File name: Pandora32s1_GreenbeltMD_20231023_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T220300.4Z 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_20231023_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: 20231023 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 20231023T115729.5Z 8696.498258 46 1 48.77 2 84.77 109.25 160.43 338.96 0.00 1 0.00 1 0 17 2.212e-01 3.492e-02 1.225e-01 1.809e-02 9.270403e-01 1.008753e-02 1.056424e-02 -6.000000e+00 1.252457e-01 225.53 -2.00 3.47 -2.00 321.76 0.00e+00 -1.094779e-02 3.195912e-03 1.732537e-03 -6.000000e+00 5.601262e-03 284.29 -2.00 20.00 -2.00 321.14 0.00e+00 9.499 0.015 302.00 328.00 3 7.0032e-03 3.2148e-02 1.0672e-01 -6.0000e+00 3.0951e-01 1.8014e+00 3.7612e-02 5.5111e-02 -6.0000e+00 3.3614e-01 -2.1855e+00 2.0789e-02 2.2720e-02 -6.0000e+00 2.0083e-01 8.3041e-01 1.1838e-02 1.1723e-02 -6.0000e+00 8.6185e-02 1.7667e-05 -1.4896e-03 4.7059e-04 1.4010e-04 -6.0000e+00 5.8895e-03 1.0233e-02 -7.0741e-05 12 8 8 10 0 0 -44.93 20.93 1.98 0.01023 -0.00096 33 8 1 5 0 1477.810 25.58 19.98 20.93 10.82 3.6 916.31 36176 61666 30431 -1944 37353 -57336 22406 -33342 -11674 -4799 -27306 -3581 -1074 5123 5369 13018 19673 37733 28065 45727 11630 -12872 34221 -10709 18500 44084 18790 -34372 -43470 -73711 26381 -45140 91 -10714 -26255 -16220 -38761 3638 -18097 50711 11868 35785 49969 36955 53105 13877 25359 29661 14312 -4560 -19849 61320 3154 18028 20738 27874 47713 5631 28638 -13050 12844 -18113 -13587 16755 1308 22696 14174 23518 -3622 44637 27746 -385 23958 7016 -8541 -8292 -9560 10921 -22276 -9262 -9132 10683 1501 -3049 23984 -8026 17807 914 1185 7743 -2268 -92 -10755 -9591 3244 1500 2428 -3070 3724 -5120 -263 -3916 -10454 3860 -3404 1756 -6380 -2409 1368 -2168 1763 -1128 -270 -268 3374 -302 -2922 1464 942 -2337 1082 -561 5691 477 5180 448 1276 768 332 2397 -1778 -1147 -1445 -861 2555 392 -239 -1732 1795 169 59 78 -1824 4409 5933 3709 -277 2815 -9195 1545 -4224 -1254 -485 -3328 -339 -107 534 620 1503 2177 3449 2745 3520 1156 -1466 2305 -1185 1632 3040 1567 -4244 -5019 -10757 1523 -6081 9 -1168 -3074 -1535 -4538 340 -2264 4115 1570 3851 4584 3651 4122 1493 2326 2564 1464 -587 -3221 4868 484 2544 3000 3884 5555 974 3637 -2279 1631 -3227 -2564 2630 259 3603 2400 3734 -824 7165 5824 -111 5325 1708 -2155 -1814 -1922 1792 -5659 -2467 -2899 3241 561 -1280 8123 -3950 7068 440 564 3319 -1004 -38 -4762 -4399 1494 834 1580 -2464 3146 -4466 -230 -3178 -8040 2479 -2492 1307 -5447 -2134 1303 -2260 2047 -1501 -374 -374 4410 -396 -3941 1975 1354 -3617 1597 -801 7273 627 6338 560 1690 968 485 4059 -3585 -2528 -3437 -2201 6827 1138 -718 -5334 5324 489 159 192 -4326 SS 20231023T121002.8Z 8696.506977 49 1 48.58 2 82.49 111.32 161.06 347.21 0.00 1 0.00 1 0 17 4.800e-01 1.803e-02 7.078e-02 3.414e-03 7.822351e-01 1.847068e-03 9.155989e-03 -6.000000e+00 2.717335e-01 225.53 -2.00 3.47 -2.00 321.61 0.00e+00 7.478644e-03 9.634098e-04 4.023346e-03 -6.000000e+00 1.215232e-02 284.28 -2.00 20.00 -2.00 321.07 0.00e+00 7.090 0.006 302.00 328.00 3 1.5325e-01 6.6569e-03 8.2311e-02 -6.0000e+00 6.7150e-01 5.6849e-01 8.9502e-03 4.4911e-02 -6.0000e+00 7.2929e-01 -8.0354e-01 8.0082e-03 2.5416e-02 -6.0000e+00 4.3571e-01 3.3597e-01 3.7649e-03 9.4141e-03 -6.0000e+00 1.8699e-01 1.9437e-04 -1.3855e-03 8.9814e-05 1.5671e-04 -6.0000e+00 1.2778e-02 9.6712e-03 -9.2072e-05 12 8 8 10 0 0 -1.06 20.95 0.68 0.00967 -0.00074 135 32 1 5 0 359.810 25.58 20.00 20.95 11.29 3.6 919.31 -156770 -144572 -107358 -125658 -158255 -173009 -153965 -124104 -147432 -113374 -145376 -165278 -133427 -104689 -51751 -14311 -62292 -31437 -29417 -12174 -29848 -2667 -28453 -55673 -29599 -58859 -32678 -45454 -22793 -30508 -23844 -10341 -5014 9475 4833 359 2512 6585 5584 28811 22798 28423 8284 27135 17449 19911 13266 32214 23285 14131 19633 20886 26663 21565 27049 18177 19498 14845 11905 13798 11637 12932 12655 13016 14252 9131 11670 9918 10321 10423 6196 7108 4956 3618 3561 1529 442 -2730 -3115 -2838 325 -478 -2231 -893 -558 -1386 -875 -607 273 -542 261 -922 -2159 -2835 -2706 -2232 -1587 -1021 -1854 -1217 -931 -2753 -2173 -1364 -2640 -2643 -1780 -1494 -917 -211 -643 -121 254 229 141 100 5 -46 724 212 902 1366 1781 1727 1202 1341 742 1530 651 509 645 272 522 -4 149 -49 -206 -41 -93 -413 -323 -518 -1171 -3274 -3194 -1930 -2636 -4057 -4608 -3332 -2107 -3387 -1925 -3436 -5117 -3731 -2893 -1085 -253 -2032 -827 -813 -292 -855 -56 -758 -2020 -867 -2371 -1012 -1544 -599 -914 -794 -372 -202 363 188 14 97 278 286 1391 1321 1675 626 1744 1243 1405 1025 2134 1775 1261 1830 2162 2876 2656 3350 2548 2759 2184 1736 1902 1650 1963 2208 2368 2808 1910 2342 2077 2349 2732 1896 2272 1611 1125 1007 392 106 -677 -865 -947 126 -217 -1155 -489 -324 -862 -572 -376 184 -358 161 -538 -1228 -1668 -1789 -1589 -1326 -989 -2037 -1379 -1004 -2716 -1905 -1150 -2394 -2566 -1811 -1629 -1098 -265 -922 -188 407 363 214 147 7 -70 1163 359 1508 2181 2706 2549 1728 1864 1002 2110 1028 934 1235 567 1151 -8 353 -124 -533 -109 -243 -1051 -770 -1227 -2648 SS 20231023T122050.0Z 8696.514468 52 1 48.67 2 80.55 113.14 161.34 354.62 0.00 1 0.00 1 0 17 4.623e-01 1.003e-02 3.797e-02 1.477e-03 6.675233e-01 7.729179e-04 7.626213e-03 -6.000000e+00 2.617266e-01 225.53 -2.00 3.47 -2.00 320.94 0.00e+00 4.166410e-03 3.498624e-04 1.811333e-03 -6.000000e+00 1.170439e-02 284.28 -2.00 20.00 -2.00 320.35 0.00e+00 5.798 0.003 302.00 328.00 3 1.4495e-01 2.5309e-03 6.6892e-02 -6.0000e+00 6.4677e-01 1.5211e-01 3.3760e-03 3.5551e-02 -6.0000e+00 7.0241e-01 -2.0951e-01 3.2503e-03 1.9581e-02 -6.0000e+00 4.1965e-01 8.3346e-02 1.5784e-03 7.1114e-03 -6.0000e+00 1.8012e-01 7.7331e-04 -8.3601e-04 3.9638e-05 8.7869e-05 -6.0000e+00 1.2306e-02 9.0920e-03 -9.0926e-05 12 8 8 10 0 0 1.89 20.96 0.45 0.00909 0.00281 289 68 1 5 0 168.370 25.58 20.00 20.96 11.88 3.6 922.22 -172065 -138432 -139363 -158746 -139129 -181330 -127629 -147267 -137413 -124799 -143999 -108901 -111617 -73935 -68015 -57903 -40722 -42101 -13785 -33486 -24864 -24456 -29725 -31418 -31242 -18118 -24517 -24386 -25047 -37040 -18029 -18944 210 -5461 -5299 -4527 -9361 -2500 -6412 7120 4697 5654 3706 4790 5604 3564 4278 8453 5350 5975 4818 8362 6544 7380 6529 4851 4849 2147 3660 1402 2952 4083 3860 6180 3579 4652 2521 2740 2661 2285 2284 990 866 457 -133 -247 -1905 -1422 -2301 -1322 -1298 -1488 -1763 -2141 -1174 -1039 -209 1 -321 593 -129 330 -1067 -864 -478 -586 -23 119 -76 -516 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