2.400306e-01 232.74 -2.00 3.47 -2.00 321.94 0.00e+00 6.944469e-03 1.491863e-03 6.231613e-03 -6.000000e+00 1.066123e-02 288.98 -2.00 20.00 -2.00 321.42 0.00e+00 7.371 0.007 302.00 328.00 3 1.5473e-01 1.0345e-02 9.1686e-02 -6.0000e+00 6.0253e-01 9.2660e-01 1.3546e-02 5.8337e-02 -6.0000e+00 6.5034e-01 -1.2693e+00 1.0703e-02 2.8642e-02 -6.0000e+00 3.8737e-01 5.1394e-01 5.0086e-03 8.0688e-03 -6.0000e+00 1.6451e-01 1.2367e-04 -1.3249e-03 1.1960e-04 1.8108e-04 -6.0000e+00 1.1009e-02 9.6436e-03 -1.0134e-04 12 8 8 10 0 0 0.61 21.75 0.74 0.00964 -0.00031 106 25 1 5 0 457.510 26.21 20.01 21.75 22.31 4.7 995.29 -123143 -113748 -102711 -94839 -72485 -149237 -108216 -114893 -130843 -84436 -130683 -140463 -91712 -40316 -57891 -59349 -45089 -15447 13851 67719 -24881 -40211 -36259 -42898 -37327 -2779 -10189 -38175 -42795 -49535 12050 8646 49073 21700 14687 8283 -13850 24666 18623 51803 37003 52113 18481 44848 53741 23442 29515 49838 23108 13479 22261 40332 33571 37814 28190 21117 32182 21707 29212 23806 19080 17285 17472 25484 17551 18905 16016 13668 9260 17423 15640 14416 10851 7372 4812 611 -2175 -856 -2356 2608 2322 184 -2498 -661 2938 -268 -187 200 -231 -461 -1240 1361 -3490 -3683 -4830 -3383 -2565 -1665 -2474 -1735 -2378 -3288 -3802 -3035 -3407 -2914 -2421 -2219 -1572 -903 -513 -294 47 137 -179 -388 -380 159 739 594 893 2116 2173 2390 2294 1200 1065 892 409 964 462 656 179 76 128 -11 178 -35 99 -366 -310 -843 -1916 -3580 -3496 -2943 -2363 -1358 -4773 -2423 -2834 -3587 -1620 -3940 -4941 -2430 -829 -1798 -2250 -1669 -459 323 928 -841 -1488 -1242 -1607 -1364 -72 -279 -1308 -1466 -1901 297 273 1211 763 530 295 -626 856 817 1917 1775 2286 1174 2213 2406 1424 1712 2436 1552 1065 1780 3022 2960 3455 3001 2489 3455 2549 3029 2480 2075 2061 2379 3691 3023 3248 2802 2529 1963 3568 3637 3563 2749 1810 1091 140 -473 -186 -533 681 733 69 -1086 -303 1378 -138 -101 111 -129 -251 -640 643 -1679 -1845 -2787 -2292 -2052 -1421 -2405 -1744 -2299 -2876 -3242 -2478 -2961 -2472 -2163 -2134 -1673 -1101 -716 -418 69 202 -276 -580 -569 247 1123 945 1402 3392 3314 3532 3295 1690 1454 1264 668 1697 928 1436 392 178 325 -31 491 -97 278 -989 -779 -1961 -4258 SS 20240701T104250.9Z 8948.446422 168 1 48.58 2 80.93 67.61 38.03 113.15 0.00 1 0.00 1 0 17 6.021e-01 1.257e-02 5.217e-02 1.862e-03 7.615482e-01 1.019516e-03 8.839665e-03 -6.000000e+00 3.501278e-01 232.74 -2.00 3.47 -2.00 321.31 0.00e+00 4.110957e-03 5.165233e-04 4.113920e-03 -6.000000e+00 1.555128e-02 288.98 -2.00 20.00 -2.00 320.70 0.00e+00 6.012 0.004 302.00 328.00 3 1.5422e-01 3.5942e-03 7.4310e-02 -6.0000e+00 8.7889e-01 2.5979e-01 4.9463e-03 4.6879e-02 -6.0000e+00 9.4865e-01 -3.7756e-01 4.7039e-03 2.3702e-02 -6.0000e+00 5.6506e-01 1.5409e-01 2.2190e-03 6.6860e-03 -6.0000e+00 2.3997e-01 5.4729e-04 -8.7033e-04 4.8395e-05 1.1454e-04 -6.0000e+00 1.6060e-02 9.2301e-03 -1.2096e-04 12 8 8 10 0 0 3.59 21.76 0.47 0.00923 0.00269 242 57 1 5 0 200.720 26.21 20.00 21.76 22.74 4.7 997.25 -210447 -203890 -182480 -197875 -206599 -213854 -171054 -181573 -176973 -154105 -177148 -134720 -133996 -109350 -87546 -82054 -66855 -70831 -57290 -29285 -43086 -49587 -35538 -49435 -44513 -32662 -34055 -29133 -27779 -55291 -31483 -26193 -6883 -12786 -7559 -3415 -15254 1974 -4168 12227 9621 10861 1158 10970 13878 10616 8966 11612 4565 4944 10306 11855 12476 12087 13394 9264 8455 6390 6206 5291 5163 7341 7438 8116 7252 4538 5768 4259 4152 4488 3505 3125 2812 1601 642 -443 -1593 -2326 -2567 -547 229 -1452 -1415 -2014 -865 -543 -459 -95 225 334 -232 -219 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