File name: Pandora32s1_GreenbeltMD_20240716_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240717T051922.9Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240716_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: 20240716 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 20240716T105204.4Z 8963.452829 67 1 48.26 2 80.79 70.08 150.84 297.66 0.00 1 0.00 1 0 25 3.622e-01 2.553e-02 1.939e-01 1.083e-02 7.310038e-01 5.848540e-03 8.809781e-03 -6.000000e+00 2.109487e-01 232.63 -2.00 3.47 -2.00 321.48 0.00e+00 2.840708e-03 2.776147e-03 7.039088e-03 -6.000000e+00 9.461220e-03 290.27 -2.00 20.00 -2.00 320.84 0.00e+00 5.925 0.004 302.00 328.00 3 3.1532e+00 2.0780e-02 7.9587e-02 -6.0000e+00 5.2972e-01 7.2383e-01 2.5799e-02 6.1705e-02 -6.0000e+00 5.7233e-01 -1.0991e+00 1.8321e-02 2.2351e-02 -6.0000e+00 3.4080e-01 4.5843e-01 9.0246e-03 6.3351e-03 -6.0000e+00 1.4460e-01 2.9338e-05 -2.9114e-04 2.9575e-04 9.8304e-05 -6.0000e+00 9.6627e-03 8.8783e-03 -8.8093e-05 12 8 8 10 0 0 45.73 22.01 1.57 0.00888 0.00669 17 4 1 5 0 2838.580 26.32 20.00 22.01 31.97 4.8 1047.14 14581 -88343 -67092 -55592 -82786 -93690 -28979 63872 -89065 -58859 -96306 -102072 -46638 -20686 19387 -20913 -29849 19210 69823 900000 5056 -12544 77206 -8369 1890 72683 180274 20372 -12448 -30460 -8789 -26812 134715 1012 8017 9211 -37883 -4725 397 61909 42450 46556 53238 34297 15647 13969 58423 70755 8495 66892 3692 51214 38412 30116 26586 12603 14472 5423 20311 8878 13569 15429 11163 21710 10715 8744 10424 4701 12498 16175 7418 -3210 4425 4962 -2427 -1786 -15149 -1318 -6346 1914 -1960 2397 538 -3130 -1085 -1994 -2809 -1184 -2872 1635 -2794 6544 -3858 -4588 -5089 -234 -1480 -2596 -1013 -2228 -2125 -4019 -5283 -1734 -4324 -2901 -3193 -896 173 -2172 89 1647 938 49 526 602 539 -1085 -162 1130 1079 1927 2372 1305 2100 1383 1495 1612 -539 2480 511 754 -652 653 -482 1225 -198 -1706 216 -204 363 -1082 -1625 280 -5341 -3348 -2294 -3813 -4226 -667 674 -4188 -2090 -4898 -5681 -1746 -808 614 -1044 -1776 811 1843 900000 251 -702 1712 -451 96 1841 1903 796 -631 -1865 -492 -2123 2418 74 516 545 -3679 -374 36 3529 3271 3637 3990 3114 1685 1519 4070 4407 1013 4660 526 5028 4663 4260 4097 2302 2643 1070 3302 1546 2249 2687 2286 4515 2669 2197 2498 1211 3232 4627 2576 -1183 1649 1734 -830 -539 -4781 -360 -2010 663 -836 1129 261 -1679 -606 -1198 -1796 -770 -1905 1006 -1686 3696 -2103 -2571 -3199 -164 -1227 -2519 -1079 -2473 -2244 -3896 -4680 -1456 -3984 -2820 -3288 -967 203 -2956 133 2417 1421 74 817 897 802 -1716 -248 1791 1711 3189 3746 2023 3122 2000 2081 2304 -886 4168 976 1547 -1434 1511 -1212 2958 -497 -4419 548 -505 905 -2543 -3659 SS 20240716T110233.3Z 8963.460107 72 1 48.32 2 78.86 71.61 152.55 300.97 0.00 1 0.00 1 0 17 4.057e-01 1.173e-02 1.089e-01 4.173e-03 6.477843e-01 2.237627e-03 7.535891e-03 -6.000000e+00 2.359103e-01 232.63 -2.00 3.47 -2.00 321.02 0.00e+00 2.604127e-03 1.028453e-03 3.468767e-03 -6.000000e+00 1.053821e-02 290.27 -2.00 20.00 -2.00 320.35 0.00e+00 4.992 0.002 302.00 328.00 3 2.7728e+00 7.5833e-03 6.2297e-02 -6.0000e+00 5.9174e-01 1.3811e-01 9.9534e-03 4.0285e-02 -6.0000e+00 6.3852e-01 -3.0496e-01 8.8387e-03 1.9090e-02 -6.0000e+00 3.8068e-01 1.2915e-01 4.2810e-03 4.9295e-03 -6.0000e+00 1.6199e-01 1.2215e-04 -4.0443e-04 1.1453e-04 7.8362e-05 -6.0000e+00 1.0819e-02 7.9715e-03 -5.2530e-05 12 8 8 10 0 0 29.87 22.05 0.92 0.00797 0.00493 42 10 1 5 0 1150.240 26.32 20.00 22.05 32.61 4.8 1051.43 -155377 -150007 -88734 -113591 -144678 -144566 -35569 -140192 -141277 -138249 -117430 -111958 -44757 -71965 -74099 -13054 -45048 -31019 -14854 6516 -42868 -42195 7116 -33347 -6016 -6835 28943 -25134 -21765 -32530 -8851 -4676 41100 -6169 -7278 2038 -25258 -9006 1573 12059 1977 6936 -1356 16674 8273 5046 10833 14826 -371 4688 3155 14223 8472 6189 6807 1960 5831 3495 6391 6349 2140 5794 4306 6176 4587 3584 2050 1425 1811 3441 1464 1866 1910 1362 -1247 -1962 -2245 -2406 -2648 -1002 -1354 -2328 -2004 -1169 253 -221 -914 230 213 1108 -41 1061 -1742 -1057 -2033 -909 -537 701 -657 -528 -1055 -1541 -1689 -477 -2006 -1883 -800 -411 219 23 106 299 475 230 425 429 238 83 540 266 -36 315 861 1121 444 182 386 641 148 654 517 -346 -47 -5 -204 189 -24 -373 31 -179 -210 -100 -523 -2719 -2991 -1047 -1710 -2708 -2530 -217 -2739 -3162 -3263 -2342 -2278 -565 -1523 -2020 -234 -1265 -833 -369 138 -1535 -1494 156 -1181 -176 -214 648 -941 -762 -1311 -324 -198 1288 -341 -400 98 -1686 -597 115 962 200 723 -162 1710 933 598 1234 1665 -50 641 438 2182 1382 1124 1312 415 1230 759 1315 1273 454 1282 1096 1748 1422 1114 627 445 611 1319 643 866 890 610 -528 -751 -790 -837 -1006 -442 -708 -1416 -1237 -765 174 -163 -723 187 174 875 -31 735 -1177 -714 -1527 -780 -533 730 -771 -637 -1216 -1614 -1741 -479 -2186 -2026 -897 -489 282 33 158 478 772 365 637 660 365 132 848 442 -61 511 1333 1807 695 275 558 942 243 1128 987 -666 -95 -10 -468 430 -56 -891 75 -419 -493 -221 -1107 SS 20240716T110828.5Z 8963.464219 75 1 48.66 2 77.77 72.47 153.50 302.98 0.00 1 0.00 1 0 17 3.240e-01 8.656e-03 5.854e-02 2.419e-03 6.059621e-01 1.283638e-03 7.014325e-03 -6.000000e+00 1.884394e-01 232.63 -2.00 3.47 -2.00 320.63 0.00e+00 2.367386e-03 5.212686e-04 2.243225e-03 -6.000000e+00 8.417759e-03 290.27 -2.00 20.00 -2.00 319.92 0.00e+00 4.580 0.002 302.00 328.00 3 2.3025e+00 4.0769e-03 5.6354e-02 -6.0000e+00 4.7267e-01 5.6354e-02 5.2483e-03 3.4343e-02 -6.0000e+00 5.1004e-01 -1.5243e-01 4.6975e-03 1.7083e-02 -6.0000e+00 3.0408e-01 5.9859e-02 2.3346e-03 4.7308e-03 -6.0000e+00 1.2939e-01 2.9944e-04 -5.5168e-04 6.6593e-05 6.2565e-05 -6.0000e+00 8.6420e-03 7.8340e-03 -6.4244e-05 11 8 0 10 0 0 17.23 22.07 0.63 0.00783 0.00369 80 19 1 5 0 608.230 26.32 20.00 22.07 32.97 4.8 1053.38 -122631 -106999 -100704 -103463 -105217 -110936 -64960 -95336 -99960 -116276 -99118 -108332 -56541 -64821 -36333 -26559 -15338 3645 3244 -13170 -26821 -24489 -8816 -20992 -6960 -1734 -4623 -12667 -18655 -15572 -17072 -340 10188 -7051 -6081 -5141 -12579 -7020 -7605 4442 -347 1688 -5328 5099 5814 2576 5932 4499 607 -884 1673 6696 6250 4760 2719 1804 2922 460 1973 517 999 3777 3470 4115 3036 1534 391 1032 1221 1436 1319 1040 921 642 -77 -821 -1193 -2470 -2543 -977 -1532 -748 -1788 -1722 -10 -262 153 349 1066 840 345 1464 -652 -909 -661 -585 -706 552 -447 -801 -897 -1421 -1298 -484 -1280 -1416 -1105 -612 -77 240 536 537 521 353 401 115 410 164 59 176 -38 357 819 483 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