File name: Pandora32s1_GreenbeltMD_20241104_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241105T133021.6Z 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_20241104_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: 20241104 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 20241104T121214.2Z 9074.508498 50 1 37.57 2 84.80 114.92 117.76 104.79 0.00 1 0.00 1 0 25 4.198e-01 4.491e-02 2.308e-01 2.962e-02 8.076401e-01 1.575912e-02 9.168084e-03 -6.000000e+00 2.366522e-01 224.44 -2.00 3.47 -2.00 321.42 0.00e+00 -1.769244e-02 4.556213e-03 1.842666e-03 -6.000000e+00 1.055798e-02 282.72 -2.00 20.00 -2.00 320.76 0.00e+00 9.543 0.015 302.00 328.00 3 6.9458e-01 4.7570e-02 1.0557e-01 -6.0000e+00 5.8369e-01 1.5095e+00 5.5423e-02 5.7365e-02 -6.0000e+00 6.3460e-01 -1.9141e+00 3.1949e-02 1.9586e-02 -6.0000e+00 3.7909e-01 7.5402e-01 1.8007e-02 1.6098e-02 -6.0000e+00 1.6282e-01 1.0767e-05 3.8645e-04 7.9961e-04 2.0703e-04 -6.0000e+00 1.1173e-02 8.9208e-03 -1.3881e-04 12 9 9 12 1 1 74.10 20.23 2.27 0.00892 0.01182 12 4 1 5 0 2889.750 25.28 21.10 20.23 10.11 5.2 921.27 43441 32511 14392 6175 -2958 12806 37639 314 -13500 31552 -28078 -14690 -19974 5033 61980 27230 -15559 -23774 6562 87634 35178 26434 18928 -29517 -22720 27341 85825 25483 -23144 -54287 173327 -75727 27091 -26283 -21219 28615 -37096 -2103 -29212 72148 42001 55090 306545 43555 101825 3113 25114 77087 103293 81022 -19633 20099 38640 50131 21093 14153 41322 39382 38007 24591 49408 -6848 1342 13289 -18231 6574 -4128 43557 -15508 36197 14037 -10867 11366 9382 -12611 4906 -13087 -26698 -2831 -22013 -2075 15917 14341 -10334 15403 43 24031 10768 7643 4825 -5280 31937 -4120 -8763 147 4469 -1958 4782 4021 -4192 -6457 -4541 -7231 -7687 -551 -2859 -2813 1145 2248 -1614 -595 -1954 771 -40 1172 -589 -4095 -3314 2720 1029 1909 1928 3408 -69 -596 1087 1591 -3001 -930 4107 -1941 1833 -560 2202 1535 -892 -996 -3178 3770 870 -499 -350 -1899 5362 4439 2154 843 -350 1110 2570 35 -1879 2900 -4571 -2045 -3042 634 4720 3075 -2697 -4370 862 4833 3048 2291 1740 -4806 -3818 2872 4733 2208 -2735 -7983 5007 -15909 2205 -3727 -2619 2149 -4968 -249 -4986 5835 5096 6047 8855 4907 5883 450 2757 4899 5072 5149 -3686 2787 4799 5937 3534 2657 6087 5802 5270 3552 5281 -1325 264 2572 -5108 1405 -954 6417 -4524 7215 3852 -3987 3283 2575 -3861 1105 -3213 -7481 -687 -7631 -695 5150 5261 -5194 6362 22 10135 5319 3864 2411 -2730 10701 -1928 -4480 78 2647 -1442 3799 3578 -4154 -6211 -3856 -5703 -6018 -431 -2452 -2552 1075 2318 -1986 -751 -2740 1090 -56 1576 -778 -5613 -4716 3871 1556 2842 2754 5069 -104 -878 1529 2160 -4447 -1545 6849 -3863 3812 -1273 5233 3962 -2504 -2871 -9490 10475 2395 -1297 -841 -4418 SS 20241104T122443.8Z 9074.517174 53 1 48.62 2 82.62 117.00 115.53 106.40 0.00 1 0.00 1 0 25 4.059e-01 2.130e-02 1.304e-01 5.988e-03 7.065132e-01 3.216964e-03 8.709887e-03 -6.000000e+00 2.288227e-01 224.44 -2.00 3.47 -2.00 321.53 0.00e+00 1.071638e-02 1.606183e-03 5.122377e-03 -6.000000e+00 1.020814e-02 282.72 -2.00 20.00 -2.00 321.00 0.00e+00 7.202 0.006 302.00 328.00 3 1.1204e+00 1.1224e-02 8.1888e-02 -6.0000e+00 5.6438e-01 5.3645e-01 1.4581e-02 4.2149e-02 -6.0000e+00 6.1358e-01 -7.6767e-01 1.2726e-02 2.4770e-02 -6.0000e+00 3.6654e-01 3.2472e-01 6.1047e-03 1.0117e-02 -6.0000e+00 1.5745e-01 7.2956e-05 -1.3400e-03 1.6511e-04 1.7772e-04 -6.0000e+00 1.0802e-02 7.6676e-03 -1.6482e-04 12 8 8 10 0 0 99.09 20.25 0.65 0.00767 -0.00240 50 12 1 5 0 972.220 25.39 19.35 20.25 10.67 5.3 926.24 -116000 -68119 -150995 -10118 -116849 -146553 -95922 -155327 -40517 -144982 -128734 -134405 -120181 -56254 22441 37983 -52147 -17474 -27886 12416 -18641 -46589 40080 -65989 -9436 -34606 -21232 6546 -36264 27001 5667 -20683 1154 -7111 12816 -11702 9027 2378 -5298 62979 25469 42424 16522 36713 43193 24319 25324 11470 37156 6226 22119 31390 20316 40601 18040 32073 13084 9316 18882 -1484 26073 120 17141 11600 7476 15537 10526 17167 2324 12207 6041 3528 6693 3119 1864 -3255 -2292 -4836 -5955 682 -3507 3497 -4931 -1297 691 -3106 1941 -1436 1989 316 -1312 2287 -3859 -1867 -3586 -1942 -1522 -1455 -267 -1983 -1430 -2805 -3880 -2281 -3500 -2379 -2791 -1694 -1125 -339 248 -477 633 311 507 -169 -136 399 477 537 514 2358 1611 978 2443 526 1822 549 912 1567 5 1059 -470 498 43 -141 -176 -804 405 -540 439 -1105 -1344 -2586 -1121 -6092 -106 -2854 -4279 -1793 -4948 -473 -4464 -3684 -4317 -4141 -1347 315 555 -2132 -551 -1042 319 -653 -2068 726 -3507 -292 -1394 -744 168 -1398 583 179 -1039 55 -399 569 -622 401 128 -365 2574 1696 2552 1351 2530 2825 1960 2070 1112 2908 702 2325 3355 2416 4671 2490 4345 1980 1449 2834 -241 3593 21 2921 2389 1746 3349 2325 3600 612 3344 1966 1240 2271 1038 574 -942 -603 -1304 -1799 231 -1474 1585 -2710 -734 407 -2028 1274 -1013 1366 215 -855 1343 -2301 -1110 -2420 -1385 -1272 -1412 -287 -2245 -1537 -2753 -3461 -1954 -3235 -2331 -2902 -1870 -1358 -461 348 -733 987 477 742 -238 -191 583 742 878 843 3664 2419 1437 3708 788 2596 812 1397 2745 9 2246 -992 1109 103 -358 -460 -2152 1076 -1406 1065 -2535 -2945 SS 20241104T123532.3Z 9074.524679 56 1 48.38 2 80.77 118.85 113.62 107.79 0.00 1 0.00 1 0 25 3.916e-01 1.015e-02 6.517e-02 2.671e-03 6.186223e-01 1.396137e-03 7.146679e-03 -6.000000e+00 2.208733e-01 224.44 -2.00 3.47 -2.00 320.93 0.00e+00 4.214928e-03 6.129767e-04 1.935705e-03 -6.000000e+00 9.852049e-03 282.72 -2.00 20.00 -2.00 320.35 0.00e+00 5.922 0.004 302.00 328.00 3 1.1887e+00 4.5212e-03 6.6662e-02 -6.0000e+00 5.4477e-01 1.3890e-01 5.9205e-03 3.3229e-02 -6.0000e+00 5.9218e-01 -2.0270e-01 5.6243e-03 1.8364e-02 -6.0000e+00 3.5376e-01 8.0777e-02 2.7561e-03 6.6395e-03 -6.0000e+00 1.5202e-01 2.6075e-04 -6.2558e-04 7.4338e-05 8.8790e-05 -6.0000e+00 1.0422e-02 5.5442e-03 -1.3884e-04 12 8 8 10 0 0 67.11 20.43 0.40 0.00554 0.00084 105 25 1 5 0 460.690 25.47 20.90 20.43 11.55 5.2 930.09 -148780 -142093 -103183 -148658 -78766 -159881 -122239 -109043 -130085 -105673 -134984 -88689 -74688 -71173 -5668 -23163 -36614 -42903 -26323 -6956 -22380 -24381 -21120 -12487 -27786 -10136 -12207 -14085 -13501 -28947 -1538 -15876 9921 -1987 -7571 -4771 -13181 3501 -8757 8917 7622 4478 435 7750 11103 5000 2894 9469 3138 4047 3167 9446 7119 7567 7072 3116 5634 743 1993 2162 806 3961 2038 6858 2536 3649 2795 1174 2027 1313 1625 533 765 1039 -672 -505 -1957 -2034 -2783 -1814 -612 -1402 -1668 -2289 -1034 -613 59 -10 -126 495 189 1185 -186 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