File name: Pandora32s1_GreenbeltMD_20240404_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240405T051632.3Z 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_20240404_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: 20240404 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 20240404T111816.8Z 8860.471027 100 1 48.14 2 84.68 86.60 68.17 146.03 0.00 1 0.00 1 0 25 3.018e-01 4.468e-02 1.639e-01 2.371e-02 1.208612e+00 1.367366e-02 1.394145e-02 -6.000000e+00 1.724524e-01 227.97 -2.00 3.47 -2.00 321.85 0.00e+00 -2.545295e-02 3.655478e-03 3.548917e-03 -6.000000e+00 7.511516e-03 280.16 -2.00 20.00 -2.00 321.25 0.00e+00 9.386 0.014 302.00 328.00 3 -7.2351e-02 4.1910e-02 1.1933e-01 -6.0000e+00 4.2920e-01 2.6235e+00 4.8685e-02 9.0602e-02 -6.0000e+00 4.6556e-01 -2.8201e+00 2.7365e-02 3.0035e-02 -6.0000e+00 2.7693e-01 9.5612e-01 1.6091e-02 2.1918e-02 -6.0000e+00 1.1784e-01 1.2394e-05 9.2953e-04 5.4406e-04 2.7030e-04 -6.0000e+00 8.0360e-03 6.0085e-03 -8.9050e-05 12 8 8 10 0 0 83.44 20.81 2.04 0.00601 0.01299 28 7 1 5 0 1718.930 25.47 20.00 20.81 9.77 4.4 926.80 49248 58416 45459 33393 8975 -47374 -7681 -10378 23871 -20060 -15811 91 49481 20517 13674 84393 7613 38041 -3196 43678 24781 -33342 35274 3227 29143 14005 38687 29682 -47501 -79030 -30795 -60193 -30994 -9745 -47881 -30662 -51936 -15526 -55322 150536 18820 74065 13537 29828 67800 -17695 13270 37703 -2326 3782 -27030 15784 -3789 64172 6920 64938 67415 8860 18237 -25813 29273 -35304 6046 -4071 -15974 6920 -1099 39025 8271 39615 8693 -4048 25782 21210 3239 -23908 7526 -34319 -29385 -12353 -6091 29409 -273 13828 23112 2521 54326 10683 18704 -3290 2143 25208 -3001 -5836 20489 9787 8340 6528 8211 100 -161 -9350 -12501 -9433 -4756 2208 -6387 -2465 1622 2218 1972 4197 2022 -210 2198 -1467 -1711 -5662 492 -1629 1014 1450 167 -1867 364 -1241 2227 -1320 -472 3412 -435 -4488 -671 -852 3595 -103 -530 -1734 1180 1131 144 1450 -1076 7452 7735 6019 4000 1037 -8065 -888 -1374 2458 -3331 -2492 12 4264 2501 1897 6031 1168 4158 -497 3856 2344 -4975 2595 366 2879 1648 3252 2246 -6290 -13122 -3430 -10247 -4299 -1106 -7145 -3415 -7095 -1664 -10697 4872 2294 5822 1679 3103 4232 -2332 1196 2615 -247 402 -4312 1825 -578 5341 1088 6005 6234 1413 2361 -4476 2639 -6121 769 -649 -3102 1072 -186 4692 1511 6045 1969 -1067 4828 3727 584 -4809 1009 -7220 -6726 -2884 -1605 6391 -90 4252 6786 944 12434 3803 5967 -1232 703 6236 -992 -2172 6916 4435 4570 4271 5942 81 -124 -6895 -8265 -5757 -2914 1337 -4445 -1795 1297 2108 2229 4789 2524 -274 2762 -1871 -2201 -7902 678 -2335 1357 1971 217 -2412 452 -1527 2595 -1715 -664 5608 -867 -10441 -1649 -2308 10147 -320 -1690 -5627 3674 3342 390 3505 -2508 SS 20240404T113014.4Z 8860.479334 103 1 48.48 2 82.36 88.47 66.92 148.64 0.00 1 0.00 1 0 25 4.102e-01 2.235e-02 9.682e-02 4.290e-03 1.047332e+00 2.404541e-03 1.134530e-02 -6.000000e+00 2.343563e-01 227.98 -2.00 3.47 -2.00 322.12 0.00e+00 8.006891e-03 1.334666e-03 2.564142e-03 -6.000000e+00 1.020849e-02 280.16 -2.00 20.00 -2.00 321.68 0.00e+00 6.991 0.006 302.00 328.00 3 1.6036e-01 9.0225e-03 9.2034e-02 -6.0000e+00 5.8326e-01 1.2246e+00 1.1972e-02 6.5940e-02 -6.0000e+00 6.3272e-01 -1.6645e+00 1.0463e-02 3.0077e-02 -6.0000e+00 3.7635e-01 6.7920e-01 4.9485e-03 1.2732e-02 -6.0000e+00 1.6013e-01 1.3706e-04 -2.0720e-03 1.0158e-04 1.5016e-04 -6.0000e+00 1.0923e-02 5.7520e-03 -1.4291e-04 12 8 8 10 0 0 10.00 20.83 0.67 0.00575 -0.00982 120 28 1 5 0 403.930 25.47 20.00 20.83 10.58 4.4 932.43 -100716 -75524 -108795 -42639 -98077 -126646 -43220 -155801 -90857 -156764 -89571 -136187 -96814 -31002 -62590 -22936 -42074 14438 -1463 31496 28920 -54560 35783 -47730 2362 -20576 -48482 -21585 -71439 -24226 -24697 -10889 32053 -6405 50734 -19591 10077 6632 16073 47973 34272 58533 -4923 61737 45501 31462 50668 11059 50056 7592 47001 51635 55271 76993 28898 51110 33254 38842 35510 12279 35494 11314 37117 26485 26269 24713 21203 27258 13643 27042 19783 16791 18381 7863 11836 -2791 7052 1114 -3344 2899 -1085 6420 -1139 1438 4512 502 3791 -614 3230 767 246 1551 -3629 -4356 -5866 -3366 -3619 -2093 -1503 -3287 -528 -3704 -3065 -3279 -3966 -3796 -3824 -1704 -2821 -792 -1476 -626 4 -882 234 -596 -420 -400 -259 1029 895 2763 2239 2150 2084 1381 2090 1223 885 853 708 621 199 235 59 141 289 -101 181 -424 -35 -1112 -2190 -2720 -1838 -3807 -714 -2387 -3468 -524 -5274 -1786 -5366 -1686 -3936 -2592 -571 -1857 -614 -1549 326 -40 619 557 -2214 554 -1717 52 -568 -1704 -542 -2809 -628 -785 -383 872 -279 1189 -844 320 241 625 1586 1448 2057 -336 2170 1846 1461 1971 666 2178 546 2537 3003 3422 4155 2672 3892 3061 3299 2927 1192 2673 1160 3385 3147 3506 3453 3087 3911 2247 4484 3928 3589 3796 1666 2134 -559 1177 203 -665 668 -318 2061 -448 593 1903 232 1770 -308 1555 365 110 649 -1569 -2008 -3186 -2161 -2580 -1746 -1426 -3338 -500 -3223 -2309 -2541 -2964 -3023 -3218 -1520 -2866 -927 -2040 -892 6 -1352 346 -865 -609 -606 -414 1680 1429 4065 3112 3139 2966 1924 2808 1728 1351 1560 1391 1355 472 601 152 386 805 -284 502 -1135 -91 -2673 -4949 SS 20240404T114825.7Z 8860.491964 108 1 48.60 2 78.82 91.33 65.18 152.74 0.00 1 0.00 1 0 25 6.502e-01 1.157e-02 3.305e-02 1.077e-03 8.069049e-01 5.775292e-04 9.097005e-03 -6.000000e+00 3.716045e-01 227.98 -2.00 3.47 -2.00 321.09 0.00e+00 5.024144e-03 2.663407e-04 2.110058e-03 -6.000000e+00 1.618470e-02 280.16 -2.00 20.00 -2.00 320.58 0.00e+00 4.979 0.002 302.00 328.00 3 1.5318e-01 1.8762e-03 6.5347e-02 -6.0000e+00 9.2485e-01 2.0808e-01 2.6212e-03 4.3457e-02 -6.0000e+00 1.0032e+00 -2.9145e-01 2.7348e-03 2.4877e-02 -6.0000e+00 5.9670e-01 1.1794e-01 1.3073e-03 9.6326e-03 -6.0000e+00 2.5396e-01 1.3335e-03 -8.3050e-04 2.6810e-05 1.1539e-04 -6.0000e+00 1.7314e-02 4.2072e-03 -1.2140e-04 12 8 8 10 0 0 -7.97 20.87 0.36 0.00421 -0.00203 425 100 1 5 0 114.340 25.58 19.99 20.87 11.96 4.4 939.58 -206641 -216177 -203419 -200631 -218722 -204231 -206635 -193407 -194174 -190982 -194637 -174103 -144460 -118307 -98080 -82181 -76294 -63454 -64516 -37152 -50336 -46982 -50210 -48161 -44353 -49147 -39414 -42608 -48016 -47699 -30150 -21414 -9960 -1822 -9407 -12673 -13760 -10592 -4046 2188 6009 6181 3377 6571 5718 9044 6230 8872 5569 4783 7761 8624 10079 9361 9740 7610 6333 4598 3074 3153 3518 4760 6019 6503 5480 5173 4621 3552 3510 3703 2681 2991 1865 1533 289 -833 -1530 -2372 -2206 -1131 -882 -968 -2186 -2000 -1106 -707 -130 111 95 538 107 57 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