File name: Pandora32s1_GreenbeltMD_20241125_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241126T050855.8Z 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 v1.8.60 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241125_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: 20241125 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 20241125T123631.8Z 9095.525369 220 1 48.88 2 84.94 122.17 39.62 174.43 0.00 1 0.00 1 0 17 5.814e-01 5.204e-02 2.773e-01 3.063e-02 9.195135e-01 1.652603e-02 1.042974e-02 -6.000000e+00 3.273331e-01 223.43 -2.00 3.47 -2.00 321.38 0.00e+00 -1.812867e-02 4.401169e-03 3.856010e-03 -6.000000e+00 1.450973e-02 280.35 -2.00 20.00 -2.00 320.81 0.00e+00 9.745 0.016 302.00 328.00 3 5.1344e-01 4.9858e-02 1.1274e-01 -6.0000e+00 8.0723e-01 1.8872e+00 5.7661e-02 7.2755e-02 -6.0000e+00 8.7993e-01 -2.2121e+00 3.1563e-02 2.2054e-02 -6.0000e+00 5.2391e-01 8.3476e-01 1.8354e-02 1.9395e-02 -6.0000e+00 2.2450e-01 8.3625e-06 -8.1762e-04 7.6750e-04 2.1756e-04 -6.0000e+00 1.5470e-02 6.7489e-03 -1.2244e-04 12 8 8 10 0 0 19.07 20.11 2.88 0.00675 0.00060 17 4 1 5 0 2874.590 25.28 19.03 20.11 9.74 5.2 919.57 31429 39751 31667 11726 486 -41056 -22904 60953 -5600 11074 -3238 -30108 120077 6748 249654 86011 -31811 22047 -18538 332655 -2068 6314 9883 -14123 96821 5993 162561 -1364 -14 -52309 43995 -25069 900000 3846 -55651 -43679 -19167 -48315 28645 -13033 86078 85365 251138 127523 18930 225885 44159 100865 5142 8962 -13795 17209 74554 88632 41681 29238 5012 50860 15576 24698 17461 -39387 -10856 -16098 23352 6098 20023 42337 -1766 78450 3157 37184 12469 32897 -19320 -37483 23912 -13496 19100 -9315 -1313 11850 -15750 17033 16884 5386 16454 239 8447 -9980 -2880 34927 14219 -6891 4870 15800 -8190 7971 8459 3365 4103 -11569 -11640 -13037 -4608 -7851 -6670 -3264 -1860 1773 -3423 6459 -259 -526 2842 -4602 1259 -5290 3446 -615 2069 3532 3899 8070 69 -1392 -4990 859 9 -466 2868 2583 -3130 -386 -1585 1797 -1061 -1867 1566 1603 -435 -188 -380 5717 6583 5158 1942 70 -7468 -3420 4302 -836 1443 -475 -5640 5216 971 7455 6304 -7600 2993 -3624 9934 -292 737 1073 -2109 5257 830 4854 -163 -1 -7810 2628 -3335 900000 428 -10273 -6403 -2185 -8263 2722 -2229 6076 6883 7500 6093 2431 6745 3824 4819 645 1124 -2348 2364 6234 6882 5477 4540 1018 6379 2558 3319 2346 -9527 -2172 -3798 3975 1220 3408 5942 -422 9605 905 7884 3314 6582 -5769 -11641 3642 -2982 3365 -2587 -400 3680 -7243 6053 6353 2396 6830 119 3834 -5215 -1307 10221 5010 -3148 2254 7738 -5992 5760 6821 2954 3406 -10054 -9003 -9888 -3413 -6424 -5696 -2905 -1822 1943 -4570 8679 -390 -798 4049 -6830 1760 -8230 5197 -1004 3243 5190 5438 10532 96 -1896 -6840 1157 14 -865 5333 5286 -7289 -945 -4248 4948 -3081 -5525 4459 4382 -1124 -444 -849 SS 20241125T124907.6Z 9095.534115 223 1 48.75 2 82.90 124.29 39.54 179.30 0.00 1 0.00 1 0 25 4.063e-01 2.167e-02 1.205e-01 5.755e-03 8.048767e-01 3.097810e-03 9.236717e-03 -6.000000e+00 2.282306e-01 223.43 -2.00 3.47 -2.00 321.79 0.00e+00 7.613852e-03 1.635392e-03 3.380655e-03 -6.000000e+00 1.011991e-02 280.35 -2.00 20.00 -2.00 321.31 0.00e+00 7.440 0.007 302.00 328.00 3 6.6737e-01 1.1277e-02 8.5399e-02 -6.0000e+00 5.6211e-01 7.4450e-01 1.4632e-02 4.4458e-02 -6.0000e+00 6.1175e-01 -1.0851e+00 1.2679e-02 2.4472e-02 -6.0000e+00 3.6520e-01 4.5481e-01 6.0538e-03 9.1659e-03 -6.0000e+00 1.5690e-01 8.2137e-05 -1.7222e-03 1.5278e-04 1.6449e-04 -6.0000e+00 1.0810e-02 5.9279e-03 -1.5851e-04 12 8 8 10 0 0 -1.23 20.15 0.88 0.00593 -0.00701 73 17 1 5 0 667.700 25.28 19.41 20.15 10.17 5.3 922.46 -7074 -110039 -129181 -91712 -121750 -140478 -118319 -123678 -96878 -146832 -126214 -134908 -60481 -63030 -46954 -24204 -52647 -17451 23237 46797 -3503 -44587 13143 -59016 13413 -6898 20271 17970 -63144 -22656 -31185 15842 62937 7225 26341 -22825 8115 5217 6359 25819 32954 42642 2808 42049 44862 40439 20004 42245 30139 17041 31148 37573 33791 42648 26852 23736 28660 18864 17423 18830 20188 10237 19271 18062 15076 21742 15573 22166 10124 15875 9452 6184 10625 4696 4418 -3555 722 -5410 -6809 -1191 -254 367 -4671 -170 1649 -1027 2593 2 -1457 474 -1458 1251 -2942 -3891 -5533 -1707 -2268 -2378 -912 -2808 -1051 -1720 -3357 -3394 -3384 -2583 -2976 -1092 -1394 -1490 -286 -765 93 -400 778 -653 -210 423 21 590 1084 2092 2657 1837 1680 1165 1188 1514 809 1222 509 971 -45 398 -130 13 45 -555 210 -358 -224 -791 -1612 -65 -3313 -4944 -2293 -3541 -4301 -2777 -3155 -2175 -5020 -3825 -4695 -1222 -1698 -1370 -679 -2216 -558 522 841 -102 -1852 295 -2782 316 -201 444 383 -2906 -725 -1278 498 1448 316 917 -1204 319 237 339 1333 1776 2226 227 2337 2417 2292 1415 2466 2081 1425 2483 3142 3224 4021 3135 2944 3442 2467 2210 2251 2380 1436 2823 3082 2911 3966 2972 4056 2273 3867 2494 1773 2895 1277 1091 -928 166 -1327 -1892 -343 -87 146 -2186 -82 824 -560 1438 1 -876 272 -803 629 -1486 -2043 -3332 -1171 -1854 -2087 -890 -2911 -1024 -1655 -2925 -2854 -3016 -2448 -2996 -1064 -1509 -1853 -402 -1189 148 -638 1178 -965 -308 644 34 999 1817 3329 4012 2718 2419 1635 1612 2106 1290 2262 990 2046 -102 961 -315 34 118 -1487 560 -929 -540 -1914 -3719 SS 20241125T125954.3Z 9095.541600 226 1 48.73 2 81.19 126.16 39.63 183.47 0.00 1 0.00 1 0 17 5.451e-01 1.277e-02 5.919e-02 2.378e-03 7.041241e-01 1.250368e-03 8.047110e-03 -6.000000e+00 3.061295e-01 223.43 -2.00 3.47 -2.00 321.21 0.00e+00 6.267333e-03 5.960722e-04 1.858370e-03 -6.000000e+00 1.357436e-02 280.35 -2.00 20.00 -2.00 320.69 0.00e+00 6.173 0.004 302.00 328.00 3 6.2002e-01 4.1741e-03 7.0902e-02 -6.0000e+00 7.5398e-01 2.1445e-01 5.6879e-03 3.7347e-02 -6.0000e+00 8.2058e-01 -3.4045e-01 5.6786e-03 2.1765e-02 -6.0000e+00 4.8986e-01 1.4346e-01 2.7197e-03 9.4140e-03 -6.0000e+00 2.1044e-01 3.3046e-04 -9.9738e-04 6.3275e-05 1.1538e-04 -6.0000e+00 1.4502e-02 6.2853e-03 -1.7674e-04 12 8 8 10 0 0 -25.20 20.22 0.56 0.00629 -0.00121 161 38 1 5 0 302.600 25.39 20.27 20.22 10.76 5.3 925.30 -179064 -180013 -174029 -172489 -178908 -192720 -164293 -165670 -178686 -147605 -150864 -153457 -121543 -103367 -44002 -62523 -61362 -55191 -24075 -27601 -44282 -41825 -36318 -33905 -33877 -33015 -27526 -38944 -28050 -36767 -7555 -21371 12276 -3301 -19971 -1757 -4637 -975 -53 3665 12058 10556 4941 15001 14580 12029 9247 13946 10581 7693 7588 11960 11145 12828 10968 11536 7821 4141 4489 2922 5162 5019 7872 7402 5812 4905 5518 3323 3626 3957 3214 3194 2029 1965 -647 -64 -738 -2413 -3272 -2002 -1225 -767 -2082 -2220 -895 -735 -623 63 -161 95 33 329 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