File name: Pandora32s1_GreenbeltMD_20240702_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240703T052122.0Z 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_20240702_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: 20240702 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 20240702T103222.1Z 8949.439144 145 1 48.73 2 82.89 66.10 47.06 94.54 0.00 1 0.00 1 0 17 2.738e-01 2.364e-02 1.303e-01 9.024e-03 9.084987e-01 5.005534e-03 1.014301e-02 -6.000000e+00 1.590888e-01 232.73 -2.00 3.47 -2.00 322.01 0.00e+00 3.550721e-03 2.576938e-03 2.357169e-03 -6.000000e+00 7.070586e-03 289.07 -2.00 20.00 -2.00 321.46 0.00e+00 7.417 0.007 302.00 328.00 3 1.0884e+00 1.8822e-02 8.8351e-02 -6.0000e+00 3.9932e-01 1.2429e+00 2.3458e-02 4.8750e-02 -6.0000e+00 4.3112e-01 -1.6831e+00 1.6249e-02 2.4451e-02 -6.0000e+00 2.5681e-01 6.7409e-01 8.0365e-03 7.4066e-03 -6.0000e+00 1.0898e-01 4.3390e-05 -1.6104e-03 2.3016e-04 1.1544e-04 -6.0000e+00 7.3040e-03 1.3128e-02 -1.5523e-04 12 8 8 10 0 0 44.23 21.72 1.20 0.01313 0.00103 43 10 1 5 0 1132.970 26.21 19.98 21.72 21.53 4.7 990.74 -28984 -15079 14497 -26203 -72113 -85584 -32848 -49591 -89516 -4178 -96950 -92460 4925 -35611 2164 23770 3329 826 29338 38633 -9494 -19823 32387 -1026 -18290 -25378 48899 -23931 46764 -58819 -1980 -35235 47676 -1761 9632 24277 -44634 -3467 -6296 55346 23424 55949 45234 41295 80899 12992 40299 52710 20383 4896 13986 46932 21182 52706 40613 26443 29808 13396 21283 12627 13715 15580 19808 26136 13513 13379 15559 13137 24186 17704 16477 12006 16454 14196 3752 1047 -3732 -1099 -10369 -5221 -1247 1567 2748 1038 4448 -3038 -2652 2432 2372 3338 -477 4828 -6083 -7027 -4006 -1530 -1504 -2898 -3349 -3930 -2445 -3197 -5046 -3381 -6640 -2960 -1829 -729 -368 -1866 -998 -985 339 -176 704 69 -437 -652 641 -30 432 2396 4190 1243 1809 911 996 1189 705 1593 610 231 625 993 -308 95 329 -623 -413 307 -630 -165 -2278 -1206 -603 429 -1048 -3750 -4314 -920 -1666 -4584 -90 -5119 -4808 126 -1539 78 799 149 40 1188 1394 -526 -1117 1026 -46 -998 -1474 1291 -1200 1070 -3934 -87 -2605 1762 -113 517 1026 -3771 -217 -477 2630 1690 3053 2787 2617 3346 1041 2447 2876 1597 474 1354 3635 2312 4499 4110 3165 3489 1804 2491 1511 1593 1892 2615 3703 2367 2355 2643 2359 4257 3817 3988 3170 4084 3348 878 221 -759 -220 -2573 -1489 -410 585 1137 425 1865 -1453 -1326 1191 1159 1563 -217 2159 -2950 -3593 -2064 -917 -1072 -2458 -3221 -3949 -2310 -2724 -3892 -2478 -5333 -2452 -1585 -675 -379 -2259 -1380 -1382 490 -255 981 103 -653 -937 966 -47 673 3795 6205 1843 2593 1278 1355 1680 1154 2784 1224 509 1469 2507 -785 254 905 -1748 -1153 819 -1572 -408 -5424 SS 20240702T104305.2Z 8949.446587 148 1 48.70 2 80.97 67.67 45.02 96.31 0.00 1 0.00 1 0 17 5.537e-01 1.605e-02 7.004e-02 2.962e-03 7.844370e-01 1.626668e-03 9.056503e-03 -6.000000e+00 3.218042e-01 232.73 -2.00 3.47 -2.00 321.50 0.00e+00 5.853694e-03 8.546114e-04 3.980841e-03 -6.000000e+00 1.430195e-02 289.07 -2.00 20.00 -2.00 320.90 0.00e+00 6.035 0.004 302.00 328.00 3 9.0598e-01 5.9227e-03 7.4770e-02 -6.0000e+00 8.0775e-01 4.2065e-01 8.0064e-03 4.6328e-02 -6.0000e+00 8.7201e-01 -6.0528e-01 7.1915e-03 2.4368e-02 -6.0000e+00 5.1944e-01 2.4581e-01 3.3768e-03 7.6963e-03 -6.0000e+00 2.2049e-01 2.3982e-04 -1.1587e-03 7.7891e-05 1.3296e-04 -6.0000e+00 1.4771e-02 1.2211e-02 -1.4331e-04 12 8 8 10 0 0 -30.19 21.75 0.63 0.01221 0.00350 122 29 1 5 0 399.100 26.21 19.99 21.75 22.05 4.7 993.43 -186344 -199028 -180625 -176795 -174345 -170990 -154431 -177007 -180112 -159971 -140463 -159337 -91261 -104664 -49725 -70206 -57230 -68908 -28191 -13641 -47380 -41898 -40553 -42611 -46272 -28662 -10803 -40080 -48192 -52138 -20296 -17659 6212 4383 -5533 -6715 -4185 -5614 -1546 24437 17488 16744 -2658 19711 20740 23897 17369 18652 12850 12284 17773 20580 22219 17032 16182 12775 10530 10131 11692 9135 9877 11574 10798 12997 10317 10187 7000 6307 4921 7310 5603 4874 4357 3586 261 -240 -3862 -652 -2499 -1986 -818 -1104 -1735 -2112 -444 -529 -750 -24 -224 31 156 557 -1743 -2566 -2446 -2022 -1373 -674 -930 -1372 -790 -1415 -2437 -1492 -2045 -2080 -1513 -1009 -443 -164 -381 515 300 -79 -33 227 -101 249 477 200 339 996 1555 1042 1395 1188 607 1327 348 661 234 137 222 113 175 -192 -113 8 193 -248 -241 -683 -1110 -3337 -4442 -4017 -3727 -3223 -2815 -2186 -3425 -3954 -3049 -2272 -3405 -1239 -2146 -761 -1622 -1339 -2010 -594 -260 -1286 -1053 -1007 -1145 -1377 -745 -237 -1146 -1461 -1747 -592 -622 205 162 -221 -258 -164 -259 -83 1221 1066 1112 -226 1378 1450 1650 1314 1449 1117 1153 1756 2235 2631 2106 2154 1835 1593 1535 1685 1307 1419 1778 1917 2594 2311 2297 1606 1500 1302 2186 1910 1766 1581 1239 85 -70 -1076 -177 -773 -735 -358 -563 -912 -1193 -263 -334 -501 -16 -155 21 98 327 -1005 -1533 -1642 -1590 -1264 -661 -1025 -1568 -854 -1383 -2336 -1381 -2026 -2204 -1553 -1106 -532 -224 -548 800 480 -125 -50 329 -146 377 763 336 566 1583 2348 1533 2129 1755 870 1945 542 1187 442 281 481 261 409 -476 -289 22 497 -620 -565 -1589 -2468 SS 20240702T105434.4Z 8949.454565 153 1 48.62 2 78.90 69.34 42.85 98.30 0.00 1 0.00 1 0 25 4.379e-01 8.790e-03 3.758e-02 1.399e-03 6.674081e-01 7.489763e-04 7.608514e-03 -6.000000e+00 2.545145e-01 232.73 -2.00 3.47 -2.00 320.81 0.00e+00 3.227667e-03 3.252980e-04 1.803159e-03 -6.000000e+00 1.131127e-02 289.07 -2.00 20.00 -2.00 320.13 0.00e+00 5.006 0.002 302.00 328.00 3 7.7818e-01 2.4515e-03 6.1320e-02 -6.0000e+00 6.3885e-01 9.9375e-02 3.2213e-03 3.6407e-02 -6.0000e+00 6.8965e-01 -1.6176e-01 2.9864e-03 1.8887e-02 -6.0000e+00 4.1081e-01 6.1492e-02 1.4590e-03 5.9673e-03 -6.0000e+00 1.7440e-01 8.4240e-04 -7.3675e-04 3.7630e-05 7.5214e-05 -6.0000e+00 1.1681e-02 1.1921e-02 -1.2860e-04 11 8 0 10 0 0 -5.03 21.77 0.42 0.01192 0.00638 250 59 1 5 0 194.470 26.32 20.00 21.77 22.64 4.7 997.19 -156051 -144077 -150023 -128282 -157076 -146709 -140315 -131702 -119207 -129808 -117367 -126339 -94943 -78059 -58345 -37115 -46793 -32858 -37211 -24844 -31160 -27225 -29012 -28377 -21478 -23417 -15949 -16364 -27497 -25620 -18410 -7487 -8105 -4917 -9248 -5682 -6140 -6409 -4329 1918 2544 5485 100 5634 3780 6253 2456 5513 4830 1813 5729 4929 5235 5764 5469 5009 2507 2822 1390 2416 4542 3126 4087 4071 3453 1915 1716 2015 717 2583 1312 962 185 121 -570 -1073 -1470 -2317 -2404 -873 -1319 -929 -1796 -1791 -943 -767 -407 -103 571 792 546 319 -346 -682 -336 -200 -107 397 -161 -558 -432 -1098 -817 -545 -1145 -1582 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