File name: Pandora32s1_GreenbeltMD_20230922_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T220301.0Z 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_20230922_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: 20230922 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 20230922T113813.8Z 8665.484882 54 1 49.07 2 82.43 95.78 163.97 51.39 0.00 1 0.00 1 0 17 4.102e-01 2.305e-02 2.246e-01 8.856e-03 7.733188e-01 4.808296e-03 9.660821e-03 -6.000000e+00 2.355026e-01 228.56 -2.00 3.47 -2.00 321.70 0.00e+00 1.134100e-02 2.580091e-03 7.311312e-03 -6.000000e+00 1.057146e-02 287.93 -2.00 20.00 -2.00 321.13 0.00e+00 7.038 0.006 302.00 328.00 3 1.7538e+00 1.8063e-02 8.6274e-02 -6.0000e+00 5.8611e-01 7.9636e-01 2.3222e-02 5.3579e-02 -6.0000e+00 6.3574e-01 -1.0779e+00 1.8301e-02 2.7139e-02 -6.0000e+00 3.7874e-01 4.3943e-01 8.7077e-03 8.6938e-03 -6.0000e+00 1.6172e-01 3.8743e-05 -1.7646e-03 2.3771e-04 2.2547e-04 -6.0000e+00 1.0932e-02 7.1033e-03 -1.4193e-04 12 8 8 10 0 0 93.59 21.50 0.93 0.00710 -0.00616 27 6 1 5 0 1817.120 26.00 20.00 21.50 17.71 3.5 955.09 -99498 -108444 31723 -94238 -41940 -151089 -99923 -90019 -121458 64617 -145666 -52353 -76952 -50105 49451 -49001 41940 -27315 77337 148002 -4094 -28363 19198 -12550 26769 -4821 27706 -40882 -28573 -46541 129139 -19422 900000 32670 -11399 -1298 12040 50716 10610 33077 46664 23556 73344 41931 60767 43414 7791 91280 28153 36712 17967 47056 19980 41488 33296 14119 34512 10314 9774 16351 19478 9978 21551 22890 7326 19214 8712 10331 12342 19467 8257 4331 7042 3027 1545 1134 -8573 -262 -3495 -2101 -93 651 4854 -3057 2575 -2954 1194 -879 -1112 1831 -4364 -832 -2142 -5032 -3463 -3435 -1796 -1990 -2152 -3070 -1138 -1463 -4040 -1657 -5016 -2057 -1988 -2204 -771 -912 262 638 -974 -504 6 337 -538 -521 1194 832 1591 1081 3369 2682 1905 1319 657 714 131 1555 763 -335 -254 208 559 -215 -5 -360 494 470 -908 -341 -2279 -3280 -4597 349 -3477 -790 -7353 -2745 -2261 -4290 558 -6403 -945 -2175 -1416 660 -2116 823 -1158 1214 1278 -145 -1202 482 -433 630 -155 631 -1765 -1054 -2156 1338 -991 900000 1257 -653 -62 510 1796 600 1740 2381 1609 3483 2534 3358 2624 685 3941 2166 2738 1763 3842 2337 4201 3842 2017 4064 1522 1389 2092 2431 1480 3248 3899 1593 3725 1833 2173 2752 4630 2450 1404 2206 929 436 286 -2180 -61 -938 -668 -35 280 2233 -1627 1373 -1769 723 -563 -718 1118 -2669 -459 -1147 -2832 -2150 -2513 -1401 -1815 -2216 -3318 -1154 -1340 -3390 -1313 -4360 -1861 -1899 -2267 -863 -1166 376 999 -1478 -815 10 498 -799 -809 1938 1315 2491 1772 5159 4015 2784 1876 909 1011 211 2645 1471 -709 -571 495 1323 -545 -13 -950 1298 1198 -2196 -818 -5283 SS 20230922T115517.9Z 8665.496735 59 1 42.46 2 79.14 98.53 161.39 59.68 0.00 1 0.00 1 0 25 3.699e-01 1.311e-02 1.380e-01 4.868e-03 6.073556e-01 2.585200e-03 7.174019e-03 -6.000000e+00 2.119719e-01 228.56 -2.00 3.47 -2.00 320.87 0.00e+00 2.601891e-03 1.126721e-03 3.161429e-03 -6.000000e+00 9.652425e-03 287.93 -2.00 20.00 -2.00 320.21 0.00e+00 5.110 0.002 302.00 328.00 3 2.7392e+00 8.4818e-03 6.1202e-02 -6.0000e+00 5.2689e-01 1.2815e-01 1.1049e-02 3.6972e-02 -6.0000e+00 5.7046e-01 -1.8789e-01 1.0003e-02 1.7963e-02 -6.0000e+00 3.4099e-01 7.4876e-02 4.8996e-03 4.7936e-03 -6.0000e+00 1.4638e-01 1.1614e-04 -6.2623e-04 1.3639e-04 7.5696e-05 -6.0000e+00 9.9525e-03 8.2595e-03 1.1032e-05 12 9 9 12 1 1 99.99 21.52 0.46 0.00826 0.00355 51 14 1 5 0 816.460 26.00 19.99 21.52 18.33 3.4 958.27 -111739 -58219 -165900 900000 -161865 -99083 -138830 -109984 -10713 -140983 -36149 -146199 -27679 -36181 -72859 49550 -41901 45328 -11376 30112 -13197 -41218 71473 -46834 30899 -28107 34291 6042 -30626 1429 -21025 -2774 9987 -4889 15581 -14295 12976 -10517 -589 9744 -245 18752 -7193 23785 -741 9478 8520 5896 9764 -8885 10491 4836 8460 12539 2076 10215 -810 3208 264 -178 7520 886 5874 2367 2990 542 3225 7282 319 6711 -244 6 2057 -699 2996 -398 1757 -3042 -1895 -1592 -2420 205 -3464 -2047 -341 -879 95 -116 1500 -1006 927 31 -2295 -844 -2429 934 -855 -411 -174 -496 4 -2540 -1228 -1206 -993 -1529 -1116 -192 -343 749 3 643 411 106 931 29 489 285 -277 461 365 1195 253 818 72 -140 741 40 1127 97 505 -219 -412 -57 -496 673 -354 -215 195 -241 26 -554 -196 -1368 -514 -4437 900000 -3881 -1239 -2632 -1780 -76 -3773 -375 -4592 -341 -612 -2158 555 -1261 661 -307 581 -397 -1609 989 -2102 729 -1221 855 193 -1331 48 -975 -129 476 -293 764 -891 662 -771 -48 857 -27 1865 -955 2446 -97 1149 1063 769 1273 -1445 1555 840 1557 2402 466 2219 -201 773 64 -43 1699 229 1621 756 1018 187 1053 2308 116 2609 -112 3 989 -331 1282 -160 637 -1133 -749 -727 -1292 121 -2318 -1433 -249 -686 77 -98 1255 -844 725 23 -1651 -601 -1893 800 -841 -452 -208 -609 5 -2805 -1237 -1202 -1046 -1713 -1301 -234 -447 1056 5 1042 675 171 1423 42 714 431 -441 763 609 1941 403 1260 108 -204 1044 57 1731 166 927 -425 -829 -118 -1095 1537 -834 -512 466 -566 59 -1200 -409 SS 20230922T120031.7Z 8665.500367 62 1 48.48 2 78.14 99.39 160.56 61.84 0.00 1 0.00 1 0 25 2.588e-01 6.899e-03 3.709e-02 1.636e-03 5.654743e-01 8.502441e-04 6.470412e-03 -6.000000e+00 1.482493e-01 228.56 -2.00 3.47 -2.00 320.36 0.00e+00 2.731512e-03 3.217282e-04 9.635957e-04 -6.000000e+00 6.655339e-03 287.93 -2.00 20.00 -2.00 319.66 0.00e+00 4.712 0.002 302.00 328.00 3 1.5409e+00 2.6161e-03 5.5017e-02 -6.0000e+00 3.6847e-01 3.6786e-02 3.2989e-03 2.9594e-02 -6.0000e+00 3.9899e-01 -6.1706e-02 2.9432e-03 1.5351e-02 -6.0000e+00 2.3834e-01 1.8479e-02 1.4871e-03 5.1338e-03 -6.0000e+00 1.0206e-01 5.9304e-04 -6.6956e-04 4.5295e-05 5.7088e-05 -6.0000e+00 6.8940e-03 6.0138e-03 -1.0725e-04 11 8 0 10 0 0 95.53 21.53 0.30 0.00601 0.00098 150 35 1 5 0 323.140 26.11 20.00 21.53 18.55 3.5 959.91 -81400 -111757 -88872 -89986 -94976 -91084 -99826 -43067 -87519 -53620 -67423 -71745 -34772 -45281 -14533 -25670 -15683 -18936 -11500 -1123 -13456 -8813 -8979 -16266 -6352 -11214 5057 -13999 -9897 -12040 -8165 -3301 1816 3559 -6773 -9538 -7979 -2871 1974 1233 1885 14 28 2650 3539 4022 1259 3804 -987 -497 2328 3174 3497 2733 2455 1747 1573 -40 543 994 1178 2447 2413 3402 2441 931 1543 438 1538 1286 817 782 103 -83 -709 -428 -1495 -1820 -2427 -1366 -955 -1084 -2127 -1835 -659 -613 152 319 284 607 354 399 91 -588 117 -109 150 229 150 -300 -452 -845 -640 -263 -763 -1302 -628 -613 106 291 422 572 301 467 158 178 -66 75 79 -128 -171 161 283 136 431 437 41 672 269 32 342 -189 -251 -33 -89 -42 -51 135 26 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