File name: Pandora32s1_GreenbeltMD_20240717_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240718T052136.0Z 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_20240717_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: 20240717 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 20240717T110736.9Z 8964.463622 95 1 3.29 2 78.05 72.47 146.90 283.14 0.00 1 0.00 1 0 17 4.853e-01 2.506e-02 3.363e-01 1.919e-02 6.061442e-01 1.053348e-02 8.041108e-03 -6.000000e+00 2.884821e-01 232.59 -2.00 3.47 -2.00 320.65 0.00e+00 9.325368e-04 4.330860e-03 6.479970e-03 -6.000000e+00 1.401565e-02 290.29 -2.00 20.00 -2.00 319.94 0.00e+00 4.678 0.002 302.00 328.00 3 2.9792e+00 3.3616e-02 6.5002e-02 -6.0000e+00 7.2566e-01 1.0989e-01 4.2549e-02 5.3759e-02 -6.0000e+00 7.8679e-01 -2.1129e-01 3.6695e-02 1.7646e-02 -6.0000e+00 4.6542e-01 8.5755e-02 1.8297e-02 7.0257e-03 -6.0000e+00 1.9550e-01 1.3685e-04 -7.6193e-04 5.4422e-04 6.6890e-05 -6.0000e+00 1.3500e-02 8.2676e-03 -8.4136e-05 12 9 9 12 1 1 999.00 22.02 0.41 0.00827 0.00254 1 7 1 5 0 1641.170 26.21 20.00 22.02 32.57 4.7 1049.59 -213558 -667 -187306 -4780 900000 900000 145738 900000 -142237 78057 900000 -111247 185179 -115351 900000 900000 -49389 900000 -27887 900000 -23101 46379 131797 -65563 900000 5185 5359 176449 -12884 121460 -32350 40867 -578 -1435 -12980 -44312 157027 -11539 3992 17675 1505 41814 938 33096 -2449 27403 1590 37674 2199 -3300 12453 1626 10750 3714 13894 4769 780 25317 143 4156 -1279 2035 6738 15926 5844 -6658 7873 -2430 865 4862 2064 4718 -5306 -2811 -4218 1612 3481 -2032 6838 -7073 -4279 -2910 1526 1837 -1908 -204 -4890 2611 3374 3054 -3923 2093 -2097 -4595 -4764 -1939 -1124 2297 -379 1151 -1036 -2509 -2596 -3648 402 -3943 -3087 -169 1917 2884 -1057 2379 -1260 390 956 -290 1409 1694 514 -37 1384 1614 731 2478 -1426 2897 -3016 833 177 688 1267 -735 -2091 -193 -514 -769 502 691 -22 -259 106 206 -976 -8046 -12 -7130 -89 900000 900000 2723 900000 -4170 1459 900000 -2976 3460 -4750 900000 900000 -1804 900000 -983 900000 -853 890 2463 -3986 900000 189 199 3297 -536 2269 -1863 1395 -34 -92 -917 -4040 2934 -953 346 1620 182 3761 130 3481 -363 3112 234 4028 338 -560 1986 319 2125 846 3070 1195 210 5488 38 1048 -343 569 2013 4883 2090 -2639 2651 -904 335 2065 996 2345 -2896 -1449 -2059 683 1338 -806 2680 -3605 -2452 -1852 1022 1295 -1466 -164 -4278 2218 2867 2552 -3300 1584 -1566 -3505 -3910 -1742 -1125 2486 -453 1389 -1227 -2784 -2679 -3766 424 -4536 -3670 -206 2441 3950 -1606 3697 -2030 608 1426 -420 2005 2481 793 -60 2225 2544 1129 3690 -2129 4077 -4300 1165 267 1130 2219 -1364 -4041 -384 -1070 -1667 1101 1531 -50 -570 225 420 -1948 SS 20240717T111220.4Z 8964.466903 98 1 2.69 2 77.17 73.15 147.76 284.16 0.00 1 0.00 1 0 17 4.771e-01 2.107e-02 3.565e-01 1.763e-02 5.764426e-01 9.396576e-03 6.536513e-03 -6.000000e+00 2.795256e-01 232.59 -2.00 3.47 -2.00 320.39 0.00e+00 8.800552e-04 3.577744e-03 5.528292e-04 -6.000000e+00 1.322469e-02 290.29 -2.00 20.00 -2.00 319.65 0.00e+00 4.381 0.001 302.00 328.00 3 2.9478e+00 2.9164e-02 5.3220e-02 -6.0000e+00 7.0047e-01 5.7602e-02 3.6822e-02 3.0951e-02 -6.0000e+00 7.5615e-01 -1.0636e-01 3.2172e-02 1.5004e-02 -6.0000e+00 4.4940e-01 3.5965e-02 1.6166e-02 4.7647e-03 -6.0000e+00 1.9131e-01 1.9215e-04 -3.3449e-04 4.9213e-04 4.7096e-05 -6.0000e+00 1.3015e-02 7.2201e-03 -6.0862e-05 12 9 9 12 1 1 999.00 22.03 0.50 0.00722 0.00471 1 8 1 5 0 1343.170 26.32 20.01 22.03 32.66 4.8 1050.87 -202684 62274 -33634 -151433 900000 -98980 900000 -33728 -102211 -79827 -100720 900000 -81881 -53486 -55647 15899 -22485 -44525 105071 317004 44198 46109 21738 106944 37369 60226 30637 -17383 189715 -32049 5689 -16827 52074 39399 19121 16003 314 34610 -26455 14203 -9349 10538 -649 14519 8793 3181 -1312 10442 -3363 21005 3865 10347 -3750 -353 2414 -12500 4637 -3768 7045 397 265 -2152 628 15884 -2391 4335 -2255 -1565 -2686 -3312 6613 2223 9528 -1790 4872 -25 -2723 9546 -10359 1701 943 -3049 -2684 -5547 1334 -1767 -133 63 985 664 3302 3553 -674 -1397 -1606 694 475 452 778 -751 -943 -1342 -1904 2429 -2293 -1321 -1819 -1488 -1123 -736 1923 -190 -331 -1040 152 185 393 2593 -155 311 -2214 131 595 94 2033 -400 1985 6 482 1703 1809 -550 263 557 -276 -787 -132 -264 1182 -1173 158 693 -2004 -7205 1070 -578 -4342 900000 -1701 900000 -580 -2238 -1554 -2505 900000 -2170 -1352 -1770 305 -703 -1872 1806 5448 964 995 607 1838 1066 1481 1027 -896 3261 -1876 262 -1127 2110 1967 1140 950 23 2138 -3519 1553 -1446 1466 -105 2107 1363 527 -230 1671 -630 3293 771 2159 -971 -96 678 -4183 1380 -1217 2033 119 81 -719 228 5581 -1046 1768 -941 -652 -1209 -1690 3433 1260 5121 -1023 2470 -12 -1245 3853 -5275 893 570 -2132 -2033 -4527 1086 -1558 -121 59 924 613 2843 2884 -539 -1121 -1380 651 497 523 968 -961 -1166 -1547 -2056 2526 -2601 -1565 -2244 -1916 -1524 -1071 2947 -309 -542 -1671 233 272 574 3840 -243 509 -3709 213 938 145 3020 -587 2786 9 737 2804 3169 -1019 500 1095 -569 -1693 -289 -584 2605 -2582 333 1405 -4027 SS 20240717T111732.2Z 8964.470512 101 1 16.22 2 76.20 73.90 148.69 285.32 0.00 1 0.00 1 0 25 2.249e-01 8.729e-03 1.243e-01 5.404e-03 5.385664e-01 2.833928e-03 6.237960e-03 -6.000000e+00 1.307567e-01 232.59 -2.00 3.47 -2.00 320.18 0.00e+00 2.970532e-03 9.971094e-04 1.327586e-03 -6.000000e+00 5.842114e-03 290.29 -2.00 20.00 -2.00 319.42 0.00e+00 4.095 0.001 302.00 328.00 3 3.2690e+00 8.5747e-03 4.9800e-02 -6.0000e+00 3.2795e-01 3.6230e-02 1.0565e-02 2.8898e-02 -6.0000e+00 3.5388e-01 -7.0441e-02 8.9510e-03 1.4702e-02 -6.0000e+00 2.1099e-01 2.1506e-02 4.5836e-03 4.6170e-03 -6.0000e+00 8.9793e-02 1.8959e-04 -5.0551e-04 1.5046e-04 5.4754e-05 -6.0000e+00 5.9968e-03 7.6892e-03 -5.3525e-05 12 9 1 12 1 1 97.25 22.05 0.40 0.00769 0.00389 10 8 1 5 0 1474.330 26.32 20.00 22.05 32.92 4.8 1052.47 -101886 -107586 -5444 2849 -118982 -65761 -85283 -95067 -23373 -37717 -4183 -10537 -38574 -41071 -50051 -33795 -15791 -11773 8956 5873 -13617 -20649 27513 -9278 8452 -10392 12424 922 -3657 2426 -7037 6073 9783 -9036 -5199 -6145 -5867 -9555 -979 -5453 -375 -944 1948 5745 5811 3957 2102 438 704 415 5135 3942 2331 1796 -1122 4244 690 1707 410 -264 -235 3026 2292 4706 72 -222 767 748 110 2967 1637 1722 347 -905 538 -1980 -42 -1970 -602 -1477 -3147 -1247 -514 -1709 -381 -1070 4 -169 464 696 1153 810 -929 -604 -237 -791 7 761 275 -503 -669 -953 -777 -355 -1134 -1679 -737 -413 -436 361 537 1020 977 79 73 196 37 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