File name: Pandora32s1_GreenbeltMD_20240806_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240807T051955.0Z 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_20240806_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: 20240806 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 20240806T112256.0Z 8984.474260 71 1 48.87 2 77.88 78.50 99.10 68.19 0.00 1 0.00 1 0 25 3.347e-01 1.388e-02 1.818e-01 6.237e-03 5.722043e-01 3.328847e-03 6.653085e-03 -6.000000e+00 1.941487e-01 231.91 -2.00 3.47 -2.00 320.72 0.00e+00 2.599428e-03 1.350128e-03 2.112745e-03 -6.000000e+00 8.712439e-03 290.73 -2.00 20.00 -2.00 320.00 0.00e+00 4.618 0.002 302.00 328.00 3 3.8883e+00 1.0605e-02 5.5387e-02 -6.0000e+00 4.8604e-01 1.4345e-01 1.3445e-02 3.2099e-02 -6.0000e+00 5.2470e-01 -2.6093e-01 1.1444e-02 1.5947e-02 -6.0000e+00 3.1311e-01 1.0608e-01 5.7125e-03 4.4792e-03 -6.0000e+00 1.3350e-01 6.0880e-05 -4.0816e-04 1.7760e-04 6.1344e-05 -6.0000e+00 8.9249e-03 8.4576e-03 -3.2303e-05 12 8 8 10 0 0 37.61 22.07 1.39 0.00846 0.00539 18 4 1 5 0 2714.910 26.21 20.00 22.07 31.47 4.9 1042.91 173480 -49032 -144667 -50829 -56343 -79565 -60472 125677 -87256 -94095 -71036 -114592 39718 -51884 -42354 11099 17482 39605 2685 82833 -38778 -39369 52829 -15602 -7867 -30477 71492 -831 5291 -13602 -25871 24285 -29964 -11017 -10265 9147 -18463 -18563 -4584 3910 10163 2715 11866 22400 4555 9173 1852 22381 1271 10444 3787 16117 392 1952 10318 468 2996 -1726 3653 5774 4735 4791 5376 7982 2660 1934 -1114 -569 -697 2437 -792 749 217 -771 -2085 -1926 -4289 4866 -1727 -2209 -1740 -938 2083 -2767 181 -954 -2881 627 -410 930 1048 4618 -1169 -1388 30 -1711 -2237 2320 -879 -778 -819 -1158 -881 -876 -1129 -1362 -2032 294 -247 73 349 670 320 311 918 273 -334 -129 356 577 -463 226 1188 786 782 -124 -276 1064 -145 620 409 -757 -196 -219 948 507 -73 -473 120 -300 -594 125 -546 1055 -656 -4960 -742 -788 -1307 -846 764 -2017 -2518 -1555 -4112 362 -1483 -1365 250 415 819 87 1260 -2052 -2083 1125 -702 -354 -1817 1565 -36 209 -662 -1605 1078 -2643 -878 -793 556 -1561 -1829 -480 452 1255 390 1631 2848 698 1361 300 2995 216 1690 712 2980 84 448 2311 120 775 -470 921 1392 1170 1277 1602 2599 975 702 -399 -203 -268 1043 -392 387 114 -390 -989 -820 -1705 1722 -702 -1053 -968 -592 1409 -2091 141 -809 -2421 529 -352 767 885 3493 -881 -1043 24 -1474 -2232 2525 -1093 -990 -990 -1273 -881 -866 -1200 -1555 -2457 368 -337 101 535 1089 527 495 1366 387 -474 -189 554 950 -779 368 1847 1188 1232 -190 -405 1556 -219 1043 755 -1503 -404 -443 2024 1152 -171 -1139 290 -709 -1334 262 -1109 SS 20240806T112821.8Z 8984.478030 74 1 49.11 2 76.84 79.31 98.16 69.09 0.00 1 0.00 1 0 17 2.340e-01 1.122e-02 1.033e-01 4.474e-03 5.321333e-01 2.352253e-03 6.153929e-03 -6.000000e+00 1.357038e-01 231.91 -2.00 3.47 -2.00 320.44 0.00e+00 3.134949e-03 8.872312e-04 1.621277e-03 -6.000000e+00 6.089778e-03 290.73 -2.00 20.00 -2.00 319.69 0.00e+00 4.280 0.001 302.00 328.00 3 3.7503e+00 7.3446e-03 5.1117e-02 -6.0000e+00 3.3972e-01 6.6435e-02 9.1340e-03 2.8928e-02 -6.0000e+00 3.6675e-01 -1.6281e-01 7.5980e-03 1.4757e-02 -6.0000e+00 2.1885e-01 6.3063e-02 3.8426e-03 4.5253e-03 -6.0000e+00 9.3309e-02 1.0172e-04 -7.1257e-04 1.2705e-04 5.8268e-05 -6.0000e+00 6.2383e-03 8.5620e-03 -3.2321e-05 12 8 8 10 0 0 16.71 22.08 1.18 0.00856 0.00321 26 6 1 5 0 1888.530 26.32 20.00 22.08 31.67 4.9 1044.21 -31700 -87354 -61411 -56921 -140285 -65226 9918 10713 -64326 -75120 -87939 -92201 13152 -30405 -22844 -24951 -3229 101 -2877 37089 -17711 -11427 21770 -13803 -10350 -1380 25693 -19581 -2192 -27279 -16550 -8629 767 -3453 -9068 -9918 -17990 -15829 -4202 2012 5473 351 4611 8677 5102 5520 7879 16317 1748 2443 -1938 9859 2956 915 4526 1890 1301 253 3586 1998 4555 4060 4533 6987 -296 1280 562 134 1037 2051 1032 408 508 -300 -944 479 -1999 -910 -1522 -427 197 -555 -1404 -2916 -572 -608 -2214 575 562 1046 180 2170 -777 -1409 -949 -923 -1006 674 -431 -947 -653 -1142 -691 -108 -1668 -1526 -518 -101 15 -215 269 589 1043 222 155 397 -564 76 480 504 -176 -51 835 680 572 114 189 440 305 898 282 -436 -668 341 594 23 -50 -324 545 -252 -215 -160 -1034 -332 -1906 -1125 -994 -5142 -1053 78 93 -1347 -1901 -2609 -3017 178 -796 -688 -915 -107 4 -112 1020 -873 -529 731 -705 -551 -71 1031 -1205 -109 -1774 -1083 -614 57 -294 -799 -844 -1751 -1754 -506 274 819 54 719 1339 908 904 1406 2713 313 452 -405 2034 715 244 1233 550 393 78 1043 578 1308 1264 1577 2653 -128 537 226 54 443 994 567 239 300 -172 -505 228 -887 -387 -695 -224 120 -356 -1002 -2249 -459 -523 -2058 541 534 964 157 1723 -594 -1071 -776 -860 -1077 746 -533 -1204 -788 -1256 -750 -115 -1941 -1754 -620 -127 20 -323 410 950 1685 348 246 595 -843 118 731 814 -290 -82 1289 1097 887 170 270 631 480 1462 505 -833 -1330 662 1226 50 -113 -754 1267 -577 -468 -329 -2066 SS 20240806T113412.6Z 8984.482091 77 1 47.86 2 75.73 80.18 97.14 70.05 0.00 1 0.00 1 0 17 1.813e-01 8.693e-03 5.256e-02 3.453e-03 4.970091e-01 1.799767e-03 5.773854e-03 -6.000000e+00 1.051692e-01 231.91 -2.00 3.47 -2.00 320.10 0.00e+00 2.573216e-03 6.061438e-04 1.486676e-03 -6.000000e+00 4.718790e-03 290.73 -2.00 20.00 -2.00 319.31 0.00e+00 3.967 0.001 302.00 328.00 3 3.6624e+00 5.3975e-03 4.7440e-02 -6.0000e+00 2.6328e-01 2.4072e-02 6.5692e-03 2.6881e-02 -6.0000e+00 2.8421e-01 -1.1143e-01 5.2918e-03 1.3494e-02 -6.0000e+00 1.6960e-01 4.2863e-02 2.7193e-03 3.9839e-03 -6.0000e+00 7.2327e-02 1.5651e-04 -3.2784e-04 9.7929e-05 4.9740e-05 -6.0000e+00 4.8330e-03 7.7847e-03 3.9770e-06 11 8 0 10 0 0 74.17 22.11 0.87 0.00778 0.00532 32 8 1 5 0 1495.610 26.32 20.00 22.11 31.88 4.9 1045.28 -52842 -72775 -57507 -44016 -83156 -69448 -54875 -55872 -56903 -34647 -51826 -59363 -14827 -20618 -10190 -13606 -11611 -2105 5361 10045 -7893 -13537 1609 -14862 -2923 -5795 8904 -8631 -3859 -14598 -3208 -1382 -752 -8322 -11740 -3563 -12660 -3400 -5079 1766 1378 2561 -86 6573 4447 2375 1472 5189 405 1708 296 6561 2840 4761 2027 -67 1296 2603 1908 841 2472 1858 2093 4694 2725 1004 369 -156 220 1868 557 -445 420 -145 -745 -38 -3197 -1502 -2425 -1602 -2268 -1843 -962 -1714 220 -1231 -760 -387 600 1048 1432 1379 -678 -483 -559 -383 -426 1087 223 -387 -563 -1442 -1165 -217 -1175 -1125 -449 -705 -233 436 698 259 531 -55 263 407 201 197 382 373 -182 255 870 514 -33 240 -96 520 103 421 363 -366 -336 112 -45 -126 -87 -88 381 -439 279 -459 -368 -908 -1814 -1336 -889 -2268 -1544 -1090 -1261 -1476 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