File name: Pandora32s1_GreenbeltMD_20240909_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240910T051005.3Z 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_20240909_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: 20240909 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 20240909T111622.4Z 9018.469704 45 1 48.60 2 84.55 87.94 152.23 64.58 0.00 1 0.00 1 0 17 3.946e-01 3.647e-02 3.110e-01 2.565e-02 1.093769e+00 1.490189e-02 1.296845e-02 -6.000000e+00 2.287959e-01 229.66 -2.00 3.47 -2.00 322.27 0.00e+00 -2.857190e-02 5.545365e-03 1.597346e-03 -6.000000e+00 1.038926e-02 289.11 -2.00 20.00 -2.00 321.72 0.00e+00 9.185 0.014 302.00 328.00 3 6.8443e-01 5.2008e-02 1.1243e-01 -6.0000e+00 5.6942e-01 1.9704e+00 6.1978e-02 8.1832e-02 -6.0000e+00 6.1625e-01 -2.5463e+00 3.4048e-02 2.7121e-02 -6.0000e+00 3.6878e-01 9.7763e-01 2.0018e-02 2.3590e-02 -6.0000e+00 1.5831e-01 1.0339e-05 1.1040e-03 6.4133e-04 3.2833e-04 -6.0000e+00 1.0537e-02 1.0586e-02 -7.8784e-05 12 9 9 12 12 4 -5.31 -62.18 2.41 0.01059 0.01888 22 5 1 5 0 2208.700 25.90 20.20 -62.18 17.29 5.1 962.78 51280 18431 24203 22730 -38803 2344 112570 38473 -25761 32374 35143 -43265 64804 -9574 1314 63225 25519 24654 1053 900000 -9944 -34640 51611 -23830 39232 -26250 28153 40069 44560 -34757 29511 -33644 -6216 15164 -5351 53815 -81685 -15300 -55050 12978 133831 136225 900000 900000 125820 115931 78197 900000 119177 41824 70742 32644 23537 9710 95213 20618 50917 23720 20418 30689 44977 50435 39871 7248 -24949 18012 44226 53087 -21201 111431 14973 -11331 41164 42833 7013 -1302 10135 -7103 -17756 -524 -24657 38939 7147 17130 30321 9311 21622 18475 3552 14628 22 28943 -11585 5302 -979 5742 -9405 2784 -4172 -901 2094 -9017 -4348 -9125 -3581 -6253 -252 1764 129 -1745 -6884 -754 1703 -2415 3126 -995 1799 -3952 1350 297 137 1450 1668 1214 2462 86 212 498 905 2430 1611 -1521 -779 491 1440 1377 -549 -2448 1220 352 363 -1961 -192 4660 2219 2420 1859 -4496 154 2813 2098 -2985 2207 2316 -6193 3239 -1044 134 3591 2087 1961 100 900000 -881 -3542 2228 -2491 2496 -3340 1919 2003 1721 -2685 1274 -3058 -466 930 -365 1834 -10950 -1217 -8005 1150 4348 4426 900000 900000 3459 3187 2931 900000 2978 2404 3359 2529 2176 1116 4997 2422 4581 2727 2194 2608 3035 3277 3189 906 -4614 2161 4090 4776 -4504 7241 2807 -2860 5967 5566 1139 -198 1266 -1083 -3417 -102 -7333 7201 2054 4795 7881 3141 6701 6002 1314 4606 8 7017 -4227 1776 -409 2683 -6064 1858 -3347 -720 1539 -6581 -2684 -5747 -2273 -4345 -174 1301 110 -1792 -7946 -920 2152 -3227 3878 -1257 2228 -5424 1853 423 190 2043 2231 1597 3132 110 264 662 1292 4086 3144 -3396 -1879 1277 4031 4088 -1696 -7758 3685 1017 957 -4806 -437 SS 20240909T112929.7Z 9018.478816 48 1 48.75 2 82.00 90.00 150.02 68.39 0.00 1 0.00 1 0 17 5.047e-01 2.014e-02 1.121e-01 4.450e-03 9.030472e-01 2.471627e-03 1.038364e-02 -6.000000e+00 2.901076e-01 229.66 -2.00 3.47 -2.00 321.86 0.00e+00 6.369913e-03 1.414663e-03 4.621020e-03 -6.000000e+00 1.304024e-02 289.11 -2.00 20.00 -2.00 321.32 0.00e+00 6.711 0.005 302.00 328.00 3 7.6783e-01 9.6323e-03 8.3919e-02 -6.0000e+00 7.2267e-01 7.7295e-01 1.3197e-02 5.2937e-02 -6.0000e+00 7.8195e-01 -1.0905e+00 1.1339e-02 2.8492e-02 -6.0000e+00 4.6701e-01 4.4873e-01 5.2232e-03 9.4055e-03 -6.0000e+00 1.9957e-01 1.2427e-04 -1.5489e-03 1.1072e-04 1.6753e-04 -6.0000e+00 1.3455e-02 1.0750e-02 -1.6349e-04 12 9 9 12 4 4 55.35 -62.18 0.65 0.01075 -0.00089 90 21 1 5 0 541.630 26.00 20.29 -62.18 17.69 5.0 965.14 -139823 -116304 -161707 -110362 -169951 -152576 -150476 -133750 -120014 -174832 -161012 -191449 -64902 -103080 -77748 -20554 -66029 -10000 -37385 74308 -51654 -51266 905 -46789 4538 -56686 10176 -24555 -45117 -32787 -41391 2041 -2004 23494 -20189 -10770 1645 2372 24126 32135 34825 29664 -4467 55710 25777 44927 21709 33504 39430 8588 39325 25701 37404 28479 25407 27873 25375 29206 18231 19135 24570 18985 25875 14777 22607 13163 17032 12265 11933 17516 8869 13003 10398 7102 5631 -3362 437 -3175 736 583 -1008 2094 -1609 -575 -648 767 794 138 77 8 -318 495 -1805 -3554 -4400 -2715 -3130 -850 -1835 -2458 -2070 -2261 -2709 -3230 -1728 -3716 -2242 -1708 -2150 -202 -865 133 -172 243 324 -252 137 335 208 615 1046 2009 1346 2020 1607 1653 1072 944 919 544 1084 314 -107 290 -113 156 -277 67 -32 -153 -151 -1023 -1316 -2482 -1927 -4465 -1916 -4224 -3112 -2938 -2322 -1927 -5007 -4052 -6419 -845 -2594 -1957 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8.1023e-01 2.4453e-03 6.1903e-02 -6.0000e+00 7.0646e-01 1.2935e-01 3.2475e-03 3.8418e-02 -6.0000e+00 7.6435e-01 -1.9376e-01 3.0582e-03 1.9861e-02 -6.0000e+00 4.5650e-01 7.6519e-02 1.4919e-03 6.0125e-03 -6.0000e+00 1.9513e-01 8.1469e-04 -7.1862e-04 3.6764e-05 8.1611e-05 -6.0000e+00 1.3148e-02 9.3759e-03 -1.5060e-04 12 9 9 12 4 4 64.56 -62.18 0.41 0.00938 0.00398 236 55 1 5 0 206.130 26.11 20.13 -62.18 18.93 5.1 972.51 -211539 -157156 -160219 -171309 -151329 -188448 -103249 -167482 -129710 -139689 -148049 -98508 -109944 -53402 -84872 -51220 -51930 -47011 -18803 -40186 -26570 -34524 -35850 -23683 -28634 -10893 -29567 -18350 -36115 -29607 -14076 -18894 5300 -10394 -124 -7639 -10333 -2682 -5084 9076 1064 6718 1406 4364 8103 4226 6863 3038 2551 3570 3783 9080 5867 8568 5248 5404 5358 1791 4236 1919 5094 4026 3534 6147 3388 3622 1926 1375 1478 2410 2081 1081 1273 507 -389 -636 -1898 -1523 -2450 -859 -1279 -1190 -1905 -2232 -685 -1006 122 -74 174 520 -45 1008 -1144 -655 -871 -889 -50 -101 378 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