File name: Pandora32s1_GreenbeltMD_20240430_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240501T051357.6Z 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_20240430_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: 20240430 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 20240430T105405.2Z 8886.454227 169 1 47.89 2 82.61 76.66 65.72 184.89 0.00 1 0.00 1 0 25 4.444e-01 2.334e-02 2.325e-01 9.818e-03 8.593422e-01 5.489445e-03 9.585767e-03 -6.000000e+00 2.558042e-01 230.02 -2.00 3.47 -2.00 321.97 0.00e+00 5.951929e-03 2.991410e-03 2.133777e-03 -6.000000e+00 1.118578e-02 282.87 -2.00 20.00 -2.00 321.48 0.00e+00 7.195 0.006 302.00 328.00 3 1.5991e+00 2.0842e-02 8.5298e-02 -6.0000e+00 6.3917e-01 8.9134e-01 2.7061e-02 4.7179e-02 -6.0000e+00 6.9206e-01 -1.2629e+00 2.2498e-02 2.4862e-02 -6.0000e+00 4.1164e-01 5.2259e-01 1.0613e-02 9.0196e-03 -6.0000e+00 1.7476e-01 3.5709e-05 -1.7331e-03 2.6056e-04 1.4474e-04 -6.0000e+00 1.1842e-02 9.5940e-03 -8.3742e-05 12 8 8 10 0 0 81.45 21.96 0.77 0.00959 -0.00343 32 8 1 5 0 1496.250 26.41 20.00 21.96 23.77 4.5 1006.74 -92706 -111828 -33947 -96178 -70160 -134581 -108532 -90099 -134352 -92483 -146351 -141631 48064 -7994 -39366 -49381 -13234 -6108 67840 207041 -47962 -36913 28406 -28663 -30493 -10430 59698 -21595 -29791 -57891 27537 -10374 17588 13358 -1996 40458 14694 43597 -3730 68079 63491 26668 51044 81424 34666 34586 37391 104514 43123 9940 11883 66950 37985 49029 27904 21862 40921 13837 26450 15394 29655 18429 12131 31493 7214 10247 10393 21742 17060 16680 10753 1530 9657 9463 2417 -1409 -6314 3644 -5576 -2815 3432 4539 916 -33 789 949 -2014 3487 374 3598 3150 4744 -8470 -5402 -6736 -5389 -1251 772 -2467 -2822 -2091 -2534 -4319 -4704 -4880 -2068 -1577 -1847 -1131 -2263 -1 -666 1188 211 710 -63 -2151 -412 -191 1330 1015 578 3306 1085 2364 1894 2896 1456 148 606 1586 -560 -818 1106 1013 525 203 -1326 83 -391 -182 -639 -1796 -2421 -4088 -591 -2930 -1405 -4451 -2645 -1882 -4561 -2093 -5605 -5424 460 -138 -1062 -1762 -369 -170 1039 1982 -2087 -1349 571 -1043 -1168 -330 915 -703 -998 -2660 633 -427 640 550 -92 1123 535 1336 -218 2281 2492 1609 2492 2962 1991 1987 2112 3102 2477 847 1092 3974 3310 4131 3072 2398 4153 1650 2912 1798 2981 2223 1615 4372 1275 1775 1773 3406 3059 3455 2639 433 2496 2298 568 -304 -1313 691 -1301 -772 1063 1624 382 -15 375 478 -1101 1867 207 1873 1549 2156 -4247 -2718 -3893 -3649 -966 628 -2343 -2803 -1974 -2158 -3631 -3824 -4210 -1857 -1491 -1729 -1167 -2720 -1 -998 1820 325 1051 -90 -3156 -621 -305 2188 1662 908 4814 1569 3277 2557 3745 1971 231 1107 2999 -1182 -1847 2631 2595 1434 571 -3555 237 -1080 -466 -1516 -4064 SS 20240430T110422.5Z 8886.461372 172 1 48.66 2 80.66 78.21 65.91 187.34 0.00 1 0.00 1 0 17 5.710e-01 1.341e-02 7.007e-02 2.513e-03 7.452751e-01 1.356897e-03 8.379906e-03 -6.000000e+00 3.286264e-01 230.02 -2.00 3.47 -2.00 321.32 0.00e+00 5.002517e-03 6.684461e-04 2.490622e-03 -6.000000e+00 1.437044e-02 282.88 -2.00 20.00 -2.00 320.78 0.00e+00 5.861 0.003 302.00 328.00 3 9.1813e-01 4.6566e-03 7.0769e-02 -6.0000e+00 8.2113e-01 2.4782e-01 6.3931e-03 4.1358e-02 -6.0000e+00 8.8911e-01 -3.9254e-01 6.2940e-03 2.3039e-02 -6.0000e+00 5.2884e-01 1.6242e-01 2.9750e-03 8.3898e-03 -6.0000e+00 2.2451e-01 3.0234e-04 -1.0204e-03 6.6408e-05 1.1116e-04 -6.0000e+00 1.5216e-02 9.5467e-03 -1.1152e-04 12 8 8 10 0 0 36.27 21.97 0.50 0.00955 0.00188 135 32 1 5 0 360.440 26.41 20.00 21.97 24.43 4.5 1010.46 -187501 -183177 -171527 -128266 -205361 -172916 -201114 -196122 -160731 -182134 -127902 -178978 -112685 -126795 -80212 -49957 -88455 -22222 -67182 -4240 -53043 -42828 -18724 -58492 -20166 -52563 -13748 -37077 -31258 -20259 -33055 -5996 -8307 2277 -13425 -11037 11792 -6763 11016 6893 13933 14844 -1647 25502 8868 14523 7013 17605 9337 3001 13610 10710 16616 13346 12737 11462 5623 8311 3194 7434 5342 5177 9287 7406 7181 4929 5411 4679 2694 5665 3121 3106 2351 1231 1117 -617 -1568 -3175 -1970 -2309 -1900 -480 -2005 -944 -1683 -562 -395 243 577 373 441 -169 -858 -2181 -1462 -1171 -1192 172 -420 -839 -700 -1454 -1173 -941 -1411 -2329 -1107 -802 -266 290 22 414 37 250 43 48 258 -341 41 257 83 1112 1262 1118 441 707 277 768 377 352 628 -71 -226 216 163 -125 -129 110 20 -52 -114 -547 -897 -2390 -2739 -2522 -1226 -3876 -2204 -3500 -3605 -2324 -3527 -1505 -3860 -1574 -2704 -1396 -796 -2406 -349 -1811 -64 -1352 -976 -340 -1692 -430 -1636 -297 -991 -774 -477 -1053 -181 -305 84 -569 -438 393 -317 529 417 902 1037 -131 1756 732 1160 622 1463 809 298 1349 1238 2014 1829 1882 1795 966 1394 548 1188 883 933 1842 1719 1827 1291 1386 1240 797 1884 1097 1156 883 444 402 -202 -478 -986 -671 -945 -848 -245 -1162 -580 -1109 -391 -290 184 438 276 307 -111 -542 -1427 -1062 -917 -1096 182 -462 -957 -818 -1540 -1113 -868 -1393 -2481 -1229 -950 -319 393 34 641 60 391 65 73 392 -546 64 424 137 1746 2026 1742 669 1033 392 1108 615 619 1229 -142 -477 484 370 -301 -319 275 50 -128 -261 -1243 -1951 SS 20240430T111356.1Z 8886.468010 177 1 48.61 2 78.84 79.65 66.15 189.61 0.00 1 0.00 1 0 17 4.014e-01 8.094e-03 6.540e-02 1.992e-03 6.562493e-01 1.057935e-03 7.414301e-03 -6.000000e+00 2.310591e-01 230.02 -2.00 3.47 -2.00 320.84 0.00e+00 3.652479e-03 4.540969e-04 1.486934e-03 -6.000000e+00 1.010314e-02 282.88 -2.00 20.00 -2.00 320.26 0.00e+00 4.985 0.002 302.00 328.00 3 1.4523e+00 3.3815e-03 6.0461e-02 -6.0000e+00 5.7734e-01 7.1097e-02 4.4795e-03 3.5295e-02 -6.0000e+00 6.2508e-01 -1.2133e-01 4.4039e-03 1.9283e-02 -6.0000e+00 3.7180e-01 4.5716e-02 2.1518e-03 7.0655e-03 -6.0000e+00 1.5788e-01 4.4526e-04 -5.3375e-04 5.4041e-05 8.2930e-05 -6.0000e+00 1.0695e-02 8.9351e-03 -6.7127e-05 11 8 0 10 0 0 99.22 22.01 0.35 0.00894 0.00492 155 36 1 5 0 313.560 26.41 20.00 22.01 25.13 4.5 1013.96 -154199 -76167 -136187 -113651 -166229 -140854 -111044 -123207 -73222 -136595 -113204 -126402 -98882 -67086 -60976 -7444 -54607 -37066 -37475 -23929 -13050 -25981 4588 -32451 -30618 -20389 -14195 -5096 -28582 -16737 -16863 -10087 -4517 -7626 -3673 -6695 -5397 -11497 -3242 7620 -924 3531 -3906 7975 4005 1584 5958 5718 6450 31 3623 5498 5581 6720 3513 4968 1390 1488 1437 1035 3457 2665 4822 3919 2004 1209 1231 1932 1215 2074 759 726 1116 35 449 -1785 -1414 -2727 -2720 -848 -1300 -568 -2108 -1248 -789 -445 -198 91 778 511 340 685 -824 -517 -473 -114 -253 385 -30 -532 -108 -1192 -876 -258 -987 -1077 -1098 -235 -79 597 508 417 379 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