File name: Pandora32s1_GreenbeltMD_20230802_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230804T110053.3Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230802_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: 20230802 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 20230802T110258.2Z 8614.460396 210 1 47.80 2 80.95 74.43 92.77 246.34 0.00 1 0.00 1 0 25 6.297e-01 2.456e-02 3.217e-01 7.631e-03 7.763593e-01 4.286800e-03 9.256290e-03 -6.000000e+00 3.688382e-01 232.08 -2.00 3.47 -2.00 321.62 0.00e+00 7.071728e-03 2.347181e-03 5.595481e-03 -6.000000e+00 1.742976e-02 290.62 -2.00 20.00 -2.00 321.03 0.00e+00 6.022 0.004 302.00 328.00 3 2.5662e+00 1.6186e-02 7.6795e-02 -6.0000e+00 9.2239e-01 5.4338e-01 2.2106e-02 5.1738e-02 -6.0000e+00 9.9840e-01 -8.1890e-01 1.9711e-02 2.5331e-02 -6.0000e+00 5.9356e-01 3.4972e-01 9.1682e-03 6.8686e-03 -6.0000e+00 2.5105e-01 4.5580e-05 -1.7864e-03 2.0534e-04 1.4820e-04 -6.0000e+00 1.7266e-02 3.0653e-02 -1.3524e-05 12 8 8 10 0 0 -50.08 26.31 1.30 0.03065 0.01723 22 5 1 5 0 2172.720 30.87 25.00 26.31 21.85 3.2 980.01 -65164 -164796 -117140 -148397 900000 -174021 900000 -14952 -123130 136778 -209278 -17322 -53078 19438 900000 200980 -20890 20430 133722 900000 -12580 -12785 27547 17136 120019 256344 900000 132823 101015 -72796 900000 -55771 77843 -29959 27446 24462 -1158 62602 -14831 249381 9953 73421 60331 116658 59261 136932 110748 75112 65364 24707 -3895 79163 49651 66524 17505 26013 12994 16028 19836 -3296 26043 5230 7781 1234 -5351 19754 10523 16152 2352 14093 6109 4860 5534 256 1525 -11737 4856 1731 -2683 179 -4542 4357 -3727 -3656 5670 -1084 2441 -2191 855 3921 844 -6580 -3115 -852 -899 -224 -2070 -608 367 -2847 -824 -4050 -3737 -4403 -4147 92 -2245 -432 -1938 -5 -882 1541 378 -953 3476 -1171 606 -707 1198 -117 415 1133 2808 1439 804 127 1506 1319 -73 1983 371 179 -897 728 -159 497 10 -2435 619 361 218 43 -1608 -676 -5348 -2532 -4181 900000 -5027 900000 -111 -2454 1017 -10101 -137 -745 173 900000 1494 -480 341 994 900000 -319 -312 448 321 892 1905 900000 987 824 -3475 900000 -3262 1445 -1720 869 755 -48 1597 -963 1854 670 2857 2780 3175 2839 3119 3334 3308 3324 1979 -453 4642 4237 5213 2317 3280 1897 2250 2591 -520 3151 838 1386 266 -1323 3856 2204 3300 599 3677 1903 1601 1798 82 444 -3482 1143 426 -767 59 -1854 1878 -1913 -1990 3007 -648 1482 -1432 544 2365 494 -3897 -1727 -478 -563 -162 -1760 -583 384 -3134 -852 -3921 -3288 -3850 -3833 87 -2273 -458 -2276 -7 -1272 2328 590 -1483 5027 -1705 873 -1072 1876 -192 674 1769 4175 2109 1154 178 2029 1838 -115 3438 712 364 -1930 1629 -377 1228 24 -6314 1569 893 513 96 -3491 SS 20230802T111414.5Z 8614.468223 215 1 48.79 2 78.84 76.11 94.68 248.04 0.00 1 0.00 1 0 25 4.681e-01 1.141e-02 1.263e-01 2.705e-03 6.751774e-01 1.447213e-03 7.784353e-03 -6.000000e+00 2.709526e-01 232.08 -2.00 3.47 -2.00 320.90 0.00e+00 3.766175e-03 6.499441e-04 2.402137e-03 -6.000000e+00 1.215961e-02 290.62 -2.00 20.00 -2.00 320.21 0.00e+00 4.981 0.002 302.00 328.00 3 2.0266e+00 4.8104e-03 6.1590e-02 -6.0000e+00 6.7858e-01 1.3699e-01 6.3852e-03 3.7636e-02 -6.0000e+00 7.3329e-01 -1.9913e-01 5.8995e-03 1.9443e-02 -6.0000e+00 4.3747e-01 7.8465e-02 2.8676e-03 5.8866e-03 -6.0000e+00 1.8575e-01 2.4200e-04 -9.5991e-04 7.2459e-05 8.1819e-05 -6.0000e+00 1.2491e-02 2.9955e-02 -1.1936e-05 12 8 8 10 0 0 65.34 26.33 0.58 0.02995 0.02274 69 16 1 5 0 707.020 30.87 25.01 26.33 22.33 3.2 982.81 -161203 -172101 -155171 -151972 -168358 -201263 6640 -87922 -106588 -148645 -147482 -154023 -94437 61651 89610 -10776 -53420 -26069 -31070 38667 -32025 -43579 18979 -59918 -14876 -33320 10728 17459 -12391 -31704 -6015 -29848 2527 -8183 -10924 -5220 -8052 -5219 -7969 16318 2727 11050 -9644 7331 2929 10923 11349 17187 6611 506 3266 8393 8233 11805 6960 7549 3014 2057 1845 -55 5085 3533 4040 1942 2583 1671 3383 4049 2267 4080 535 -252 -468 1512 -111 -926 569 -2370 -2133 -1439 -1056 -161 -2760 -1792 -127 -815 -80 -104 6 989 850 -1139 -62 -124 -419 -210 -48 139 -956 -1228 35 -1556 -812 -994 -1360 -1822 -1012 -418 23 140 142 768 43 265 946 433 499 -102 356 -48 -234 555 824 635 559 14 301 907 333 183 408 -36 -164 243 -215 -116 7 -316 -118 -312 10 -227 -174 -1967 -2810 -2365 -2243 -2689 -4220 19 -737 -1217 -2776 -2858 -3518 -1514 281 396 -154 -1321 -551 -754 509 -863 -1310 323 -2341 -411 -1167 253 379 -352 -1149 -201 -1506 110 -430 -577 -255 -433 -321 -612 1196 256 1041 -1160 779 329 1168 1240 1840 817 71 490 1343 1452 2186 1432 1612 693 478 420 -13 1128 864 1111 611 862 559 1091 1329 824 1658 248 -123 -228 695 -48 -367 207 -889 -875 -684 -579 -99 -1889 -1283 -94 -646 -66 -88 5 813 664 -855 -44 -91 -336 -190 -49 157 -1177 -1536 42 -1722 -829 -1016 -1471 -2078 -1194 -516 31 202 220 1246 71 427 1457 648 748 -158 575 -80 -391 903 1299 980 841 21 430 1317 528 318 759 -71 -332 512 -475 -264 17 -743 -278 -720 22 -481 -360 SS 20230802T112021.0Z 8614.472466 218 1 48.64 2 77.68 77.01 95.73 248.95 0.00 1 0.00 1 0 25 3.359e-01 7.946e-03 5.184e-02 1.907e-03 6.248913e-01 1.006334e-03 7.138085e-03 -6.000000e+00 1.944268e-01 232.08 -2.00 3.47 -2.00 320.55 0.00e+00 3.889594e-03 4.054747e-04 1.531125e-03 -6.000000e+00 8.725283e-03 290.62 -2.00 20.00 -2.00 319.82 0.00e+00 4.549 0.002 302.00 328.00 3 1.8841e+00 3.1816e-03 5.5995e-02 -6.0000e+00 4.8693e-01 8.6150e-02 4.0957e-03 3.3317e-02 -6.0000e+00 5.2618e-01 -1.1418e-01 3.7107e-03 1.7562e-02 -6.0000e+00 3.1391e-01 4.0027e-02 1.8503e-03 6.0079e-03 -6.0000e+00 1.3329e-01 4.4087e-04 -8.7657e-04 5.1279e-05 6.8251e-05 -6.0000e+00 8.9630e-03 2.9921e-02 -8.4262e-06 11 8 0 10 0 0 0.85 26.35 0.50 0.02992 0.02333 102 24 1 5 0 476.860 30.87 25.00 26.35 22.60 3.2 984.20 -106295 -150415 -92561 -109376 -129708 -125866 -90243 -63094 -102703 -83409 -107231 -104798 -53378 -48752 -7855 -34795 -30256 -5794 -27617 35017 -33836 -18997 -890 -21991 -6167 -17005 9087 -21690 -11302 -27491 -7095 -5887 -12065 -4428 -15472 2188 -9745 -3819 -5109 3565 2707 707 -4925 5225 2901 7158 1615 7574 32 -1430 2151 4251 5826 4763 4374 2523 2182 219 -459 -387 1797 3657 3447 2639 2061 313 2181 1268 1949 1192 621 835 -123 760 -1246 -924 -804 -1230 -153 -1596 -784 -1121 -2033 -1420 -379 -125 -380 529 232 676 788 -170 385 -486 78 -259 -118 257 -376 -444 -731 -1050 -770 -715 -1112 -1273 -499 -721 -107 275 55 595 267 395 397 650 221 250 216 -397 24 159 569 425 237 175 158 952 99 457 189 -207 -144 -28 -16 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