File name: Pandora32s1_GreenbeltMD_20241214_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241215T051010.7Z 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_20241214_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: 20241214 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 20241214T130618.8Z 9114.546051 288 1 48.48 2 83.14 127.52 102.19 318.86 0.00 1 0.00 1 0 25 3.411e-01 2.857e-02 1.634e-01 1.073e-02 9.024151e-01 5.869873e-03 1.010510e-02 -6.000000e+00 1.911850e-01 223.12 -2.00 3.47 -2.00 322.01 0.00e+00 5.807222e-03 2.772866e-03 1.322543e-03 -6.000000e+00 8.419037e-03 278.33 -2.00 20.00 -2.00 321.56 0.00e+00 7.664 0.008 302.00 328.00 3 1.2215e+00 2.0724e-02 8.8698e-02 -6.0000e+00 4.7088e-01 1.3050e+00 2.4742e-02 4.6483e-02 -6.0000e+00 5.1290e-01 -1.8061e+00 1.7500e-02 2.3772e-02 -6.0000e+00 3.0589e-01 7.3726e-01 9.0743e-03 8.4772e-03 -6.0000e+00 1.3114e-01 3.1501e-05 -2.2888e-03 2.7722e-04 1.3525e-04 -6.0000e+00 9.0755e-03 1.0063e-02 -2.2070e-04 12 8 8 10 0 0 -60.90 19.16 1.54 0.01006 -0.00714 37 9 1 5 0 1310.090 24.46 18.47 19.16 1.45 5.2 871.76 132636 27685 -37222 40492 -43879 -76072 -8811 -56728 37374 -54363 -42376 -92247 -3556 24581 -10072 50674 -38265 27658 19240 54567 65167 -6366 44388 -53203 13090 15374 19733 18796 -57054 -5385 29853 -16385 80893 44943 50083 -31024 21692 -21910 8171 71390 49443 89813 25680 95182 81706 35181 57479 53421 84657 767 35324 30969 40255 86718 26130 67613 24002 29879 28040 10167 49366 -4928 15969 10550 12762 36442 16991 31802 142 35284 11829 8455 22801 14729 5096 -11844 5128 -1039 -11483 5958 -3759 3024 -6200 2053 3384 -812 10866 -2815 6730 -3051 -3670 11588 -8332 -6226 -7386 -790 -2892 -1193 1061 -4161 -919 -6212 -6431 -3247 -6267 -598 -5520 -2977 -2680 -3438 -450 -680 130 -1304 450 -1022 -1500 1097 1439 929 821 3279 3311 617 4819 1680 2679 33 1559 413 347 2074 -371 439 244 -207 -284 -1029 1155 -306 -498 -407 -2405 1767 1159 -2940 1310 -2672 -5284 -285 -2915 747 -2638 -1734 -6320 -118 772 -546 1736 -3459 1342 1025 1973 2183 -357 1533 -4404 617 692 805 708 -4240 -242 1094 -1149 2455 2070 2044 -2565 1044 -1789 573 3063 2898 3666 2016 3686 3506 2357 3068 3019 3633 80 2847 2885 3708 5355 3090 5378 2964 3377 3023 1224 3927 -717 2139 1711 2217 5035 2810 4660 31 6204 2909 2239 5131 3330 1131 -2727 912 -199 -2752 1453 -1216 1067 -2693 879 1509 -399 4970 -1382 3297 -1594 -1809 4609 -3933 -3004 -4120 -448 -1998 -953 938 -4042 -826 -5266 -4828 -2262 -4752 -458 -4706 -2674 -2683 -4027 -591 -995 197 -2014 663 -1475 -2176 1622 2248 1521 1328 4920 4719 879 6410 2241 3434 45 2418 764 672 4327 -851 1072 642 -579 -815 -3003 3285 -851 -1283 -959 -5432 SS 20241214T131716.6Z 9114.553664 291 1 48.51 2 81.47 129.42 103.49 320.85 0.00 1 0.00 1 0 17 5.303e-01 1.851e-02 8.542e-02 3.789e-03 7.925497e-01 2.032337e-03 9.167343e-03 -6.000000e+00 2.973047e-01 223.12 -2.00 3.47 -2.00 321.56 0.00e+00 9.724809e-03 1.016680e-03 3.090109e-03 -6.000000e+00 1.309148e-02 278.32 -2.00 20.00 -2.00 321.08 0.00e+00 6.358 0.004 302.00 328.00 3 1.0777e+00 7.0095e-03 7.5310e-02 -6.0000e+00 7.3225e-01 5.0094e-01 9.4994e-03 4.2483e-02 -6.0000e+00 7.9752e-01 -7.4305e-01 9.1561e-03 2.5620e-02 -6.0000e+00 4.7563e-01 3.1087e-01 4.3376e-03 1.1841e-02 -6.0000e+00 2.0398e-01 1.5188e-04 -1.5428e-03 9.8712e-05 1.7097e-04 -6.0000e+00 1.4108e-02 8.5480e-03 -2.1111e-04 12 8 8 10 0 0 27.93 19.31 0.82 0.00855 -0.00304 96 23 1 5 0 505.270 24.56 21.36 19.31 2.01 5.2 874.29 -108729 -162227 -168739 -154914 -160418 -177692 -160665 -181257 -160711 -171770 -150858 -162305 -122369 -113180 -35000 -38713 -78610 -35692 -33936 12808 -28972 -49977 -22871 -61399 -14311 -47675 -23040 -24329 -37118 -52751 -11366 -10628 26886 30196 -7670 -13733 1332 -2751 28465 19690 26758 27489 14843 27109 33858 39868 15126 27668 34927 12668 20353 26779 31190 26013 20921 18943 17735 13958 13121 9357 12024 12104 12085 10373 12165 11918 13218 10863 8529 8674 6602 6085 4961 3046 1242 -3007 587 -1946 -3961 -2295 -1163 -219 -3608 -720 -924 -1287 693 -771 485 -1055 -308 339 -2513 -3279 -3106 -2266 -2093 -836 -308 -905 -615 -2326 -2498 -2193 -2097 -2520 -2024 -1495 -1227 -488 -178 545 245 -105 437 -266 -329 84 382 502 478 1672 1911 1591 1419 881 855 781 1188 581 885 607 18 -25 -212 108 -385 16 -10 -430 -61 -594 -1150 -1245 -3487 -4194 -3278 -3497 -4136 -3087 -4487 -3444 -4252 -3066 -4018 -2577 -2927 -543 -772 -2701 -884 -890 218 -749 -1533 -524 -2132 -323 -1533 -579 -602 -1029 -1832 -315 -365 755 904 -326 -584 50 -123 1115 997 1424 1564 1009 1683 1989 2254 1129 1901 2362 1147 1888 2622 3227 3076 2760 2632 2543 2058 1876 1341 1697 1860 2139 1962 2484 2466 2664 2303 2020 2363 2051 1999 1636 964 363 -815 142 -486 -1134 -780 -469 -102 -1942 -402 -549 -816 454 -530 331 -710 -193 198 -1455 -1970 -2102 -1649 -1798 -828 -341 -1045 -675 -2326 -2228 -1886 -1911 -2464 -2079 -1642 -1487 -620 -256 854 398 -168 669 -393 -486 129 620 851 804 2659 2890 2343 2029 1225 1150 1083 1865 1067 1694 1263 41 -56 -506 270 -996 42 -27 -1089 -144 -1396 -2575 SS 20241214T133328.4Z 9114.564911 296 1 48.50 2 79.10 132.32 105.30 323.88 0.00 1 0.00 1 0 17 4.427e-01 9.849e-03 3.789e-02 1.521e-03 6.654811e-01 7.906616e-04 7.594478e-03 -6.000000e+00 2.482873e-01 223.12 -2.00 3.47 -2.00 320.79 0.00e+00 4.226379e-03 3.317213e-04 1.299840e-03 -6.000000e+00 1.093170e-02 278.32 -2.00 20.00 -2.00 320.27 0.00e+00 5.095 0.002 302.00 328.00 3 9.3032e-01 2.4706e-03 6.0639e-02 -6.0000e+00 6.1153e-01 1.1179e-01 3.2471e-03 3.4579e-02 -6.0000e+00 6.6596e-01 -1.8402e-01 3.2338e-03 1.9369e-02 -6.0000e+00 3.9717e-01 7.2811e-02 1.5964e-03 7.5641e-03 -6.0000e+00 1.7038e-01 6.8544e-04 -8.5438e-04 4.0545e-05 8.7517e-05 -6.0000e+00 1.1777e-02 7.0019e-03 -1.9017e-04 12 8 8 10 0 0 55.85 19.41 0.48 0.00700 0.00058 226 53 1 5 0 214.580 24.56 20.74 19.41 2.79 5.2 879.53 -152980 -127787 -159274 -144269 -144572 -165845 -121748 -152783 -125155 -130484 -129024 -110795 -100084 -73613 -58158 -40867 -49703 -34164 -25512 -11589 -20052 -32499 -28037 -29898 -19991 -11927 -21891 -16899 -35084 -29575 -9543 -8365 5562 -969 -5792 -10125 -7242 -1777 476 4989 1295 4251 941 4428 6577 7400 5409 3319 4106 2651 5358 6926 6379 6863 4045 4791 4207 2391 2716 708 2914 2882 4390 5083 3749 3521 2478 1865 1628 2386 1681 1306 1159 467 -473 -1163 -1523 -2420 -2656 -1157 -2221 -1648 -2013 -1922 -979 -1288 -45 143 86 513 571 376 -1083 -835 -668 -659 -108 422 321 -305 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