File name: Pandora32s1_GreenbeltMD_20240810_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240821T144725.2Z 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_20240810_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: 20240810 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 20240810T110954.9Z 8988.465219 63 1 49.56 2 80.95 77.55 142.90 49.14 0.00 1 0.00 1 0 25 3.976e-01 2.309e-02 2.354e-01 1.002e-02 7.033588e-01 5.532838e-03 8.402342e-03 -6.000000e+00 2.308937e-01 231.77 -2.00 3.47 -2.00 321.46 0.00e+00 6.366893e-03 2.716129e-03 4.266359e-03 -6.000000e+00 1.061197e-02 290.82 -2.00 20.00 -2.00 320.83 0.00e+00 6.021 0.004 302.00 328.00 3 3.0247e+00 1.9734e-02 7.2347e-02 -6.0000e+00 5.7848e-01 5.6400e-01 2.5345e-02 4.2632e-02 -6.0000e+00 6.2538e-01 -8.7400e-01 2.0088e-02 2.1690e-02 -6.0000e+00 3.7277e-01 3.6956e-01 9.7466e-03 6.5762e-03 -6.0000e+00 1.5877e-01 3.2087e-05 -9.3340e-04 2.7736e-04 1.2391e-04 -6.0000e+00 1.0615e-02 7.6902e-03 -1.0152e-04 12 8 8 10 0 0 86.52 21.44 1.33 0.00769 0.00068 19 4 1 5 0 2608.240 25.58 20.00 21.44 29.03 4.9 1028.64 -44586 -54763 -103235 -29603 -126309 -50841 -129973 -26105 -6549 -124968 -4609 -150760 900000 -35145 990 73073 8078 131441 14382 900000 -16510 -20952 47892 55033 63457 -39742 207654 -2605 41235 -29457 -67399 24924 -16620 39877 -2380 -7577 -35205 -8408 -13850 -646 50090 81073 51182 84613 20235 30631 29489 50979 11912 35209 1054 39476 32250 24326 18158 5616 7044 12503 8183 16657 9117 17174 14888 13342 7917 2888 6802 4959 2929 15079 889 2328 55 6467 -345 -6373 -3049 -5886 -9345 -4017 1595 1956 1975 54 2327 2630 -5768 2386 -354 -256 2675 3968 -3063 -5041 -533 -2193 -3041 -1035 -3546 -2278 -1339 -2450 -515 -2132 -2166 -2539 -1648 -142 -1177 -1621 -280 204 878 683 1551 -184 -1103 -1655 359 1087 575 1315 1914 2391 1258 1030 81 832 429 2302 1195 -869 -171 379 1243 1015 -32 -1419 -222 -278 -122 -995 -1202 -831 -1313 -4217 -552 -5384 -903 -4963 -371 -81 -5216 -63 -8434 900000 -936 23 1071 230 1284 478 900000 -689 -874 1076 1183 1302 -2117 2028 -99 967 -1439 -5027 974 -1136 1675 -146 -459 -2889 -600 -1245 -60 3131 3960 3500 4215 1917 2633 2592 3685 1315 3233 148 4203 4032 3540 2962 972 1226 2247 1479 2668 1585 2969 2981 2796 1891 721 1582 1189 775 4057 308 837 20 2107 -110 -1924 -896 -1765 -2896 -1402 625 881 989 29 1319 1586 -4000 1583 -243 -171 1629 2227 -1757 -2990 -336 -1638 -2682 -1035 -4068 -2444 -1482 -2474 -460 -1895 -2056 -2593 -1762 -160 -1469 -2107 -403 317 1388 1060 2275 -263 -1584 -2499 565 1791 955 2097 2911 3511 1806 1431 109 1138 661 3992 2333 -1864 -355 832 2898 2517 -81 -3765 -585 -710 -292 -2240 -2584 SS 20240810T112100.1Z 8988.472918 68 1 48.80 2 78.84 79.22 141.33 52.55 0.00 1 0.00 1 0 25 3.896e-01 1.424e-02 1.707e-01 5.643e-03 6.250715e-01 3.031050e-03 7.128959e-03 -6.000000e+00 2.259373e-01 231.77 -2.00 3.47 -2.00 321.04 0.00e+00 2.585944e-03 1.400800e-03 2.145356e-03 -6.000000e+00 1.018088e-02 290.82 -2.00 20.00 -2.00 320.35 0.00e+00 4.983 0.002 302.00 328.00 3 3.1891e+00 1.0347e-02 5.9969e-02 -6.0000e+00 5.6539e-01 1.2315e-01 1.3719e-02 3.5101e-02 -6.0000e+00 6.1077e-01 -2.2402e-01 1.2284e-02 1.7863e-02 -6.0000e+00 3.6425e-01 8.6656e-02 5.9356e-03 5.1769e-03 -6.0000e+00 1.5622e-01 8.2454e-05 -6.5120e-04 1.5943e-04 6.9572e-05 -6.0000e+00 1.0481e-02 8.2839e-03 -8.3048e-05 12 9 8 11 8 0 99.86 21.46 0.71 0.00828 0.00339 46 11 1 5 0 1060.860 25.58 20.00 21.46 29.27 4.9 1030.14 900000 -158362 -74372 -149072 -83130 -136963 -121896 8167 -165950 -71122 -163783 -93543 -70893 -125219 12568 -53060 -6286 -48764 63070 26704 -30839 -1566 -10412 17328 -27078 20409 60126 -14714 -946 -37012 7301 -20856 -3033 -10270 -21548 7815 -23781 10390 -22735 7043 15721 706 -787 17016 15716 5813 5150 21951 1086 8919 1044 17008 6626 6792 12001 -2228 5966 -962 6330 5528 409 7449 1404 12434 2111 2505 -710 -475 3551 1776 3406 -574 2299 536 -2988 1126 -5257 1363 -4997 739 -1209 -1595 1637 -2565 2011 -2606 -2537 1198 -465 2520 -311 5481 -1293 -2130 -1016 -2358 -615 524 -894 -1636 -986 -898 -1826 587 -2228 -1037 -402 -885 723 -406 888 281 917 378 323 779 -919 -196 -116 -64 175 411 990 553 368 269 -222 962 -233 1371 -317 -273 -982 297 1235 147 338 -423 182 -33 -377 -145 -949 900000 -3010 -737 -2834 -823 -1987 -1744 45 -4317 -861 -4752 -1596 -1170 -4134 145 -1301 -121 -1439 729 470 -910 -38 -281 381 -921 505 1026 -518 -28 -1481 237 -981 -140 -560 -1293 336 -1487 541 -2024 564 1321 75 -89 1668 1580 657 598 2207 140 1120 156 2425 1157 1288 2305 -516 1319 -229 1371 1178 93 1710 388 3477 646 756 -214 -144 1122 659 1396 -260 1016 231 -1230 399 -1820 474 -1842 303 -595 -906 999 -1743 1391 -2023 -2087 986 -392 2008 -240 3709 -886 -1476 -763 -2071 -567 548 -1052 -1993 -1135 -934 -1741 583 -2249 -1107 -449 -1057 922 -585 1305 444 1461 588 475 1170 -1391 -308 -180 -104 287 653 1618 880 565 398 -317 1376 -374 2280 -591 -543 -2064 610 2688 344 811 -1041 449 -80 -860 -310 -2101 SS 20240810T112616.7Z 8988.476582 71 1 48.59 2 77.83 80.01 140.55 54.09 0.00 1 0.00 1 0 25 2.972e-01 8.126e-03 4.550e-02 2.048e-03 5.843215e-01 1.083920e-03 6.802217e-03 -6.000000e+00 1.723619e-01 231.77 -2.00 3.47 -2.00 320.49 0.00e+00 2.882758e-03 4.223440e-04 1.884764e-03 -6.000000e+00 7.740716e-03 290.82 -2.00 20.00 -2.00 319.75 0.00e+00 4.602 0.002 302.00 328.00 3 2.0201e+00 3.3926e-03 5.5441e-02 -6.0000e+00 4.3133e-01 4.2639e-02 4.3096e-03 3.2161e-02 -6.0000e+00 4.6567e-01 -1.2327e-01 3.7785e-03 1.6360e-02 -6.0000e+00 2.7792e-01 4.6403e-02 1.8953e-03 4.8549e-03 -6.0000e+00 1.1857e-01 4.0108e-04 -4.1743e-04 5.6452e-05 6.4868e-05 -6.0000e+00 7.9256e-03 6.6298e-03 -5.6138e-05 11 8 0 10 0 0 69.11 21.47 0.49 0.00663 0.00349 103 24 1 5 0 471.730 25.58 20.00 21.47 29.33 4.9 1030.60 -117406 -104916 -84408 -103249 -98972 -85746 -110584 -83915 -77178 -86923 -89811 -99903 -41237 -49740 -31025 -18676 -27261 -15556 -15113 -1382 -25677 -13180 -10534 -15306 -16139 -17570 -1377 -9416 -5486 -14332 -10157 -9861 -10509 -2974 -7157 -4328 -9695 -3551 -5186 168 5865 1746 150 2800 4415 1564 1813 6110 2488 -284 4026 3983 4253 3530 4268 2211 1090 1038 869 946 1888 3554 3552 4368 1946 843 814 388 859 1778 1358 1167 459 1003 -381 -320 -2393 -2652 -2398 -2029 -1192 -1265 -1408 -1495 -514 -341 -397 899 365 1026 570 546 -453 -438 -509 -287 -388 137 -232 -548 -698 -1074 -1058 -562 -1319 -1527 -570 -782 186 502 593 614 151 480 206 306 104 -30 42 123 -85 437 652 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