File name: Pandora32s1_GreenbeltMD_20240414_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240415T051402.1Z 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_20240414_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: 20240414 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 20240414T110340.0Z 8870.460880 70 1 48.79 2 84.68 81.85 112.66 10.93 0.00 1 0.00 1 0 25 4.432e-01 5.514e-02 2.948e-01 3.274e-02 1.195985e+00 1.925117e-02 1.371841e-02 -6.000000e+00 2.570211e-01 228.76 -2.00 3.47 -2.00 322.00 0.00e+00 -3.102532e-02 5.265546e-03 5.052345e-03 -6.000000e+00 1.126461e-02 281.17 -2.00 20.00 -2.00 321.40 0.00e+00 9.378 0.014 302.00 328.00 3 5.0941e-01 6.0544e-02 1.2501e-01 -6.0000e+00 6.4056e-01 2.4786e+00 7.0654e-02 1.0812e-01 -6.0000e+00 6.9515e-01 -2.8472e+00 3.9257e-02 3.0065e-02 -6.0000e+00 4.1426e-01 1.0224e+00 2.3967e-02 2.7336e-02 -6.0000e+00 1.7693e-01 7.5385e-06 3.2839e-04 7.5999e-04 3.2841e-04 -6.0000e+00 1.1830e-02 1.1763e-02 -7.1122e-05 12 8 8 10 0 0 33.79 21.21 2.67 0.01176 0.01423 18 4 1 5 0 2710.330 25.79 20.00 21.21 15.22 4.5 958.44 117034 46584 51989 12280 -20051 13950 57495 33510 51258 -30959 -4440 48530 79002 29963 76172 32879 -32159 60727 26891 900000 85128 -38746 -10845 -28009 94344 31605 158473 -37782 4290 -74587 2573 -59174 900000 -7160 -28770 -50229 -69462 29651 -50347 48100 3708 64791 176633 900000 900000 3528 55709 900000 29663 104981 -19171 39563 7444 92519 7919 85383 76005 36111 -1959 31075 39067 -45416 -6767 18121 -24381 37171 18512 129962 49814 101293 20341 -2148 83664 58244 -6114 -33276 12864 26915 -20225 -24459 -4838 30038 22825 -4326 53377 -1258 34755 -8915 9495 10547 -7505 74716 5322 -5935 4548 4983 8797 13228 17700 -3464 -2203 -5926 -13287 -8463 -4086 -146 -3663 -3380 51 -2561 5851 -779 1520 339 135 975 -325 -2814 1388 -5763 -1613 4142 8481 4287 -544 -4956 -1325 5309 -3980 2574 389 -6536 -3251 1040 6198 2036 -1216 -4311 2100 1432 -384 847 121 9022 6811 6219 1730 -3198 1335 3668 3110 4459 -6464 -708 4503 5498 3476 5743 3909 -7181 5107 2963 900000 4197 -5843 -1227 -4305 4924 3208 5055 -5697 336 -11463 194 -9266 900000 -727 -3254 -6263 -10474 1892 -8760 3766 505 4885 5634 900000 900000 317 2746 900000 1892 3684 -2335 3281 842 5312 1033 5992 6061 4147 -294 2875 2991 -8113 -907 2139 -4744 3913 2362 5804 5561 7755 3828 -521 8273 6688 -1151 -7006 1559 2919 -4000 -6085 -1188 6132 5679 -1518 11067 -469 9312 -3725 3210 3331 -2633 10963 1579 -2158 1756 2305 4658 7848 11292 -2818 -1673 -4121 -8689 -5048 -2464 -90 -2466 -2469 41 -2532 6308 -927 1890 437 171 1204 -409 -3786 1879 -8557 -2208 5470 10118 5210 -680 -6323 -1597 6435 -6335 4225 759 -15295 -8071 2713 16734 6082 -3825 -14051 6334 4116 -1020 2004 271 SS 20240414T111545.7Z 8870.469279 73 1 48.74 2 82.35 83.72 112.18 13.64 0.00 1 0.00 1 0 17 4.293e-01 2.115e-02 1.259e-01 5.201e-03 1.032902e+00 2.920802e-03 1.118733e-02 -6.000000e+00 2.458143e-01 228.76 -2.00 3.47 -2.00 322.12 0.00e+00 7.774693e-03 1.643617e-03 2.915192e-03 -6.000000e+00 1.072542e-02 281.17 -2.00 20.00 -2.00 321.68 0.00e+00 6.980 0.006 302.00 328.00 3 4.9737e-01 1.1120e-02 9.2369e-02 -6.0000e+00 6.1270e-01 1.1974e+00 1.4812e-02 6.7443e-02 -6.0000e+00 6.6435e-01 -1.6078e+00 1.2885e-02 2.9828e-02 -6.0000e+00 3.9516e-01 6.4990e-01 6.0437e-03 1.2783e-02 -6.0000e+00 1.6785e-01 9.9749e-05 -2.0354e-03 1.2451e-04 1.4383e-04 -6.0000e+00 1.1438e-02 1.2140e-02 -1.2989e-04 12 8 8 10 0 0 5.78 21.24 0.62 0.01214 -0.00315 92 22 1 5 0 529.760 25.79 20.00 21.24 15.85 4.5 962.57 -113648 -100637 -72555 -108526 -77723 -140685 -20393 -138758 -146842 -108393 -160712 -114298 -99571 -45662 -51445 -48270 -19348 -18529 36808 27958 -1395 -49108 12184 -33837 -48481 12040 8411 -28860 -53967 -59462 18433 -28629 116660 10715 11362 23595 -19889 39986 -4889 64619 43553 31532 2929 45035 67745 41736 50766 39535 13390 20472 32803 49793 38466 43081 54146 26650 46926 21743 35697 16059 24367 21937 22227 34175 20206 20032 21951 29066 19994 19988 20877 10932 14659 13628 5001 3754 -4564 1444 -5308 951 2837 3036 112 -361 4603 -561 283 1455 1950 1301 -1038 4686 -4134 -3002 -4925 -4526 -2663 -1572 -2264 -1959 -1594 -2571 -4358 -1506 -4792 -2621 -2664 -2753 -2289 -1775 -1086 -706 -252 -736 -362 216 -399 345 -34 467 1171 1805 2384 1928 2112 1643 1605 1727 535 969 549 379 301 312 342 106 -101 -73 -151 -175 -293 -720 -2000 -3249 -2923 -1639 -3253 -1433 -4152 -186 -3775 -4401 -2199 -5409 -2582 -2433 -950 -1328 -1469 -500 -513 672 553 -35 -1676 235 -1047 -1770 238 166 -776 -1779 -2202 383 -1205 1361 391 392 658 -857 1055 -238 1835 1701 1471 187 1896 2233 1778 2008 1825 856 1319 2080 3005 2868 3321 3955 2636 3832 2228 2987 1531 2101 2081 2424 3865 2665 2716 2935 3793 3153 3631 4178 2520 3190 2765 980 651 -793 244 -1104 229 816 1028 44 -153 1967 -266 139 726 964 624 -478 1923 -1820 -1385 -2691 -2982 -1903 -1317 -2177 -1964 -1522 -2202 -3321 -1057 -3646 -2080 -2236 -2507 -2337 -2118 -1390 -1010 -379 -1121 -535 309 -576 517 -54 763 1853 2666 3300 2816 2997 2277 2162 2433 823 1771 1159 823 707 791 937 286 -279 -204 -417 -462 -765 -1711 -4500 SS 20240414T113355.7Z 8870.481895 78 1 48.66 2 78.83 86.52 111.28 17.64 0.00 1 0.00 1 0 17 6.291e-01 1.134e-02 3.876e-02 1.251e-03 7.947517e-01 6.714971e-04 8.875096e-03 -6.000000e+00 3.602912e-01 228.76 -2.00 3.47 -2.00 321.11 0.00e+00 5.466740e-03 3.127990e-04 1.781542e-03 -6.000000e+00 1.571859e-02 281.17 -2.00 20.00 -2.00 320.58 0.00e+00 4.981 0.002 302.00 328.00 3 4.3057e-01 2.2118e-03 6.4919e-02 -6.0000e+00 8.9804e-01 2.0919e-01 3.0633e-03 4.2506e-02 -6.0000e+00 9.7364e-01 -2.8909e-01 3.1490e-03 2.4225e-02 -6.0000e+00 5.7913e-01 1.1569e-01 1.5033e-03 9.8987e-03 -6.0000e+00 2.4607e-01 1.0157e-03 -8.5337e-04 3.1589e-05 1.1352e-04 -6.0000e+00 1.6758e-02 1.0660e-02 -1.0701e-04 12 8 8 10 0 0 7.13 21.30 0.38 0.01066 0.00425 335 79 1 5 0 145.220 25.90 20.00 21.30 17.07 4.5 969.23 -236013 -191399 -217666 -187190 -219271 -204765 -195523 -201678 -154540 -193192 -172050 -178725 -122256 -105330 -97477 -58198 -75824 -42724 -55919 -32620 -38623 -53440 -40146 -59562 -29277 -35471 -31651 -35392 -48560 -29841 -39429 -14644 -4709 -11628 -7415 -21327 -7707 -11932 447 5634 2586 10364 -1649 10575 6337 7083 6739 4545 6650 2275 9689 8822 9821 9114 8034 8522 5112 5385 2976 2341 5247 4138 7341 6443 6081 4724 4217 4139 2548 3489 2231 2442 1440 1403 292 -1698 -610 -1849 -2308 -429 -1141 -572 -2333 -1872 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