File name: Pandora32s1_GreenbeltMD_20250111_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250112T052041.9Z 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 v1.8.60 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250111_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: 20250111 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 20250111T134701.4Z 9142.574321 260 1 18.53 2 77.83 131.41 111.45 342.02 0.00 1 0.00 1 0 25 4.376e-01 1.132e-02 2.583e-01 5.645e-03 7.071465e-01 2.959281e-03 8.092670e-03 -6.000000e+00 2.478976e-01 223.81 -2.00 3.47 -2.00 320.87 0.00e+00 4.599062e-03 1.257813e-03 1.992586e-03 -6.000000e+00 1.080375e-02 276.73 -2.00 20.00 -2.00 320.38 0.00e+00 4.604 0.002 302.00 328.00 3 2.8123e+00 9.2508e-03 5.8377e-02 -6.0000e+00 6.1163e-01 1.4073e-01 1.2478e-02 3.7438e-02 -6.0000e+00 6.6592e-01 -1.7957e-01 1.3096e-02 2.1749e-02 -6.0000e+00 3.9538e-01 7.2598e-02 6.4346e-03 8.5083e-03 -6.0000e+00 1.6868e-01 1.5104e-04 -8.9715e-04 1.4885e-04 1.0235e-04 -6.0000e+00 1.1700e-02 4.1632e-03 -7.5646e-05 12 9 9 12 1 1 99.99 19.30 0.49 0.00416 -0.00258 16 11 1 5 0 1089.920 24.56 20.66 19.30 2.32 5.2 877.02 -138638 -160791 -214691 -37504 -152449 -222388 900000 -120499 -62001 -12985 -134985 -1430 -112354 -941 11435 -35581 -56900 -68967 21211 -23629 113914 -12620 102030 25212 -34880 11810 -32622 -25412 -27581 -23569 24592 -36785 33213 -12958 -8174 -9298 11651 942 -13631 6895 -2582 6288 2376 3314 7040 -1721 11705 5052 11586 5265 -64 10501 850 10983 958 6800 4735 -4139 5244 -6116 7457 164 5119 4366 2822 5144 3461 7047 967 3496 1937 654 1543 112 -72 -2547 -688 -4422 -5541 -2357 -1563 -967 -596 -2450 -357 -2036 2135 -1 -35 14 -890 799 -1835 -1174 -878 151 606 -267 399 -426 -487 -1233 -1465 546 -1055 -1370 -863 -101 89 287 484 464 365 743 403 10 -574 224 491 383 -373 334 292 223 1050 414 -249 796 -416 617 -204 28 -90 -56 -87 -457 -410 -99 453 0 49 298 -682 -1096 -1948 -4849 -206 -1808 -4845 900000 -1151 -382 -71 -1944 -8 -1780 -7 94 -571 -1302 -1978 285 -517 692 -258 709 395 -1046 243 -1051 -758 -829 -719 559 -1818 1012 -676 -407 -451 487 50 -1012 508 -237 580 241 346 723 -196 1215 579 1314 675 -9 1584 155 1985 203 1423 1045 -995 1131 -1425 1554 39 1330 1295 922 1659 1111 2233 349 1402 874 314 738 52 -31 -1017 -250 -1655 -2275 -1100 -844 -589 -398 -1758 -265 -1616 1713 -1 -30 11 -704 590 -1328 -855 -694 134 608 -302 489 -539 -593 -1393 -1519 546 -1116 -1533 -999 -122 116 405 744 754 605 1209 633 16 -869 347 790 638 -624 542 459 342 1561 601 -353 1133 -649 1055 -379 55 -182 -118 -193 -1048 -956 -233 1062 0 109 628 -1395 SS 20250111T135219.6Z 9142.578005 263 1 1.60 2 77.06 132.39 111.74 343.18 0.00 1 0.00 1 0 17 5.697e-01 1.920e-02 3.785e-01 1.579e-02 6.841418e-01 8.311173e-03 7.726741e-03 -6.000000e+00 3.235252e-01 223.81 -2.00 3.47 -2.00 320.54 0.00e+00 6.949318e-03 3.227021e-03 5.374117e-04 -6.000000e+00 1.561184e-02 276.73 -2.00 20.00 -2.00 320.03 0.00e+00 4.350 0.001 302.00 328.00 3 2.2636e+00 2.4956e-02 5.5630e-02 -6.0000e+00 7.9966e-01 1.1899e-01 3.2403e-02 3.6474e-02 -6.0000e+00 8.7150e-01 -1.1252e-01 3.2797e-02 1.9945e-02 -6.0000e+00 5.1557e-01 3.5914e-02 1.6465e-02 1.0706e-02 -6.0000e+00 2.2189e-01 3.3358e-04 -1.2142e-03 4.1617e-04 8.9072e-05 -6.0000e+00 1.5517e-02 1.1709e-03 -1.6438e-04 12 9 9 12 1 1 999.00 19.28 0.30 0.00117 -0.00795 1 14 1 5 0 795.330 24.56 20.54 19.28 2.50 5.2 878.08 64773 -47603 900000 -109350 900000 -103454 900000 -227526 -93823 900000 -75826 900000 -96634 -18300 -107275 -52317 24918 -25637 417132 -21001 -55832 32506 34540 -8287 -39849 286778 -46955 -40472 102477 7440 122275 -20083 -10354 8034 -30617 -21244 -528 73690 -33276 22257 -1025 -1486 907 -771 29699 -5412 331 14769 -13554 14316 7235 6414 3906 7462 5697 2538 1939 -7735 12316 -52 2348 1536 -2022 8952 3239 -495 4364 1549 5536 -1494 6638 1789 3558 -3664 -5847 4050 -2051 63 -1210 -2767 -2844 888 -1586 -3367 5727 -4543 -620 863 -1466 3618 -3230 2584 -233 -2417 2742 -1255 -889 -529 -670 965 -1130 136 -1722 2007 -3322 -522 1933 -617 1403 -8 428 -322 -654 -319 -573 1642 1242 -247 -1444 -1071 585 336 603 1772 -1131 1035 -40 1683 -322 1086 -52 -1188 -689 6 1177 -380 905 683 -394 -20 189 156 -2058 997 -732 900000 -1683 900000 -1592 900000 -7007 -1444 900000 -1167 900000 -1530 -282 -3231 -1170 383 -586 6418 -540 -2074 529 559 -213 -1478 4413 -2031 -1644 1577 204 1881 -1023 -572 417 -2272 -1392 -30 2410 -3545 1695 -110 -175 111 -100 2978 -770 46 1875 -2344 2039 1206 1205 825 1656 1367 650 514 -2243 2929 -13 607 431 -659 2993 1230 -195 1618 597 2206 -711 3264 960 1891 -1985 -3008 1753 -867 26 -544 -1457 -1725 587 -1166 -2640 4389 -3952 -546 773 -1342 3128 -2806 2039 -180 -1911 2245 -1185 -938 -616 -845 1231 -1415 156 -1856 2062 -3697 -597 2253 -765 1820 -11 653 -518 -1073 -513 -893 2438 1833 -378 -2310 -1764 955 536 933 2658 -1690 1486 -56 2363 -492 1798 -94 -2236 -1335 11 2435 -823 1975 1505 -877 -44 397 315 -4071 SS 20250111T141543.3Z 9142.594252 273 1 48.47 2 73.82 136.90 112.78 348.37 0.00 1 0.00 1 0 25 1.611e-01 6.023e-03 7.034e-02 2.366e-03 5.636316e-01 1.211903e-03 6.409726e-03 -6.000000e+00 9.070846e-02 223.81 -2.00 3.47 -2.00 320.29 0.00e+00 2.746568e-03 4.299525e-04 4.065671e-04 -6.000000e+00 3.954334e-03 276.73 -2.00 20.00 -2.00 319.76 0.00e+00 3.530 0.001 302.00 328.00 3 3.1224e+00 3.5680e-03 4.5057e-02 -6.0000e+00 2.2387e-01 1.6401e-02 4.4515e-03 2.8799e-02 -6.0000e+00 2.4364e-01 -2.6568e-03 4.2535e-03 1.5289e-02 -6.0000e+00 1.4510e-01 -5.5440e-03 2.1814e-03 5.8457e-03 -6.0000e+00 6.2145e-02 3.5968e-04 -3.6265e-05 6.5448e-05 5.6893e-05 -6.0000e+00 4.2847e-03 2.0651e-03 -1.7184e-05 10 0 0 10 0 0 100.00 19.35 0.31 0.00207 0.00179 177 42 1 5 0 273.770 24.56 20.55 19.35 3.51 5.2 883.18 -4141 -70622 -82617 -57439 -65135 -25390 -28296 -50631 -47519 -42057 -20346 -65038 -14952 -30069 28 4209 -22887 -9022 -10633 13861 -7084 -10742 -392 -20177 538 -11945 -3266 -5315 -6015 -9210 -6814 332 1834 -1719 -3329 -10318 727 -4160 697 -1712 -1019 -657 -3411 2245 915 3164 1111 1333 -47 -2734 1419 1399 3311 2839 1521 1580 412 588 -234 -352 2224 1615 3134 1837 1414 1174 1791 254 -105 2090 176 194 338 -102 -874 -1201 188 -230 -578 -886 -1420 -1142 -2122 -1964 -1005 -699 290 -380 23 473 507 1707 126 396 302 799 430 615 219 16 -223 -783 -765 -120 -640 -1107 -1183 -751 -252 364 599 299 527 425 263 64 399 -294 -127 -399 -614 98 390 155 271 411 -38 590 378 311 283 -292 -280 -124 -2 -33 -232 142 182 -210 154 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