File name: Pandora32s1_GreenbeltMD_20240718_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240719T052052.2Z 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_20240718_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: 20240718 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 20240718T105146.1Z 8965.452617 111 1 49.56 2 81.09 70.29 135.04 267.65 0.00 1 0.00 1 0 17 6.401e-01 2.540e-02 3.318e-01 1.269e-02 7.461726e-01 7.131891e-03 8.288695e-03 -6.000000e+00 3.788532e-01 232.56 -2.00 3.47 -2.00 321.65 0.00e+00 -4.942296e-03 3.763279e-03 3.303022e-03 -6.000000e+00 1.756202e-02 290.31 -2.00 20.00 -2.00 321.04 0.00e+00 6.103 0.004 302.00 328.00 3 3.1786e+00 2.6853e-02 7.5706e-02 -6.0000e+00 9.5359e-01 5.2133e-01 3.6034e-02 5.1072e-02 -6.0000e+00 1.0335e+00 -8.1355e-01 3.0369e-02 2.0813e-02 -6.0000e+00 6.1040e-01 3.3715e-01 1.4194e-02 8.1198e-03 -6.0000e+00 2.5559e-01 2.5053e-05 -8.9411e-04 3.5614e-04 7.2582e-05 -6.0000e+00 1.7413e-02 1.2561e-02 -2.1634e-04 12 8 8 10 0 0 99.96 21.74 1.17 0.01256 0.00584 25 6 1 5 0 1982.370 26.00 20.01 21.74 28.53 4.8 1027.59 -100837 -105798 -121516 -3752 -101538 -63960 900000 -81709 900000 -124639 -162981 -81141 -2782 57232 -12319 6110 -54733 241318 900000 900000 46750 -38213 137057 -8980 -25928 117183 900000 2638 40170 7224 3571 -76144 514681 5979 54958 51869 -57146 -19474 -45036 130301 35490 28541 17927 41958 41112 5695 99984 56238 11029 16430 55 59395 20588 42051 13714 -642 13898 1738 20191 7975 11550 14835 14846 17164 4367 9733 565 14238 -3524 16092 4724 -7046 9392 8516 252 -5603 -7069 3491 -2003 7453 -5963 6277 1644 -2413 9937 -2913 118 -558 -1203 3721 1610 9715 -4134 -2957 -5141 182 -5757 339 -1984 -3546 -1107 -4438 -3266 705 -5019 1266 -2852 611 -3565 648 448 -793 2992 -2221 1424 -1241 295 697 400 2072 -1006 -219 2373 1128 2666 115 2062 -442 452 675 452 845 -1192 1483 -168 295 -123 -1207 1003 721 -646 -465 -1937 -1987 -2486 -3449 -46 -1974 -794 900000 -1425 900000 -4029 -7848 -1877 -35 708 -248 119 -2110 2984 900000 900000 778 -1418 1695 -278 -1039 1449 900000 80 786 196 113 -6093 6364 269 1482 1374 -4545 -1255 -4517 2911 2246 2058 1475 2741 2675 514 3660 3179 994 1487 6 4402 2417 4362 1985 -112 2189 306 2884 1222 1700 2257 2529 3219 990 2089 129 2940 -942 4101 1488 -2608 2978 2586 76 -1600 -1892 844 -559 2245 -2387 2572 779 -1268 4953 -1741 72 -355 -771 2220 924 4876 -2269 -1651 -3250 127 -4878 310 -2046 -3806 -1109 -4181 -2775 571 -4565 1157 -2846 629 -4152 813 627 -1207 4512 -3456 2066 -1773 416 1019 619 3293 -1640 -344 3519 1645 3736 160 2735 -615 694 1169 864 1712 -2588 3328 -406 746 -319 -3203 2618 1836 -1575 -1067 -4337 SS 20240718T110729.0Z 8965.463530 119 1 3.90 2 78.19 72.58 137.95 269.94 0.00 1 0.00 1 0 17 4.122e-01 2.107e-02 3.306e-01 1.397e-02 6.100850e-01 7.506915e-03 7.550410e-03 -6.000000e+00 2.414937e-01 232.56 -2.00 3.47 -2.00 320.67 0.00e+00 2.811652e-03 3.087782e-03 4.481633e-03 -6.000000e+00 1.089004e-02 290.31 -2.00 20.00 -2.00 319.96 0.00e+00 4.731 0.002 302.00 328.00 3 2.7292e+00 2.4104e-02 6.0669e-02 -6.0000e+00 6.0630e-01 1.0966e-01 3.0855e-02 4.2733e-02 -6.0000e+00 6.5507e-01 -2.2938e-01 2.6717e-02 1.8260e-02 -6.0000e+00 3.8866e-01 1.0013e-01 1.3215e-02 4.4622e-03 -6.0000e+00 1.6648e-01 1.6642e-04 -6.2439e-04 3.8672e-04 7.7998e-05 -6.0000e+00 1.1296e-02 6.7429e-03 -5.0961e-05 12 9 9 12 1 1 999.00 21.76 0.48 0.00674 0.00205 2 9 1 5 0 1300.050 26.00 20.01 21.76 29.12 4.8 1031.10 900000 -196258 900000 -184546 -112291 82693 -104249 900000 -59641 -70334 -66294 -21696 1857 -57661 90075 -34933 -3141 89562 -11104 174783 -63464 63983 -54302 7602 -47327 12847 41249 -74803 137181 -53942 -8214 -40657 20546 33264 -12442 49349 -37367 17047 12012 12434 26847 668 16184 -2988 15248 23091 1059 51710 26573 19586 21446 24502 8716 15228 16863 -3725 4432 128 756 5755 1610 14308 2411 8329 1125 -1884 11376 -1294 1873 -2501 -494 1275 1034 5079 -2541 5722 -7150 -3657 33 -4607 2624 -4067 -196 -4811 -16 394 1270 519 -2236 -1069 -3571 276 -1793 -3512 1243 -1588 638 -419 1929 -701 -1995 -1101 -3761 -1068 489 -2525 878 -952 1208 -583 -864 315 1568 1118 220 1671 214 1152 894 -821 788 -571 1592 204 709 1328 1106 198 -323 1159 655 -716 -801 -221 50 -868 155 -593 326 -664 367 760 -1036 900000 -7634 900000 -7023 -1982 1126 -1661 900000 -812 -1116 -1052 -295 25 -1363 1226 -990 -75 1219 -338 2380 -3463 1043 -2761 231 -2605 426 1068 -5665 1868 -3354 -377 -2996 988 1554 -881 1880 -3390 1075 962 1188 2545 87 1924 -438 1913 2736 157 4879 3282 2711 3174 3924 1767 3141 3642 -1011 1154 35 201 1430 422 3597 754 2758 424 -724 3761 -483 729 -1144 -247 660 541 2472 -1236 2365 -3056 -1491 14 -2333 1440 -2654 -135 -3642 -12 319 1074 456 -2021 -940 -3048 216 -1360 -2702 991 -1450 642 -473 2318 -876 -2434 -1237 -4008 -1105 527 -2935 1035 -1192 1581 -836 -1339 508 2534 1774 338 2447 314 1735 1410 -1363 1304 -937 2502 317 1067 1937 1569 286 -501 1944 1180 -1360 -1571 -449 105 -1923 348 -1353 743 -1499 794 1575 -2112 SS 20240718T115049.4Z 8965.493627 144 1 4.35 2 70.04 78.83 145.94 277.06 0.00 1 0.00 1 0 25 8.881e-02 7.908e-03 5.267e-02 5.676e-03 3.961229e-01 2.913877e-03 4.577570e-03 -6.000000e+00 5.171084e-02 232.56 -2.00 3.47 -2.00 318.57 0.00e+00 2.432349e-04 6.144720e-04 3.322380e-04 -6.000000e+00 2.307787e-03 290.31 -2.00 20.00 -2.00 317.71 0.00e+00 2.897 0.000 302.00 328.00 3 3.4120e+00 8.0192e-03 3.5533e-02 -6.0000e+00 1.2969e-01 -1.6337e-03 9.1774e-03 2.0688e-02 -6.0000e+00 1.3987e-01 -7.6484e-03 6.2368e-03 1.0012e-02 -6.0000e+00 8.3408e-02 -1.4329e-03 3.2750e-03 2.7554e-03 -6.0000e+00 3.5550e-02 6.0797e-04 1.0419e-03 1.5984e-04 2.8175e-05 -6.0000e+00 2.3674e-03 2.5553e-03 1.3015e-04 12 9 1 12 9 1 -85.91 21.83 0.16 0.00256 0.01038 3 11 1 5 0 1086.810 26.11 20.00 21.83 29.68 4.8 1034.43 81955 -11252 30865 -16773 11408 -18607 -7896 20159 -21099 -5676 -10967 -746 14440 -8695 11667 -8309 -1488 774 -8174 10177 -8035 -1567 3313 2062 -98 3445 9498 -3467 6527 -5621 1593 2342 2060 2188 -3140 -2678 -5428 -1259 -970 -3705 -70 -1516 353 -319 1133 113 -2360 1915 -585 189 -650 2235 1500 -259 -242 -1662 1727 -929 -379 2117 477 1748 1712 2397 1331 -424 1978 -849 2029 -761 648 -228 -292 1380 -273 661 -861 -950 -2024 -1935 -1094 -1396 -638 -2277 -663 684 96 407 -580 1293 498 555 97 -63 877 356 -198 -98 261 -191 -444 -47 -1384 -359 -320 -1087 -732 -798 394 -159 596 1132 139 451 -527 323 534 -138 -139 111 326 66 -33 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