File name: Pandora32s1_GreenbeltMD_20240521_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240522T051234.3Z 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_20240521_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: 20240521 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 20240521T103450.2Z 8907.440859 173 1 42.87 2 82.76 69.65 114.48 269.07 0.00 1 0.00 1 0 17 4.359e-01 2.511e-02 2.615e-01 1.370e-02 9.165278e-01 7.649615e-03 1.014997e-02 -6.000000e+00 2.522763e-01 231.52 -2.00 3.47 -2.00 321.98 0.00e+00 -4.735290e-03 3.862168e-03 5.831092e-03 -6.000000e+00 1.107154e-02 285.05 -2.00 20.00 -2.00 321.47 0.00e+00 7.314 0.007 302.00 328.00 3 1.7868e+00 2.8456e-02 9.4659e-02 -6.0000e+00 6.3220e-01 1.2230e+00 3.5163e-02 6.8792e-02 -6.0000e+00 6.8353e-01 -1.6642e+00 2.5629e-02 2.6640e-02 -6.0000e+00 4.0658e-01 6.6829e-01 1.2653e-02 8.8958e-03 -6.0000e+00 1.7241e-01 2.4073e-05 -8.6335e-04 3.5277e-04 1.0779e-04 -6.0000e+00 1.1622e-02 9.0432e-03 -1.5835e-04 12 9 9 12 9 1 64.54 21.66 1.11 0.00904 0.00256 17 5 1 5 0 2381.530 26.21 20.00 21.66 21.29 4.5 991.84 13811 -24793 -14614 -56536 -55180 -11933 -28804 286542 -16246 -85531 54032 -77092 -15397 -27519 39929 16858 -14617 72662 -5417 186697 -24151 -44045 6504 -34040 39597 2121 139458 -56955 38974 -55903 -23987 -41086 122926 2124 -30918 47862 -49392 25126 -17372 81639 73797 24707 105192 24411 28594 29017 48763 76825 12553 49780 1360 52230 26175 40316 33295 15554 9453 9430 36148 48149 6942 22139 7649 13729 23614 17205 14367 21097 17109 22419 13037 7875 6277 19162 -2676 -3413 -12750 -8608 -2452 -3885 -5608 1211 1047 3111 5114 -1460 5880 -1611 -1851 -590 -2222 11794 -1063 -11242 -4015 -3658 -4703 -1162 694 -670 -4058 -3109 -7099 -6641 -2546 -2979 -2652 381 112 -731 -1285 400 361 -974 29 -211 -1119 -1072 1526 -205 1766 2643 4219 1917 377 600 497 1944 75 1115 285 -809 -924 502 1136 660 -116 -1277 704 588 -161 -721 -2378 369 -1054 -550 -2884 -2278 -275 -770 3828 -434 -4674 794 -3932 -486 -1170 1120 614 -781 1844 -276 2494 -1379 -2835 269 -2026 1322 105 1863 -4413 1041 -3809 -1346 -3238 2135 130 -2478 1598 -4421 1208 -1532 3163 3451 1980 3794 1924 2063 2016 2736 3284 1057 3059 149 3838 2727 3932 3692 2140 1414 1386 3815 4181 881 2544 1144 2201 3722 2896 2457 3495 3246 4642 3292 2188 1744 4352 -676 -761 -2861 -1874 -563 -1090 -1918 452 439 1247 2130 -688 2699 -820 -940 -285 -1023 4884 -489 -5448 -2068 -2230 -3433 -957 631 -640 -3825 -2598 -5492 -4952 -1935 -2431 -2280 343 113 -860 -1751 593 560 -1529 44 -308 -1652 -1653 2429 -346 2879 4061 6072 2745 533 821 660 2652 119 1902 557 -1749 -2143 1238 3000 1857 -312 -3500 1882 1636 -418 -1726 -5465 SS 20240521T104537.0Z 8907.448345 176 1 48.60 2 80.79 71.24 116.52 270.68 0.00 1 0.00 1 0 17 5.531e-01 1.682e-02 1.153e-01 4.135e-03 7.923052e-01 2.266734e-03 9.237040e-03 -6.000000e+00 3.201442e-01 231.52 -2.00 3.47 -2.00 321.51 0.00e+00 4.279524e-03 1.174245e-03 5.326093e-03 -6.000000e+00 1.404921e-02 285.05 -2.00 20.00 -2.00 320.96 0.00e+00 5.929 0.004 302.00 328.00 3 1.6452e+00 8.0831e-03 7.6520e-02 -6.0000e+00 8.0228e-01 4.1333e-01 1.1069e-02 5.3062e-02 -6.0000e+00 8.6735e-01 -6.2567e-01 1.0408e-02 2.6536e-02 -6.0000e+00 5.1593e-01 2.5906e-01 4.8670e-03 7.2623e-03 -6.0000e+00 2.1882e-01 1.2688e-04 -9.8565e-04 1.0825e-04 1.3611e-04 -6.0000e+00 1.4745e-02 9.0330e-03 -1.0612e-04 12 8 8 10 0 0 82.95 21.67 0.71 0.00903 0.00163 58 14 1 5 0 837.860 26.21 19.96 21.67 22.06 4.5 995.78 -199878 -95204 -172938 -125962 -196253 -185707 -126526 -180898 -141373 -173578 -175446 -196018 -98240 -105138 -89090 -10913 -87228 -35241 -27180 32150 -42048 -66604 -10986 -57514 2521 -48252 12585 -36968 -67215 -59773 -40222 -17762 84822 -9533 -3795 -19559 -9334 -3933 15041 30973 15861 29867 -5436 32146 23452 26808 21074 18329 12362 1542 9786 27230 20703 21066 10674 19103 12860 15299 12581 8163 15367 5485 10505 9354 9824 7826 9525 10151 5084 8449 4330 4532 4083 4002 -196 -3052 -1334 -2688 -2790 -434 -215 321 -3361 -782 553 -565 12 -883 190 -651 -488 1423 -1694 -1882 -2558 -1412 -1866 -25 -569 -1655 -558 -2345 -2484 -2247 -2132 -2222 -1429 -1350 -669 -68 -363 232 366 51 214 -509 249 213 910 366 67 1387 1995 1486 1041 999 1129 737 112 271 619 117 -370 106 -67 212 103 -89 208 -462 -226 -818 -789 -3810 -768 -3296 -1478 -4172 -3267 -1377 -3382 -2166 -3563 -3794 -5676 -1466 -2204 -2048 -141 -2526 -739 -570 389 -1085 -2148 -204 -1809 47 -1556 223 -1043 -2493 -2169 -1427 -623 1265 -404 -148 -852 -384 -178 685 1449 985 1746 -432 1983 1589 1784 1521 1412 1067 145 940 2734 2239 2479 1491 2563 1895 2198 1794 1173 2067 883 1841 1906 2182 1787 2109 2300 1329 2472 1481 1635 1476 1369 -64 -909 -360 -738 -855 -156 -92 159 -1780 -433 321 -354 8 -607 130 -436 -306 821 -970 -1109 -1706 -1096 -1715 -24 -621 -1891 -601 -2310 -2376 -2084 -2100 -2341 -1455 -1474 -799 -92 -520 360 585 81 323 -743 359 322 1447 612 112 2190 2987 2335 1590 1474 1605 1081 174 486 1243 238 -804 245 -158 524 261 -229 536 -1156 -527 -1898 -1739 SS 20240521T105600.2Z 8907.455557 181 1 48.71 2 78.87 72.76 118.49 272.25 0.00 1 0.00 1 0 17 4.748e-01 9.600e-03 5.747e-02 2.067e-03 6.890781e-01 1.111632e-03 7.855663e-03 -6.000000e+00 2.748733e-01 231.52 -2.00 3.47 -2.00 320.91 0.00e+00 3.404262e-03 4.919635e-04 2.095486e-03 -6.000000e+00 1.206216e-02 285.05 -2.00 20.00 -2.00 320.30 0.00e+00 4.996 0.002 302.00 328.00 3 1.4868e+00 3.6207e-03 6.2061e-02 -6.0000e+00 6.8883e-01 1.1352e-01 4.8174e-03 3.8016e-02 -6.0000e+00 7.4467e-01 -1.9291e-01 4.6433e-03 2.0278e-02 -6.0000e+00 4.4296e-01 7.7053e-02 2.2513e-03 6.6505e-03 -6.0000e+00 1.8789e-01 4.0859e-04 -6.6902e-04 5.5067e-05 8.6900e-05 -6.0000e+00 1.2658e-02 8.5630e-03 -9.7815e-05 12 8 8 10 0 0 83.43 21.70 0.40 0.00856 0.00354 132 31 1 5 0 369.000 26.21 20.00 21.70 22.99 4.6 1002.35 -180805 -167775 -141452 -150035 -156367 -176195 -128121 -142742 -130933 -138734 -123688 -133798 -108206 -77366 -71598 -52679 -50436 -33603 -12790 -24049 -26136 -50540 -22596 -31055 -19755 -23048 -29097 -29464 -36316 -30619 -15548 -7754 11455 -5482 -9329 -13622 -12386 -8687 -4120 4966 4695 5827 -1885 8188 8560 5219 4729 8116 4690 1503 6498 7894 6670 5339 4369 4302 3942 1662 4647 2455 3246 3397 5081 5414 2715 2161 1885 2256 1562 2881 1634 1225 1274 278 -314 -1361 -2463 -2082 -3268 -1463 -1150 -1351 -2179 -1447 -284 -1040 -14 296 565 827 370 910 -903 -764 -1341 -341 27 576 -212 -669 -513 -986 -1214 -521 -1516 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