File name: Pandora32s1_GreenbeltMD_20240812_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240821T161621.7Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240812_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: 20240812 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 20240812T110212.4Z 8990.459865 56 1 48.54 2 82.72 76.91 161.20 15.43 0.00 1 0.00 1 0 25 3.131e-01 2.305e-02 1.643e-01 8.855e-03 8.776713e-01 4.907397e-03 9.806803e-03 -6.000000e+00 1.815275e-01 231.70 -2.00 3.47 -2.00 321.96 0.00e+00 -1.976041e-03 2.527058e-03 4.129560e-03 -6.000000e+00 8.155558e-03 290.87 -2.00 20.00 -2.00 321.38 0.00e+00 7.271 0.007 302.00 328.00 3 1.3121e+00 1.8514e-02 8.8928e-02 -6.0000e+00 4.5419e-01 1.0966e+00 2.3321e-02 5.6470e-02 -6.0000e+00 4.9035e-01 -1.5717e+00 1.6191e-02 2.4307e-02 -6.0000e+00 2.9268e-01 6.3803e-01 7.9722e-03 7.3194e-03 -6.0000e+00 1.2489e-01 4.4173e-05 -1.1061e-03 2.3240e-04 8.6834e-05 -6.0000e+00 8.3481e-03 6.8156e-03 -3.3129e-05 12 8 8 10 0 0 7.99 21.55 1.01 0.00682 -0.00150 42 10 1 5 0 1155.580 25.79 20.00 21.55 24.99 5.0 1007.48 26750 -25263 -53513 -20593 -76056 -31578 -4529 -21131 -54889 -104459 -43132 -88548 55370 -19687 9389 25521 -15256 21142 14905 142508 -22655 -53080 -22025 -33081 8756 -18924 158360 -38452 26911 -69251 -6458 14635 670 28714 -23444 2026 -25627 2098 47 33532 47549 39263 9373 68259 36595 49170 49530 58305 11200 16614 13451 40443 47363 42462 31029 11257 22843 18818 18352 18507 18680 30067 19440 21188 17119 16540 10501 13797 12843 19832 7701 12583 11912 10829 6074 1102 -6002 -4182 4978 -1014 -2896 4541 256 1128 1669 1535 -4527 -1751 1239 -568 -1760 7596 -5927 -3282 -6335 -4623 -6815 -1089 -2697 -2523 -2061 -3819 -3827 -2215 -3086 -3060 -1581 -1845 -2355 -770 -1292 -336 399 163 1505 -623 -183 -455 23 1565 1029 913 2149 2706 1656 1668 936 1591 333 1480 1655 -728 -323 -253 1340 21 373 -906 144 124 -239 -889 -1711 567 -992 -2773 -695 -3702 -843 -89 -514 -1982 -6315 -1388 -4588 861 -782 332 882 -779 858 656 1723 -1370 -3667 -1179 -2057 378 -1095 1504 -2391 790 -5263 -296 645 39 1339 -1741 107 -1793 125 3 2056 2833 2679 874 3478 2465 2845 2823 3071 977 1449 1324 3388 4049 4107 3564 1633 3018 2551 2361 2222 2178 3298 2669 3257 2986 2914 1932 2526 2595 4299 2102 3434 3241 2787 1474 247 -1322 -907 1096 -285 -993 1686 101 476 744 728 -2399 -932 640 -289 -852 3463 -2727 -1525 -3442 -2926 -5222 -922 -2619 -2550 -1986 -3367 -3007 -1654 -2467 -2621 -1411 -1779 -2535 -940 -1673 -477 588 240 2118 -865 -253 -660 35 2468 1620 1376 3046 4046 2434 2380 1303 2274 505 2602 3295 -1623 -769 -596 3354 57 1028 -2562 401 334 -602 -2246 -4112 SS 20240812T111251.3Z 8990.467260 59 1 48.57 2 80.70 78.52 160.59 22.46 0.00 1 0.00 1 0 17 5.416e-01 1.507e-02 7.289e-02 2.916e-03 7.546900e-01 1.596196e-03 8.837686e-03 -6.000000e+00 3.139216e-01 231.70 -2.00 3.47 -2.00 321.41 0.00e+00 4.542306e-03 8.263990e-04 4.682878e-03 -6.000000e+00 1.410604e-02 290.87 -2.00 20.00 -2.00 320.79 0.00e+00 5.875 0.003 302.00 328.00 3 1.1152e+00 5.7984e-03 7.3675e-02 -6.0000e+00 7.8544e-01 3.2317e-01 7.8929e-03 4.8596e-02 -6.0000e+00 8.4806e-01 -5.1348e-01 7.0760e-03 2.4013e-02 -6.0000e+00 5.0619e-01 2.1074e-01 3.3306e-03 6.4526e-03 -6.0000e+00 2.1594e-01 2.4228e-04 -9.7742e-04 7.6873e-05 1.1899e-04 -6.0000e+00 1.4442e-02 8.0528e-03 -6.3694e-05 12 8 8 10 0 0 98.03 21.58 0.60 0.00805 0.00071 119 28 1 5 0 408.120 25.79 20.00 21.58 25.69 4.9 1010.92 -152633 -195164 -163154 -148097 -190080 -179986 -163885 -163145 -166759 -158046 -184255 -172429 -88279 -101791 -59104 -40158 -49830 -33911 -32234 5056 -51411 -41195 -14817 -38605 -33235 -34395 -5352 -51112 -38123 -57011 -23188 -23157 13112 -3040 -24510 -11595 -23400 -3714 -568 9797 21407 11746 -107 18956 15100 16571 7673 20869 7978 5898 10611 15634 15772 11165 15346 12150 9781 9686 9398 9197 6741 7442 7965 11429 9502 5619 6377 5244 5781 5090 5577 5794 4648 4797 738 811 -2799 -2051 -1574 -942 244 -1184 -1466 -2193 -1409 -1133 -1299 336 168 434 561 379 -2035 -2627 -2278 -1306 -1326 -779 -1006 -1323 -1115 -1737 -2122 -1302 -1988 -1830 -1993 -835 -338 95 182 170 239 322 72 236 337 27 286 388 472 1002 1252 1112 962 867 518 1378 285 541 230 -89 -173 97 130 194 32 95 -121 -319 -275 -249 -1132 -1823 -3935 -2876 -2232 -3945 -3122 -2470 -2690 -3177 -2966 -4663 -4216 -1155 -1997 -975 -674 -1063 -685 -697 79 -1447 -1031 -286 -1010 -888 -978 -116 -1700 -1084 -2059 -705 -869 406 -123 -1206 -478 -1138 -172 -31 585 1303 855 -9 1396 1168 1286 668 1650 755 610 1162 1673 1871 1515 2138 1828 1557 1547 1460 1386 1051 1248 1519 2416 2240 1386 1533 1307 1566 1607 1969 2163 1757 1719 252 247 -813 -591 -500 -356 109 -570 -792 -1280 -868 -744 -904 239 120 301 366 232 -1223 -1620 -1564 -1041 -1242 -778 -1129 -1541 -1237 -1746 -2082 -1233 -1863 -1832 -2109 -935 -414 131 265 269 387 514 110 346 490 41 461 655 797 1618 1927 1662 1392 1213 754 2037 445 974 433 -183 -374 209 301 479 81 246 -313 -800 -648 -545 -2538 SS 20240812T112229.4Z 8990.473952 64 1 48.50 2 78.86 79.98 159.85 28.44 0.00 1 0.00 1 0 25 4.418e-01 9.039e-03 4.600e-02 1.693e-03 6.612920e-01 9.042724e-04 7.575657e-03 -6.000000e+00 2.560444e-01 231.70 -2.00 3.47 -2.00 320.88 0.00e+00 3.222038e-03 4.078258e-04 2.132476e-03 -6.000000e+00 1.150555e-02 290.87 -2.00 20.00 -2.00 320.19 0.00e+00 4.991 0.002 302.00 328.00 3 1.1051e+00 3.0181e-03 6.1020e-02 -6.0000e+00 6.4063e-01 8.2871e-02 3.9936e-03 3.6504e-02 -6.0000e+00 6.9171e-01 -1.6242e-01 3.6683e-03 1.8889e-02 -6.0000e+00 4.1287e-01 6.3732e-02 1.7896e-03 5.7447e-03 -6.0000e+00 1.7612e-01 6.3001e-04 -7.6796e-04 4.5189e-05 7.7269e-05 -6.0000e+00 1.1780e-02 8.3852e-03 -5.9439e-05 11 8 0 10 0 0 99.94 21.61 0.41 0.00839 0.00261 236 55 1 5 0 205.480 25.79 20.00 21.61 26.14 4.9 1013.55 -176153 -142852 -119044 -132293 -157378 -163909 -138001 -130739 -123478 -128794 -119160 -127554 -83451 -81041 -73050 -42552 -34668 -34395 -19671 -29984 -24458 -24011 -24835 -27072 -23470 -22534 -19983 -27482 -31663 -23843 -19944 -14915 -1402 -6137 -8021 -9101 -15196 -4282 -3112 5042 4113 3866 1865 3830 4410 2185 2709 6446 2732 2562 4926 6863 5710 5882 5518 3434 3990 2039 1951 3176 2147 4370 4300 5006 2832 2812 1224 1656 1933 1745 1620 1387 1460 807 -112 -847 -1920 -1815 -2008 -1054 -1468 -1409 -1551 -1983 -760 -764 -417 464 298 781 275 672 -580 -554 -640 -663 -373 325 -74 -759 -519 -1252 -1230 -573 -1205 -1525 -953 -644 38 271 614 413 441 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