File name: Pandora32s1_GreenbeltMD_20240415_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240416T051657.7Z 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_20240415_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: 20240415 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 20240415T111202.2Z 8871.466692 110 1 48.75 2 82.80 82.90 115.04 0.39 0.00 1 0.00 1 0 25 4.227e-01 2.631e-02 2.651e-01 1.302e-02 1.049186e+00 7.395069e-03 1.154517e-02 -6.000000e+00 2.432105e-01 228.84 -2.00 3.47 -2.00 322.25 0.00e+00 -2.654472e-03 3.673176e-03 1.070334e-03 -6.000000e+00 1.097760e-02 281.28 -2.00 20.00 -2.00 321.80 0.00e+00 7.351 0.007 302.00 328.00 3 1.5333e+00 2.7389e-02 9.1851e-02 -6.0000e+00 6.0615e-01 1.5865e+00 3.3088e-02 5.5443e-02 -6.0000e+00 6.5802e-01 -2.1541e+00 2.3353e-02 2.7885e-02 -6.0000e+00 3.9106e-01 8.5259e-01 1.2075e-02 8.4005e-03 -6.0000e+00 1.6558e-01 2.4552e-05 -1.6110e-03 3.1881e-04 1.2550e-04 -6.0000e+00 1.1310e-02 9.7714e-03 -6.3321e-05 12 8 8 10 0 0 77.25 21.91 1.05 0.00977 -0.00233 34 8 1 5 0 1433.600 26.41 20.00 21.91 22.97 4.5 1002.34 189645 81791 -13828 1666 -73349 -30329 29343 105568 1728 -58409 -23511 -92658 108709 39813 110774 110267 -930 15961 2996 900000 11983 22609 135617 -53512 77848 31559 900000 -6886 6015 -19346 -53889 235 -23885 31446 16260 340 -5918 -25422 -24799 105062 65946 88238 -2233 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-2761 -4085 64 -3530 665 -3490 -3035 -757 -5181 -5437 -4417 -2284 -1992 -1902 -1735 -3981 -839 -2284 478 744 38 -285 -1954 -2375 -1044 -103 3598 1988 3430 3159 3095 2110 2469 4770 1478 -2704 1372 3584 -2187 1899 537 4260 447 -1858 -3255 1040 1237 173 -2690 -4859 SS 20240415T113711.8Z 8871.484164 121 1 49.74 2 77.92 86.78 114.81 6.32 0.00 1 0.00 1 0 17 5.569e-01 1.483e-02 2.675e-01 6.859e-03 7.420278e-01 4.024489e-03 8.360204e-03 -6.000000e+00 3.356047e-01 228.84 -2.00 3.47 -2.00 321.26 0.00e+00 3.842311e-03 1.990860e-03 2.642518e-03 -6.000000e+00 1.839220e-02 281.28 -2.00 20.00 -2.00 320.74 0.00e+00 4.637 0.002 302.00 328.00 3 4.0148e+00 1.3728e-02 6.1534e-02 -6.0000e+00 8.4387e-01 5.0513e-02 2.0419e-02 4.2515e-02 -6.0000e+00 9.2207e-01 -8.8784e-02 2.2809e-02 2.4237e-02 -6.0000e+00 5.3570e-01 4.0029e-02 1.0702e-02 8.3188e-03 -6.0000e+00 2.2805e-01 4.1932e-05 -9.4110e-04 1.9731e-04 1.0812e-04 -6.0000e+00 1.6400e-02 8.6789e-03 -4.9887e-05 12 9 8 11 32 0 97.68 21.97 0.95 0.00868 0.00161 13 3 1 5 0 3825.520 26.41 20.00 21.97 24.48 4.4 1009.62 900000 -111428 900000 900000 -153042 900000 900000 900000 900000 900000 -191413 -231492 900000 900000 900000 900000 -31202 900000 900000 900000 -10391 900000 900000 900000 900000 137968 900000 900000 900000 290046 271675 76324 -53544 44940 31462 59679 42824 -23441 -3110 28734 -13032 15217 128023 52999 -12946 54276 -50868 41246 34285 40680 480 11484 6011 4092 3089 20 6563 -1444 -2971 8703 19100 -938 6071 3683 -514 2711 2106 5018 -1252 6505 -1437 -3247 99 1897 -3181 -8043 -3329 -3443 1321 -227 1219 3443 1065 -2004 838 -1577 -635 -1672 109 -826 -527 2576 8718 -2439 2305 -378 -386 -818 737 -547 116 -1817 333 -1212 -1800 -2351 77 -840 545 422 -433 781 -320 457 1210 -51 1032 -23 740 -534 -29 428 939 123 75 -290 -970 1653 288 865 -730 -2091 -230 782 732 -331 -811 -867 775 265 393 -166 142 900000 -742 900000 900000 -1019 900000 900000 900000 900000 900000 -2048 -4100 900000 900000 900000 900000 -260 900000 900000 900000 -102 900000 900000 900000 900000 919 900000 900000 900000 1931 1809 712 -2116 772 618 865 780 -948 -127 1056 -826 809 2453 2184 -1025 2327 -6148 2169 2049 2463 47 1161 712 543 445 3 1002 -240 -491 1255 2537 -164 1130 802 -127 658 507 1208 -349 1933 -515 -1250 37 670 -1088 -2598 -953 -989 399 -82 513 1626 570 -1173 507 -1031 -433 -1189 77 -573 -345 1549 4760 -1498 1493 -288 -337 -812 794 -612 124 -1802 295 -1065 -1672 -2320 78 -903 625 535 -610 1160 -490 684 1733 -71 1415 -32 1099 -831 -45 638 1346 173 103 -385 -1257 2132 413 1376 -1280 -3922 -443 1567 1546 -735 -1841 -1985 1759 589 834 -335 275 SS 20240415T114205.4Z 8871.487563 124 1 48.41 2 76.97 87.54 114.71 7.46 0.00 1 0.00 1 0 25 4.075e-01 8.288e-03 7.157e-02 2.176e-03 6.902752e-01 1.149195e-03 7.781503e-03 -6.000000e+00 2.335657e-01 228.84 -2.00 3.47 -2.00 320.75 0.00e+00 5.037964e-03 4.802608e-04 1.204566e-03 -6.000000e+00 1.018983e-02 281.28 -2.00 20.00 -2.00 320.19 0.00e+00 4.322 0.001 302.00 328.00 3 2.2555e+00 3.6043e-03 5.6157e-02 -6.0000e+00 5.8226e-01 1.0802e-01 4.7664e-03 3.6392e-02 -6.0000e+00 6.3114e-01 -1.5490e-01 4.7577e-03 2.0544e-02 -6.0000e+00 3.7541e-01 5.7114e-02 2.3406e-03 8.6819e-03 -6.0000e+00 1.5956e-01 3.4375e-04 -8.3583e-04 5.6860e-05 9.0673e-05 -6.0000e+00 1.0855e-02 8.8194e-03 -6.7765e-05 11 9 0 11 8 0 91.94 21.98 0.39 0.00882 0.00254 90 21 1 5 0 537.840 26.41 20.00 21.98 24.52 4.4 1010.19 -167593 -127536 -122142 -151597 -113591 -151249 -77961 -146337 -121256 -72489 -127624 -95567 -111085 -68168 -63940 -24924 -13144 -25962 -24229 -65221 -41533 -34603 -9794 -4210 -31303 -16840 -13857 -25691 -22188 -28777 -294 -16680 5171 -706 -4952 -3051 -11390 331 -13148 1668 409 2338 -1914 3110 8149 430 5267 4446 2101 1943 581 9254 3740 7300 4743 1270 3301 -375 2497 -400 2724 1815 3034 4518 1197 2369 1652 1947 2254 1778 2287 54 740 188 -777 -1020 -2116 -905 -3146 -852 -790 -886 -1708 -1930 -671 -845 -50 -104 530 1169 293 1339 -1093 -137 -273 -106 276 58 -27 -452 -351 -1061 -550 -143 -1345 -1313 -1073 -705 -19 189 332 146 433 113 -4 382 447 488 19 -30 -317 336 734 177 417 330 310 853 59 316 164 -146 -378 -101 110 -216 25 60 71 -208 -22 -118 -356 -1908 -1206 -1226 -2077 -1085 -1809 -513 -1948 -1427 -631 -1847 -1217 -1886 -1000 -1172 -385 -211 -531 -538 -2328 -1218 -948 -214 -93 -991 -491 -404 -833 -685 -1005 -9 -753 224 -36 -262 -152 -655 20 -1106 147 42 235 -214 343 951 51 614 543 276 273 92 1512 717 1476 1053 305 805 -95 601 -97 648 474 894 1498 412 807 599 717 830 760 1092 28 380 93 -355 -418 -804 -365 -1316 -413 -455 -547 -1183 -1431 -522 -702 -44 -94 478 1018 242 1018 -809 -101 -224 -94 284 65 -33 -579 -427 -1247 -577 -145 -1478 -1539 -1237 -863 -26 264 518 233 699 189 -6 574 665 755 31 -49 -518 557 1158 271 615 497 449 1251 91 528 305 -275 -753 -212 235 -491 59 142 168 -477 -46 -249 -721 SS 20240415T115744.9Z 8871.498436 130 1 48.60 2 73.93 89.98 114.26 11.11 0.00 1 0.00 1 0 25 1.834e-01 5.996e-03 1.932e-02 9.602e-04 5.738877e-01 4.949417e-04 6.542111e-03 -6.000000e+00 1.051600e-01 228.84 -2.00 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