File name: Pandora32s1_GreenbeltMD_20231120_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20231121T055357.5Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20231120_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: 20231120 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 20231120T122943.7Z 8724.520645 51 1 49.57 2 84.96 120.45 152.80 38.14 0.00 1 0.00 1 0 17 2.952e-01 5.793e-02 1.406e-01 2.847e-02 9.386376e-01 1.542311e-02 1.084988e-02 -6.000000e+00 1.658711e-01 223.52 -2.00 3.47 -2.00 320.77 0.00e+00 -1.540549e-02 3.088190e-03 2.645534e-03 -6.000000e+00 7.372194e-03 280.99 -2.00 20.00 -2.00 320.03 0.00e+00 9.769 0.016 302.00 328.00 3 1.9058e-01 4.3891e-02 1.1074e-01 -6.0000e+00 4.0852e-01 2.1661e+00 5.0884e-02 6.3914e-02 -6.0000e+00 4.4452e-01 -2.2569e+00 2.7875e-02 2.2356e-02 -6.0000e+00 2.6545e-01 7.7881e-01 1.5600e-02 1.6295e-02 -6.0000e+00 1.1407e-01 9.7903e-06 -1.6306e-03 7.0496e-04 1.7773e-04 -6.0000e+00 7.8534e-03 9.7028e-03 -2.8887e-05 12 9 8 11 8 0 -0.94 20.66 2.70 0.00970 -0.00255 20 5 1 5 0 2478.180 25.39 19.98 20.66 7.94 3.7 900.40 71680 45343 32996 7602 -9535 -45291 23544 13390 -53 6545 -9001 -24765 22718 -1737 34011 68880 3032 26648 6514 94191 -15800 -29399 43119 -38317 20439 6596 11088 -37283 -30066 -54885 -28119 -39317 110901 -13708 -52744 -51868 -18621 -16940 -14774 48642 28470 34761 87135 92604 18802 93013 2929 -4969 19647 19057 6463 -2284 37111 59633 21970 21177 24475 14887 23482 -19616 19757 -36627 -3274 9227 -1764 24955 43215 56981 3295 78182 8818 7017 24529 568 -9381 -32131 7287 -16063 -25824 -25896 -11864 7660 -2877 5749 22487 2771 36189 4916 10305 2777 2617 475 4479 -12249 -2258 21547 5923 3663 12368 -3025 -4421 -2371 -13426 -14319 -1152 -655 -1839 -2503 333 222 -3531 3313 1282 770 6833 -650 -1831 -3883 2696 -2112 -2922 3033 6224 5917 -265 -2186 -1151 -3985 2658 3708 -1123 -4223 -4399 -318 4627 594 -613 -4625 2341 3222 640 431 -855 11218 9271 6996 1746 -2022 -11318 2853 1927 -9 1107 -1727 -5438 3269 -346 5151 7824 673 4574 1315 7370 -3390 -6456 4354 -9285 2992 1132 1707 -7999 -5009 -10668 -4401 -7741 5851 -2353 -12248 -10605 -2679 -2651 -2685 6078 4822 5695 8226 7714 2976 6456 472 -842 2619 2646 1095 -463 5461 7451 4209 4234 4825 3142 4173 -4793 3017 -9966 -700 1947 -446 4781 6719 7911 851 10854 2693 2260 6470 175 -2813 -10438 1437 -3969 -7744 -9203 -4348 2680 -1254 2458 8554 1347 13063 2470 4836 1341 1177 204 1803 -6088 -1154 10230 3865 2838 9856 -2914 -4112 -1929 -10773 -11092 -825 -498 -1491 -2196 316 244 -4677 4562 1893 1149 9316 -922 -2618 -5898 4050 -3459 -4755 4413 8329 7738 -360 -2944 -1489 -5510 3970 6486 -2358 -9156 -10294 -774 11585 1648 -1771 -14068 6629 8709 1646 1018 -1931 SS 20231120T124211.6Z 8724.529301 54 1 48.35 2 82.90 122.54 151.25 43.25 0.00 1 0.00 1 0 25 3.744e-01 2.156e-02 8.527e-02 5.201e-03 8.081557e-01 2.789151e-03 9.384369e-03 -6.000000e+00 2.103183e-01 223.52 -2.00 3.47 -2.00 321.77 0.00e+00 9.252230e-03 1.445070e-03 3.651414e-03 -6.000000e+00 9.348515e-03 280.99 -2.00 20.00 -2.00 321.28 0.00e+00 7.439 0.007 302.00 328.00 3 4.5554e-01 1.0124e-02 8.5321e-02 -6.0000e+00 5.1799e-01 8.1837e-01 1.2904e-02 4.3864e-02 -6.0000e+00 5.6370e-01 -1.1532e+00 1.0681e-02 2.4809e-02 -6.0000e+00 3.3662e-01 4.7779e-01 5.1446e-03 1.0484e-02 -6.0000e+00 1.4461e-01 9.8581e-05 -1.5718e-03 1.3738e-04 1.9139e-04 -6.0000e+00 9.9620e-03 1.0040e-02 -1.0029e-04 12 9 8 11 8 0 -1.88 20.67 0.81 0.01004 -0.00177 87 20 1 5 0 555.720 25.39 20.00 20.67 8.59 3.7 904.69 -114176 -87500 -91718 -106621 -71133 -130091 -104612 -110066 -113571 -95925 -115070 -110102 -94276 -64542 -61367 -10020 -12833 -18127 17809 8211 2642 -14367 -5116 -28734 -18859 4558 -32779 -52725 -53411 -39551 -16613 -36599 70272 29004 -2538 11637 -21343 9242 -1167 43410 33610 31222 18478 45132 38888 20690 24500 39537 28036 17224 25229 32327 29145 30428 29833 30621 29764 20521 18508 13648 22346 13267 15800 20247 15976 16222 16314 17116 12333 15075 12350 8379 8997 8825 616 -464 -2564 -2837 -5635 -1927 777 965 -2634 -1251 1028 -547 1986 -209 639 -986 -1550 -1993 -2398 -4007 -3620 -3774 -2521 -2624 -1491 -2808 -1389 -2560 -3265 -2394 -3080 -2995 -2349 -2538 -1149 -892 -305 -238 -345 -291 325 -410 -594 -96 496 272 1636 2072 2193 1502 2550 1720 1312 1335 764 1030 637 713 318 403 448 28 -210 -505 35 -295 -110 -686 -2040 -3948 -2703 -3087 -3933 -1574 -4499 -2653 -2994 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280.99 -2.00 20.00 -2.00 320.64 0.00e+00 6.153 0.004 302.00 328.00 3 4.0462e-01 3.6864e-03 7.1688e-02 -6.0000e+00 7.2761e-01 2.5714e-01 4.9684e-03 4.0041e-02 -6.0000e+00 7.9182e-01 -3.8542e-01 4.8216e-03 2.2314e-02 -6.0000e+00 4.7285e-01 1.6141e-01 2.3152e-03 7.7043e-03 -6.0000e+00 2.0313e-01 4.1209e-04 -1.1329e-03 5.5875e-05 1.1291e-04 -6.0000e+00 1.3994e-02 9.7312e-03 -1.1652e-04 12 8 8 10 0 0 83.98 20.68 0.58 0.00973 0.00122 197 46 1 5 0 247.110 25.39 20.01 20.68 9.22 3.7 907.47 -187614 -170299 -167413 -131811 -164009 -187857 -174900 -159165 -157254 -140765 -141564 -154239 -132258 -100156 -78360 -51873 -60219 -41599 -38777 -36839 -27945 -45995 -16178 -38019 -31909 -32782 -32806 -37511 -37179 -35766 -19283 -17178 12321 223 -82 -5059 1280 -16 479 6927 8148 15970 5060 11526 13571 11447 11970 12021 12172 7541 10940 10132 12433 14112 10048 10908 10012 6990 6465 3322 7025 5141 8763 8782 7297 5672 6012 5537 3499 4811 3994 2633 2096 894 1195 -837 -968 -2812 -2533 -1534 -1237 -733 -1995 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