File name: Pandora32s1_GreenbeltMD_20250112_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250113T052400.7Z 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_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250112_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: 20250112 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 20250112T131223.6Z 9143.550273 277 1 48.17 2 83.05 125.08 102.94 322.82 0.00 1 0.00 1 0 17 4.038e-01 2.835e-02 1.930e-01 1.047e-02 8.457138e-01 5.660798e-03 9.871446e-03 -6.000000e+00 2.270924e-01 223.83 -2.00 3.47 -2.00 321.90 0.00e+00 1.316746e-02 2.770254e-03 2.958931e-03 -6.000000e+00 9.904054e-03 276.68 -2.00 20.00 -2.00 321.45 0.00e+00 7.580 0.008 302.00 328.00 3 1.3549e+00 1.9789e-02 8.6817e-02 -6.0000e+00 5.6052e-01 1.1153e+00 2.4220e-02 4.4626e-02 -6.0000e+00 6.1022e-01 -1.5351e+00 1.8950e-02 2.4589e-02 -6.0000e+00 3.6338e-01 6.4184e-01 9.4919e-03 1.3158e-02 -6.0000e+00 1.5547e-01 3.1614e-05 -2.2029e-03 2.7405e-04 2.2339e-04 -6.0000e+00 1.0742e-02 4.9835e-03 -1.8681e-04 12 8 8 10 0 0 -16.85 19.12 1.59 0.00498 -0.01157 31 7 1 5 0 1553.510 24.46 19.47 19.12 3.10 5.3 882.29 37892 34986 -51292 -32220 -16349 -91691 -75983 -96226 -70883 -67489 -94424 -78566 -65983 -63254 16842 25901 -28254 22067 22868 116577 51707 -43243 68633 -69640 132597 5232 -9363 74719 -24824 48860 825 14522 73562 26244 40443 -5943 24318 53610 -235 75506 56449 69704 28307 65147 92472 68730 121836 27345 118523 10718 37154 52392 39392 82652 24559 68306 28888 21871 36165 -1209 36764 -2782 27067 4581 12430 38351 11543 29762 12868 40383 14351 7465 15711 11934 -3550 -15369 7355 3779 -7840 -5101 -2722 8814 -8279 -3065 4868 -3626 10667 -2827 981 101 -2498 6197 284 -5928 -3040 -1121 -1484 -3019 985 -4840 -1388 -3348 -5457 -3270 -3683 -4212 -3683 -3070 -2878 -2390 -1664 -1488 958 -763 275 -2573 -446 293 1682 1293 1872 3270 3728 2193 3025 1079 1695 344 -149 1935 949 1117 -732 534 987 -578 272 -1208 400 -94 -682 -635 -1932 774 844 -3000 -1436 -516 -5107 -3245 -4824 -2698 -2381 -4120 -2990 -2695 -3288 500 842 -1757 881 934 2024 1637 -2930 1542 -5495 1489 203 -402 1297 -1115 1098 35 667 2178 1340 1693 -358 1068 1916 -17 2853 2825 3203 2023 3260 3494 3299 3484 2066 3752 1051 3035 4066 3781 5486 3035 5510 3451 2725 3693 -170 3529 -426 3510 856 2361 5678 2192 4802 2654 7216 3693 2150 4107 3022 -943 -4049 1412 756 -1978 -1516 -951 3195 -3628 -1363 2321 -1811 4852 -1522 510 51 -1229 2879 135 -3087 -1583 -681 -1080 -2623 932 -5082 -1349 -2978 -4387 -2459 -2934 -3613 -3323 -2967 -3083 -2938 -2333 -2304 1510 -1217 419 -3889 -658 449 2700 2180 3117 5130 5537 3212 4272 1508 2279 482 -240 3281 1844 2368 -1685 1299 2566 -1493 714 -3249 1058 -262 -1773 -1517 -4395 SS 20250112T132322.9Z 9143.557904 280 1 48.61 2 81.32 126.98 104.14 324.85 0.00 1 0.00 1 0 25 5.073e-01 1.647e-02 8.647e-02 3.780e-03 7.374959e-01 2.011248e-03 8.483138e-03 -6.000000e+00 2.853445e-01 223.83 -2.00 3.47 -2.00 321.39 0.00e+00 8.755825e-03 9.547738e-04 2.326479e-03 -6.000000e+00 1.244440e-02 276.67 -2.00 20.00 -2.00 320.92 0.00e+00 6.260 0.004 302.00 328.00 3 1.2885e+00 6.7095e-03 7.2652e-02 -6.0000e+00 7.0430e-01 3.9371e-01 8.9636e-03 3.9177e-02 -6.0000e+00 7.6675e-01 -5.7427e-01 8.8147e-03 2.3301e-02 -6.0000e+00 4.5659e-01 2.4136e-01 4.2391e-03 1.1132e-02 -6.0000e+00 1.9536e-01 1.4564e-04 -1.1355e-03 1.0145e-04 1.5033e-04 -6.0000e+00 1.3497e-02 4.6756e-03 -1.9311e-04 12 8 8 10 0 0 7.22 19.17 0.90 0.00468 -0.00386 80 19 1 5 0 607.520 24.46 19.96 19.17 3.80 5.3 886.33 -93108 -173665 -161912 -161616 -154010 -185183 -179915 -165392 -138831 -169067 -116619 -137955 -113196 -113028 -51927 -53415 -71948 -39086 -17504 -8355 -15200 -54358 -19298 -60099 -10738 -26175 -20080 -22395 -40362 -34136 -28587 -18823 38353 11927 -7017 -16485 9676 12196 11725 15642 18491 22860 3875 23263 26849 23641 15481 21159 22807 8010 19549 15250 18720 21141 18659 15885 8691 6921 5647 5400 8544 8551 8201 9825 9732 9343 8664 8325 3742 7270 4747 2948 2389 1725 -1751 -1818 -1325 -1894 -5629 -2151 -1942 526 -3942 -527 -1108 -1509 811 -756 467 355 -159 456 -1763 -2775 -2118 -660 -802 -974 -185 -692 -284 -1737 -2619 -1740 -1791 -2225 -1667 -1584 -1085 13 -47 217 -5 173 339 -117 111 -70 208 46 268 1742 1360 1164 1199 1019 943 856 1043 746 422 460 50 275 -101 -95 -208 -241 -113 -175 -170 -342 -1129 -858 -3958 -3581 -3521 -3066 -4158 -4179 -3536 -2457 -4238 -1763 -2797 -2253 -3000 -976 -1260 -2361 -1023 -400 -182 -359 -1844 -455 -2216 -253 -743 -540 -603 -1280 -1082 -1022 -756 1032 462 -321 -784 367 517 601 917 1193 1525 330 1689 1910 1778 1301 1747 1951 847 2032 1861 2436 2915 2800 2536 1386 1118 893 914 1420 1548 1553 2104 2283 2214 2027 1995 1021 2205 1653 1103 896 616 -591 -548 -366 -526 -1804 -798 -859 263 -2303 -318 -714 -954 529 -520 319 236 -109 290 -1099 -1783 -1511 -499 -715 -1011 -214 -767 -323 -1805 -2458 -1571 -1719 -2294 -1804 -1835 -1269 17 -69 350 -8 282 526 -174 165 -108 340 79 459 2823 2115 1759 1753 1443 1287 1199 1645 1264 803 945 110 596 -234 -235 -526 -619 -290 -437 -398 -745 -2522 SS 20250112T133816.2Z 9143.568243 285 1 48.63 2 79.05 129.63 105.69 327.66 0.00 1 0.00 1 0 25 3.691e-01 8.478e-03 3.657e-02 1.520e-03 6.284192e-01 7.864851e-04 7.158239e-03 -6.000000e+00 2.076318e-01 223.83 -2.00 3.47 -2.00 320.62 0.00e+00 3.474327e-03 3.076689e-04 8.576190e-04 -6.000000e+00 9.054530e-03 276.67 -2.00 20.00 -2.00 320.10 0.00e+00 5.076 0.002 302.00 328.00 3 1.0217e+00 2.3983e-03 5.9342e-02 -6.0000e+00 5.1248e-01 9.4038e-02 3.0821e-03 3.2571e-02 -6.0000e+00 5.5789e-01 -1.4044e-01 3.0372e-03 1.7730e-02 -6.0000e+00 3.3222e-01 5.4206e-02 1.5226e-03 6.7045e-03 -6.0000e+00 1.4217e-01 6.6699e-04 -8.1649e-04 4.1167e-05 7.3702e-05 -6.0000e+00 9.8188e-03 3.5510e-03 -1.8657e-04 11 8 0 10 0 0 0.44 19.29 0.49 0.00355 -0.00258 199 47 1 5 0 244.330 24.56 19.55 19.29 4.92 5.3 893.71 -111022 -129588 -123302 -109095 -121551 -134546 -127467 -124100 -115479 -101820 -97912 -94816 -81626 -66950 -38600 -42692 -43230 -23770 -32401 -2969 -22501 -25613 -13266 -23521 -11422 -15629 -10386 -19701 -18747 -20566 -12816 -7584 -3501 361 -8937 -8023 -2634 -2339 2366 2017 3237 1648 -1124 2022 4113 6625 3567 3383 2875 2460 4486 3560 5333 5055 3926 3875 2761 2718 1525 1266 1420 2653 3503 3646 3484 2088 2198 740 1217 2471 746 1025 564 251 -820 -1402 -1412 -2682 -2102 -1473 -1297 -1037 -2281 -1514 -1480 -923 31 -3 139 405 591 508 -359 -563 -203 -308 -183 539 380 -183 -340 -895 -857 -505 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