File name: Pandora32s1_GreenbeltMD_20231128_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20231129T063156.0Z 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_20231128_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: 20231128 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 20231128T124826.6Z 8732.533641 288 1 48.92 2 83.42 124.34 83.59 299.41 0.00 1 0.00 1 0 25 2.881e-01 2.687e-02 1.147e-01 9.210e-03 8.846980e-01 4.959009e-03 1.001827e-02 -6.000000e+00 1.617983e-01 223.40 -2.00 3.47 -2.00 321.92 0.00e+00 5.101647e-03 2.292283e-03 1.599743e-03 -6.000000e+00 7.169478e-03 280.14 -2.00 20.00 -2.00 321.43 0.00e+00 7.932 0.009 302.00 328.00 3 7.2811e-01 1.7380e-02 9.0499e-02 -6.0000e+00 3.9850e-01 1.2867e+00 2.0953e-02 4.5501e-02 -6.0000e+00 4.3373e-01 -1.7655e+00 1.4346e-02 2.3418e-02 -6.0000e+00 2.5890e-01 7.2038e-01 7.3833e-03 8.3021e-03 -6.0000e+00 1.1119e-01 4.1306e-05 -1.7416e-03 2.3645e-04 1.3627e-04 -6.0000e+00 7.6655e-03 8.3846e-03 -1.0289e-04 12 8 8 10 0 0 45.03 20.61 1.31 0.00838 -0.00470 49 11 1 5 0 998.230 25.39 20.00 20.61 6.67 3.8 893.26 -23819 26396 -19139 -3560 -32085 -73517 -24210 -86837 -20582 -51813 -64662 -90194 -42783 -17843 30564 42994 -22535 23279 16674 66555 34098 -4176 53763 -43578 13786 -216 1451 5667 -34742 15798 -9234 -4440 130848 26904 12610 -15276 23989 -853 -12196 52268 25742 76622 7708 64644 25937 51506 32984 27092 70543 10814 21908 36857 40230 66518 35608 46877 24632 24032 26685 2613 32055 2398 20760 14187 19375 23845 27263 30950 11660 26340 11866 10220 16858 14712 9343 -7327 -2926 -5168 -11024 -4724 -6299 7805 -6464 -2168 5490 995 10891 -1027 4229 -410 -2392 647 -2911 -3462 -8023 -2471 -2860 -4594 -1653 -4012 -2334 -4299 -6112 -4851 -4399 -1991 -3188 -765 -3111 -2521 -474 99 -440 -1048 1248 -1143 -1306 -1093 479 1769 917 2685 3705 1978 2536 1611 3183 122 1084 1337 573 566 -302 779 956 -65 -113 -384 294 -326 36 -1035 -2848 -1517 1121 -1266 -180 -1755 -5043 -929 -6169 -756 -2538 -3432 -6260 -2166 -874 1123 1615 -1767 1198 926 2391 1593 -259 1738 -3380 669 -12 74 255 -2153 596 -514 -283 2468 1522 770 -1111 1164 -58 -1085 2817 1988 3716 755 3542 2027 3053 2340 2068 3612 1059 2086 3344 3830 5198 3966 4758 3142 3000 3044 354 3167 338 2760 2306 3272 3877 4212 4726 2346 5228 3016 2754 4179 3462 2073 -1685 -589 -1072 -2723 -1324 -2156 2706 -2903 -999 2475 451 5155 -513 2003 -217 -1210 298 -1349 -1679 -4219 -1465 -2027 -3890 -1539 -3990 -2184 -3676 -4712 -3541 -3380 -1600 -2744 -694 -3224 -3010 -640 148 -689 -1652 1863 -1689 -1933 -1688 773 2939 1520 4168 5415 2862 3554 2214 4177 171 1731 2298 1130 1223 -705 1932 2545 -171 -304 -1049 797 -855 93 -2521 -6645 SS 20231128T125913.2Z 8732.541125 291 1 48.59 2 81.71 126.19 85.32 300.93 0.00 1 0.00 1 0 25 5.208e-01 1.835e-02 6.708e-02 3.277e-03 7.784083e-01 1.744890e-03 9.061685e-03 -6.000000e+00 2.924131e-01 223.40 -2.00 3.47 -2.00 321.50 0.00e+00 7.931513e-03 8.769516e-04 3.652696e-03 -6.000000e+00 1.295735e-02 280.14 -2.00 20.00 -2.00 321.01 0.00e+00 6.517 0.005 302.00 328.00 3 6.8313e-01 6.0546e-03 7.6872e-02 -6.0000e+00 7.2019e-01 4.9533e-01 8.1405e-03 4.3416e-02 -6.0000e+00 7.8388e-01 -7.1625e-01 7.6836e-03 2.5395e-02 -6.0000e+00 4.6791e-01 2.9802e-01 3.6532e-03 1.0113e-02 -6.0000e+00 2.0095e-01 1.9760e-04 -1.5099e-03 8.5459e-05 1.6189e-04 -6.0000e+00 1.3855e-02 8.5072e-03 -1.1481e-04 12 8 8 10 0 0 34.92 20.62 0.76 0.00851 -0.00284 121 28 1 5 0 401.530 25.39 20.00 20.62 7.38 3.7 897.14 -169734 -146531 -135540 -139100 -176210 -158303 -168734 -177510 -157079 -167195 -139248 -171626 -116806 -92649 -69168 -52245 -60374 -25509 -34225 -24819 -45141 -45695 -15137 -44534 -18397 -43677 -41490 -38548 -37775 -36087 -18502 1142 37909 2136 5116 -14442 16920 12932 15307 30685 15188 25819 10944 26422 16978 19228 19773 23649 19719 10455 19089 25273 24278 28791 19284 22563 16006 12885 14067 8520 9926 8361 15328 11321 12943 9422 11714 10976 6195 9270 7102 5699 5596 4008 2326 124 -838 -2245 -3750 -1339 -828 -276 -3858 -1962 -1236 -1755 -284 -568 566 -381 -492 -1173 -3008 -2853 -3230 -2034 -1787 -452 -908 -1214 -1123 -1993 -2039 -1566 -2113 -2533 -1889 -1406 -931 -317 -104 -184 286 237 411 -223 381 464 220 248 702 1311 1626 1434 1244 1090 1412 1205 737 658 660 219 96 251 56 -230 -255 -116 -154 -198 -215 -675 -1145 -3452 -2852 -2559 -2667 -4351 -3238 -3775 -4595 -3564 -4381 -2803 -5156 -2538 -2102 -1614 -1269 -1833 -603 -952 -650 -1457 -1431 -343 -1409 -470 -1480 -1379 -1207 -1147 -1142 -585 37 1006 89 203 -655 579 525 729 1490 976 1609 832 1773 1264 1426 1498 1791 1638 1019 1885 2641 2832 3487 2730 3201 2255 1860 2126 1312 1519 1411 2516 2230 2756 2099 2512 2430 1567 2620 2296 1970 1928 1324 710 34 -216 -590 -1117 -468 -345 -133 -2161 -1155 -766 -1066 -179 -373 369 -244 -296 -727 -1825 -1773 -2075 -1523 -1576 -458 -960 -1335 -1277 -2051 -1872 -1383 -1990 -2563 -2005 -1594 -1071 -413 -154 -298 475 389 645 -338 572 725 365 400 1123 2152 2539 2178 1834 1557 1941 1705 1187 1144 1289 466 203 564 135 -590 -630 -291 -385 -513 -519 -1518 -2453 SS 20231128T131625.2Z 8732.553069 296 1 48.55 2 79.07 129.24 88.03 303.42 0.00 1 0.00 1 0 25 3.873e-01 8.916e-03 2.688e-02 1.153e-03 6.343270e-01 5.953619e-04 7.235168e-03 -6.000000e+00 2.175259e-01 223.40 -2.00 3.47 -2.00 320.62 0.00e+00 3.537312e-03 2.394504e-04 8.833825e-04 -6.000000e+00 9.638518e-03 280.14 -2.00 20.00 -2.00 320.07 0.00e+00 5.084 0.002 302.00 328.00 3 4.6409e-01 1.8291e-03 5.9554e-02 -6.0000e+00 5.3575e-01 9.4481e-02 2.3553e-03 3.2707e-02 -6.0000e+00 5.8311e-01 -1.3810e-01 2.2812e-03 1.7695e-02 -6.0000e+00 3.4806e-01 5.2425e-02 1.1402e-03 6.6734e-03 -6.0000e+00 1.4950e-01 1.1389e-03 -8.7324e-04 3.0763e-05 7.4519e-05 -6.0000e+00 1.0305e-02 7.7657e-03 -1.1342e-04 11 8 0 10 0 0 31.67 20.65 0.41 0.00777 0.00120 335 79 1 5 0 144.900 25.39 20.00 20.65 8.10 3.7 900.76 -155928 -137260 -136495 -118651 -119575 -146844 -102098 -140630 -98256 -106070 -103145 -92449 -83628 -63736 -51087 -33115 -36276 -25672 -15309 -24926 -17123 -26875 -15733 -15895 -18920 -14253 -21461 -15035 -25146 -15355 -6458 -9173 7105 -6325 -3057 -7565 -8940 1174 -1576 5334 677 4099 823 3541 6456 4501 3480 3023 3106 3179 4529 6663 4879 5493 3697 4085 3647 1981 2091 1058 2672 2248 4133 4112 2377 2601 1721 1106 1491 1908 1190 425 794 -364 -186 -714 -1649 -1753 -2308 -1398 -1629 -1080 -2105 -2220 -1127 -1166 -140 -5 298 574 170 466 -674 -474 -387 -198 105 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