File name: Pandora32s1_GreenbeltMD_20241127_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241128T050022.1Z 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_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241127_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: 20241127 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 20241127T123813.9Z 9097.526549 154 1 49.71 2 85.03 122.60 54.78 152.76 0.00 1 0.00 1 0 17 4.315e-01 5.100e-02 2.689e-01 3.289e-02 9.601324e-01 1.795084e-02 1.084209e-02 -6.000000e+00 2.424357e-01 223.40 -2.00 3.47 -2.00 321.51 0.00e+00 -2.093214e-02 4.647535e-03 5.903353e-03 -6.000000e+00 1.077322e-02 280.14 -2.00 20.00 -2.00 320.92 0.00e+00 9.874 0.017 302.00 328.00 3 4.2857e-01 5.3877e-02 1.2049e-01 -6.0000e+00 5.9709e-01 1.9675e+00 6.2545e-02 9.1140e-02 -6.0000e+00 6.5015e-01 -2.2988e+00 3.4993e-02 2.3375e-02 -6.0000e+00 3.8784e-01 8.6441e-01 2.0554e-02 2.2722e-02 -6.0000e+00 1.6772e-01 7.6666e-06 3.4829e-04 8.1929e-04 2.2768e-04 -6.0000e+00 1.1578e-02 7.5385e-03 -5.3470e-05 12 8 8 10 0 0 98.34 20.20 2.41 0.00754 0.01016 18 4 1 5 0 2761.460 25.28 21.05 20.20 10.69 5.2 924.23 900000 70489 10534 -5910 663 -42684 -16582 45514 24141 6471 -16648 -30051 113676 -7942 15196 51064 17107 27043 -12586 68906 20226 17983 58961 -11718 44972 24964 205153 -35128 11098 -45125 -20932 -55671 32459 -31121 -3800 -2889 -57076 -27045 -8239 51887 13425 96223 193823 99087 188398 40926 21322 157320 40570 12349 7643 12679 11585 77710 43099 64458 25679 38122 16075 6473 -7227 -7253 45013 -20047 -10621 13830 3483 45425 -2503 61600 6411 3070 16081 24506 -28223 -30630 2744 14828 -28641 -1428 5001 33787 9396 13630 16516 -191 17945 -6970 12690 -4867 917 41928 -2371 -1840 -15441 2609 466 2388 11109 -1829 -1702 -14597 -16466 -14101 -1779 -5144 -472 -3468 -3583 -1538 -5073 5841 3236 1752 3159 -3029 873 284 6188 -4097 3980 2108 2105 -46 4647 -264 1908 -1017 -3066 5838 1638 1129 -3298 -1685 -111 2939 -2217 -3817 2946 1585 -1315 995 -128 900000 8426 2058 -1120 91 -7591 -2272 3716 2675 887 -2815 -5695 5303 -1320 2127 5211 2444 3390 -2238 5023 2182 1783 3782 -1674 4065 2839 6580 -5735 938 -6052 -2319 -9739 2555 -4718 -399 -270 -9153 -3627 -1105 4538 1918 6789 6216 6038 6042 3675 2188 5045 3383 1426 1005 1748 1746 6480 5391 6822 4118 5257 2526 996 -1182 -1210 4908 -4693 -2418 2440 670 5973 -586 8693 1727 886 3971 5109 -8780 -8448 493 2378 -7900 -357 1396 8235 3285 4896 6091 -88 7136 -3621 5332 -2326 385 11026 -958 -785 -8666 1447 311 1815 8658 -1672 -1474 -12828 -13097 -10627 -1261 -4025 -373 -3048 -3540 -1737 -6257 7186 4293 2370 4098 -4054 1238 423 9169 -6331 6114 3124 2970 -65 6096 -354 2435 -1406 -5034 9429 3148 2395 -7886 -4293 -302 8208 -6669 -11775 8434 4398 -3462 2341 -287 SS 20241127T125051.5Z 9097.535319 157 1 48.67 2 82.99 124.73 53.79 156.31 0.00 1 0.00 1 0 25 4.291e-01 2.071e-02 1.385e-01 5.346e-03 8.589453e-01 2.897176e-03 9.670901e-03 -6.000000e+00 2.409127e-01 223.40 -2.00 3.47 -2.00 321.90 0.00e+00 8.615618e-03 1.580048e-03 2.236631e-03 -6.000000e+00 1.067578e-02 280.14 -2.00 20.00 -2.00 321.43 0.00e+00 7.524 0.007 302.00 328.00 3 3.7820e-01 1.0792e-02 8.7060e-02 -6.0000e+00 5.9335e-01 8.2383e-01 1.4354e-02 4.6434e-02 -6.0000e+00 6.4587e-01 -1.1452e+00 1.2957e-02 2.5580e-02 -6.0000e+00 3.8553e-01 4.7435e-01 6.1041e-03 1.0734e-02 -6.0000e+00 1.6554e-01 9.2566e-05 -1.8280e-03 1.3962e-04 1.7168e-04 -6.0000e+00 1.1418e-02 7.9134e-03 -1.9290e-04 12 8 8 10 0 0 91.49 20.22 0.83 0.00791 -0.00582 85 20 1 5 0 572.460 25.28 20.17 20.22 10.85 5.3 926.61 -11367 -107020 -154652 -64516 -151966 -120410 -73183 -149596 -94676 -140822 -147109 -165938 -62993 -59907 -41625 -7205 -55467 -7287 -21041 89948 -4845 -44398 35425 -77010 3086 -47317 -17450 -14058 -61630 -22194 8116 -7670 23346 -1308 55765 -14083 9054 7935 17242 26213 30867 47585 -236 52194 44076 30753 27329 26696 30419 19533 34468 39614 33817 43469 21228 34272 25677 30724 22995 9566 28111 10059 23519 14151 17238 19899 14529 18497 6726 17493 10056 11867 9150 6218 7557 -4119 625 -3416 -6250 -1580 -1545 2760 -2553 -988 -565 -1032 1964 -1853 2286 249 616 1943 -3846 -2267 -4782 -1633 -3439 -808 -1665 -2519 -798 -2945 -3046 -1392 -4343 -2980 -3481 -1938 -1092 -238 -122 -494 -50 -529 843 -680 -624 411 -172 1017 490 2159 2070 1744 2114 752 1369 1008 875 365 677 899 70 333 56 -4 103 -225 110 -567 -37 -566 -1694 -86 -2485 -6084 -978 -4754 -2397 -954 -3900 -1629 -3537 -3904 -5662 -1051 -1281 -955 -143 -2024 -179 -625 891 -121 -1551 536 -3654 68 -1727 -464 -344 -2346 -602 195 -268 706 -55 1279 -602 312 310 728 1189 1497 2084 -17 2313 2114 1699 1596 1628 1887 1446 2426 2974 2962 3739 2413 3520 2918 3268 2518 1142 2785 1290 3029 2317 3020 3444 2628 3317 1348 3623 2502 3043 2385 1562 1687 -1005 134 -773 -1493 -437 -515 1031 -1130 -462 -279 -542 1053 -1067 1266 136 316 926 -1881 -1134 -2790 -1100 -2808 -692 -1626 -2584 -769 -2596 -2599 -1122 -3814 -2762 -3144 -1859 -1156 -289 -169 -763 -80 -846 1284 -1013 -929 633 -282 1590 826 3410 3113 2557 3002 1050 1840 1408 1402 636 1337 1933 163 766 139 -12 276 -614 298 -1497 -89 -1377 -3932 SS 20241127T130140.6Z 9097.542830 160 1 48.71 2 81.28 126.61 53.05 159.42 0.00 1 0.00 1 0 17 5.911e-01 1.380e-02 5.372e-02 2.085e-03 7.525231e-01 1.104459e-03 8.604216e-03 -6.000000e+00 3.319269e-01 223.40 -2.00 3.47 -2.00 321.29 0.00e+00 5.556709e-03 5.412855e-04 2.780467e-03 -6.000000e+00 1.470741e-02 280.14 -2.00 20.00 -2.00 320.78 0.00e+00 6.234 0.004 302.00 328.00 3 2.6606e-01 3.7408e-03 7.3267e-02 -6.0000e+00 8.1751e-01 2.8209e-01 5.1380e-03 4.1208e-02 -6.0000e+00 8.8980e-01 -4.0347e-01 5.1587e-03 2.3623e-02 -6.0000e+00 5.3113e-01 1.6708e-01 2.4537e-03 8.8847e-03 -6.0000e+00 2.2812e-01 4.1238e-04 -1.1673e-03 5.4728e-05 1.2442e-04 -6.0000e+00 1.5727e-02 6.6318e-03 -1.7586e-04 12 8 8 10 0 0 98.45 20.36 0.49 0.00663 -0.00214 192 45 1 5 0 253.630 25.39 20.33 20.36 11.68 5.3 931.64 -183426 -194910 -186079 -174756 -189152 -204785 -192789 -180364 -178110 -172908 -174197 -177821 -123020 -135524 -56090 -63326 -63243 -55671 -47481 -13097 -47438 -35450 -29685 -56681 -23099 -39401 -13885 -33012 -30568 -31518 -20330 -6007 -7518 6046 -8051 -16391 -943 -9584 3573 8560 15985 11424 1681 13229 10918 17633 9851 16260 15951 7550 11439 10755 12901 12467 12315 10082 6817 8471 5468 8447 6860 8128 9323 7577 8232 6013 6190 5285 3698 5288 2561 3954 2558 2607 560 -1149 -786 -3312 -1873 -1251 -556 -471 -2998 -2006 -1597 -905 -361 -282 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