File name: Pandora32s1_GreenbeltMD_20240416_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240417T051323.0Z 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_20240416_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: 20240416 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 20240416T110053.9Z 8872.458957 121 1 48.59 2 84.68 80.94 116.36 345.23 0.00 1 0.00 1 0 17 5.323e-01 5.222e-02 2.557e-01 3.138e-02 1.192652e+00 1.801976e-02 1.406984e-02 -6.000000e+00 3.048744e-01 228.91 -2.00 3.47 -2.00 321.64 0.00e+00 -3.118205e-02 4.160838e-03 3.484980e-03 -6.000000e+00 1.330678e-02 281.38 -2.00 20.00 -2.00 320.93 0.00e+00 9.373 0.014 302.00 328.00 3 3.1080e-01 5.4357e-02 1.2107e-01 -6.0000e+00 7.6013e-01 2.6522e+00 6.3582e-02 1.0019e-01 -6.0000e+00 8.2417e-01 -2.7982e+00 3.5322e-02 2.9088e-02 -6.0000e+00 4.9022e-01 9.2564e-01 2.0576e-02 2.7501e-02 -6.0000e+00 2.0813e-01 8.5823e-06 1.1631e-03 7.1741e-04 3.5396e-04 -6.0000e+00 1.4184e-02 1.3383e-02 -1.5793e-04 12 8 8 10 0 0 39.18 21.47 2.49 0.01338 0.02212 21 5 1 5 0 2313.500 26.00 20.00 21.47 18.12 4.5 974.83 100494 66596 25823 86708 -34081 6160 99421 -7178 4382 6360 1207 -25970 39496 26888 60544 110438 -1436 64810 -21069 400705 -42873 -30256 107565 -21445 63413 2183 53612 -1968 -46722 -36939 -69176 -29129 192344 5102 -16085 -53505 32127 -38570 -26586 113575 49072 35581 24498 26194 -10323 -9083 28353 50123 67207 15137 -15596 931 78308 155160 4310 42168 16153 13789 21642 -8336 62788 -47579 -2048 -31483 -2310 28771 -2239 71943 1665 93444 14600 -5153 14684 44024 6187 -41067 -18345 -8146 20498 -7011 -13610 32020 -1246 35016 29517 23025 -3042 -1372 606 -79 758 39162 7400 -551 -5939 8875 -2519 20518 1731 5444 3433 -8832 -6114 -19726 -3161 7121 -3096 3114 5108 8 -816 764 2877 -2351 6204 -3476 -1823 -4508 197 3654 -1549 -1236 -2492 2345 -899 -809 3475 -2183 502 -1073 4656 -2499 -2654 -797 4433 1155 -2203 -3304 1320 816 2122 432 -103 10623 9263 4669 6754 -6731 703 4702 -1138 695 1044 208 -5852 4724 3740 6232 7066 -276 6130 -4396 12261 -8945 -4966 4488 -3758 5468 358 4772 -246 -7278 -4727 -13085 -4133 5886 554 -1924 -8335 2145 -6008 -4511 5687 5187 4355 3135 2915 -1436 -1112 2429 3374 3907 1575 -2213 137 5751 5697 765 5419 2768 2321 2980 -1326 4419 -10191 -307 -7129 -417 3786 -404 6604 346 8864 3306 -1451 3235 6466 1136 -10304 -3368 -1396 3011 -1630 -4040 7055 -431 9000 8400 7257 -1275 -567 237 -29 257 8628 2265 -201 -2690 4155 -1565 11803 1340 4148 2500 -6378 -3761 -13400 -1925 4140 -2103 2163 3986 8 -952 989 3882 -3094 8107 -4893 -2543 -6745 295 5366 -2294 -1695 -3271 2870 -1114 -978 3956 -2852 767 -1834 8717 -5617 -6557 -2124 12220 3489 -7022 -10718 4035 2372 5543 1039 -236 SS 20240416T111308.4Z 8872.467459 124 1 48.85 2 82.32 82.82 116.91 348.17 0.00 1 0.00 1 0 17 4.635e-01 2.184e-02 1.486e-01 5.235e-03 1.070989e+00 2.967338e-03 1.157181e-02 -6.000000e+00 2.656102e-01 228.91 -2.00 3.47 -2.00 322.19 0.00e+00 4.444246e-03 1.685270e-03 1.378548e-03 -6.000000e+00 1.159172e-02 281.38 -2.00 20.00 -2.00 321.75 0.00e+00 6.959 0.006 302.00 328.00 3 4.7858e-01 1.1431e-02 9.0889e-02 -6.0000e+00 6.6224e-01 1.2560e+00 1.5384e-02 6.0993e-02 -6.0000e+00 7.1790e-01 -1.6956e+00 1.3439e-02 3.1353e-02 -6.0000e+00 4.2701e-01 6.8148e-01 6.2788e-03 1.1695e-02 -6.0000e+00 1.8140e-01 1.0001e-04 -1.5824e-03 1.2376e-04 1.5579e-04 -6.0000e+00 1.2348e-02 1.1170e-02 -1.0776e-04 12 8 8 10 0 0 34.77 21.49 0.71 0.01117 -0.00072 96 23 1 5 0 508.810 26.00 19.99 21.49 18.78 4.5 979.12 -80102 -87223 -39037 -99374 -98438 -120375 -103465 -65947 -139357 -98417 -172373 -148578 -108045 -91103 210318 -49748 -40948 -32277 -17347 -161 -60204 -28885 15173 -52821 -25689 -29235 55264 -35135 -20956 -79330 -8422 -14074 55652 45312 8170 33107 -17338 26962 2290 56688 69549 33014 7464 51059 40615 49996 27676 83878 13062 26497 25710 52638 53772 47796 58328 31918 37491 25946 30799 28478 23403 23432 22935 36121 26280 19838 30773 24218 17745 21152 18224 15484 16899 15473 5282 6136 -4100 -2060 -1945 1103 3830 4238 2682 3021 5179 3201 2357 2836 -66 1714 204 1609 -3716 -5096 -2494 -4369 -3274 -1999 -2952 -2898 -2688 -2924 -4513 -2825 -3465 -3818 -1818 -2467 -1676 -1762 -1009 -940 -794 -154 -875 -182 -428 -310 313 813 1714 1936 2432 2268 1620 2554 1189 1579 243 650 608 -94 571 164 629 119 269 -143 -140 -114 -127 -1065 -2248 -1636 -2186 -616 -2629 -2147 -2794 -1921 -857 -3881 -1827 -6640 -4827 -2909 -2706 1074 -1501 -1273 -989 -523 -4 -2375 -841 271 -1915 -734 -866 677 -987 -481 -3443 -219 -489 1137 1110 275 794 -690 771 99 1679 2024 1466 438 1929 1659 1838 1286 2312 780 1502 1641 2902 3239 3319 3871 2852 3216 2437 2579 2268 1912 2046 2318 3744 3354 2775 3896 3450 2718 3613 3561 3241 3412 2916 973 1074 -735 -374 -371 252 1038 1351 985 1189 2106 1397 1082 1330 -32 777 88 647 -1556 -2309 -1285 -2784 -2283 -1633 -2774 -2847 -2516 -2433 -3327 -2115 -2739 -2958 -1460 -2163 -1649 -2045 -1365 -1320 -1180 -231 -1288 -259 -613 -464 491 1307 2655 2802 3571 3235 2266 3441 1580 2198 371 1186 1281 -206 1342 420 1729 325 747 -400 -389 -324 -331 -2531 -5043 SS 20240416T113113.5Z 8872.480017 129 1 48.54 2 78.82 85.61 117.52 352.58 0.00 1 0.00 1 0 17 6.595e-01 1.254e-02 5.652e-02 1.540e-03 8.205082e-01 8.321390e-04 9.188353e-03 -6.000000e+00 3.779568e-01 228.92 -2.00 3.47 -2.00 321.24 0.00e+00 5.263496e-03 4.036055e-04 2.518830e-03 -6.000000e+00 1.649422e-02 281.39 -2.00 20.00 -2.00 320.73 0.00e+00 4.978 0.002 302.00 328.00 3 7.4533e-01 2.8060e-03 6.6260e-02 -6.0000e+00 9.4236e-01 2.3524e-01 3.9540e-03 4.4896e-02 -6.0000e+00 1.0215e+00 -3.2136e-01 4.0985e-03 2.5821e-02 -6.0000e+00 6.0761e-01 1.2848e-01 1.9375e-03 9.9152e-03 -6.0000e+00 2.5814e-01 7.1740e-04 -8.2034e-04 3.8839e-05 1.2631e-04 -6.0000e+00 1.7570e-02 1.0880e-02 -9.8285e-05 12 8 8 10 0 0 99.47 21.53 0.36 0.01088 0.00472 288 68 1 5 0 168.500 26.11 20.00 21.53 19.76 4.5 983.81 -229295 -250412 -123411 -232824 -183870 -235379 -222442 -172180 -227527 -149307 -220823 -149963 -147046 -142918 -47551 -105324 -54806 -79348 -36755 -47836 -56375 -28629 -60571 -21448 -51322 -49080 -20678 -56555 -25625 -57418 -18659 -25927 -632 468 -19161 -890 -22487 -381 -7898 3594 13573 704 9156 3424 15381 11004 6651 16545 3766 9152 7099 11077 11261 8453 10597 5038 9459 3422 4056 4948 3493 9035 5948 8672 5790 5009 6298 2436 5214 3409 4381 2561 1443 2266 -433 518 -2588 -1621 -2688 -1177 381 -1242 -1414 -2288 -1129 -904 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