File name: Pandora89s1_PaloDuroTX_20251031_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20251101T063328.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Kevin Mishoe Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 89 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora89_OF_v3d20240314.txt Instrument calibration file used: Pandora89s1_CF_v2d20241101.txt Level 1 file used: Pandora89s1_PaloDuroTX_20251031_L1_smca1c2d20241101p1-8.txt Full location name: Palo Duro, TX Short location name: PaloDuroTX Country of location: United States Location latitude [deg]: 34.8806 Location longitude [deg]: -101.6647 Location altitude [m]: 1056 Local noon date: 20251031 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: OOB session based clearance session 1 First and last pixel inside fitting window: 194 335 Nominal wavelengths inside fitting window [nm]: 305.1224 305.2633 305.4042 305.5451 305.6860 305.8269 305.9677 306.1085 306.2494 306.3902 306.5310 306.6718 306.8126 306.9533 307.0941 307.2349 307.3756 307.5163 307.6570 307.7977 307.9384 308.0791 308.2198 308.3604 308.5011 308.6417 308.7823 308.9230 309.0636 309.2041 309.3447 309.4853 309.6258 309.7664 309.9069 310.0474 310.1879 310.3284 310.4689 310.6094 310.7499 310.8903 311.0307 311.1712 311.3116 311.4520 311.5924 311.7328 311.8731 312.0135 312.1538 312.2942 312.4345 312.5748 312.7151 312.8554 312.9957 313.1359 313.2762 313.4164 313.5566 313.6969 313.8371 313.9773 314.1174 314.2576 314.3978 314.5379 314.6781 314.8182 314.9583 315.0984 315.2385 315.3786 315.5186 315.6587 315.7987 315.9388 316.0788 316.2188 316.3588 316.4988 316.6387 316.7787 316.9186 317.0586 317.1985 317.3384 317.4783 317.6182 317.7581 317.8979 318.0378 318.1776 318.3175 318.4573 318.5971 318.7369 318.8767 319.0164 319.1562 319.2959 319.4357 319.5754 319.7151 319.8548 319.9945 320.1342 320.2738 320.4135 320.5531 320.6928 320.8324 320.9720 321.1116 321.2512 321.3907 321.5303 321.6698 321.8094 321.9489 322.0884 322.2279 322.3674 322.5068 322.6463 322.7857 322.9252 323.0646 323.2040 323.3434 323.4828 323.6222 323.7616 323.9009 324.0403 324.1796 324.3189 324.4582 324.5975 324.7368 324.8761 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20251031T133843.8Z 9435.568562 77 1 54.13 2 84.69 111.55 156.01 334.55 0.00 1 0.00 1 0 25 6.163e-01 4.213e-02 2.984e-01 1.610e-02 9.423574e-01 9.771930e-03 1.038549e-02 -6.000000e+00 3.684855e-01 225.03 -2.00 3.36 -2.00 322.32 0.00e+00 -1.151774e-02 6.120134e-03 1.343455e-02 -6.000000e+00 2.320976e-02 280.71 -2.00 20.00 -2.00 321.88 0.00e+00 9.411 0.013 302.00 328.00 3 1.1084e+00 3.9961e-02 1.2063e-01 -6.0000e+00 9.1327e-01 1.5475e+00 4.5070e-02 9.0454e-02 -6.0000e+00 1.0090e+00 -2.0238e+00 3.0452e-02 2.3489e-02 -6.0000e+00 5.8710e-01 7.8270e-01 1.5967e-02 1.2444e-02 -6.0000e+00 2.4963e-01 1.6671e-05 -1.8991e-04 4.6433e-04 2.6496e-04 -6.0000e+00 1.7865e-02 7.7459e-02 0.0000e+00 12 9 8 11 32 0 10.40 25.38 1.55 0.07746 0.07603 27 3 1 5 0 2004.440 33.25 19.99 25.38 13.67 6.1 863.91 94640 -43542 -39263 900000 900000 -73957 51691 900000 900000 165534 900000 900000 900000 900000 900000 96906 212055 900000 26583 12412 900000 116427 900000 65067 900000 900000 900000 273150 900000 900000 -51445 900000 900000 -18360 900000 900000 -15665 139222 900000 900000 900000 52972 57524 267023 96135 900000 -24167 130110 -11989 900000 80124 51311 -5142 97024 900000 48942 86332 67222 60805 48351 18750 -6098 113620 17816 52364 34523 102345 32607 -8595 12037 28330 137 19628 22811 -15531 30366 106575 16813 -3483 17862 7627 6611 27970 -810 23379 24464 17813 -17766 963 -12768 12805 -21027 -19315 10809 7950 -7647 -1633 -2287 -921 232 6388 -2536 -7328 8856 3329 -11002 -6269 6413 -1712 8 -4527 -2115 -647 -5264 -346 -1802 -1954 -4448 2290 2160 8388 -911 8053 -1037 3680 3302 223 -262 3211 1932 1646 -1397 1165 619 -1489 1525 -38 780 1114 238 -2838 -3189 2461 -4133 -2961 900000 900000 -5674 1210 900000 900000 2583 900000 900000 900000 900000 900000 2394 3309 900000 1320 651 900000 1982 900000 2123 900000 900000 900000 4262 900000 900000 -4817 900000 900000 -1224 900000 900000 -1133 2567 900000 900000 900000 2931 2856 4167 2864 900000 -2331 2769 -1122 900000 3637 3348 -635 4542 900000 3888 4531 3910 3450 3018 1676 -787 5496 2363 4821 3825 6069 4325 -1971 2442 4995 31 3308 3275 -2860 3317 5654 2519 -772 3791 2083 2022 7332 -301 7187 7711 6087 -8539 365 -5160 3817 -8793 -8590 4149 3734 -4952 -1162 -1805 -720 168 3858 -1500 -4540 5030 2114 -8584 -5106 5214 -1763 9 -6054 -2855 -855 -7047 -429 -2308 -2637 -6511 3212 2939 10144 -1164 9160 -1256 4146 3663 275 -385 5326 3666 3426 -2929 2572 1484 -3836 3873 -98 1994 2673 530 -6617 -7152 SS 20251031T135240.0Z 9435.578241 80 1 54.28 2 82.05 113.67 156.96 342.34 0.00 1 0.00 1 0 17 5.363e-01 1.088e-02 1.331e-01 2.416e-03 7.327614e-01 1.275404e-03 8.003931e-03 -6.000000e+00 3.012327e-01 225.03 -2.00 3.36 -2.00 321.20 0.00e+00 2.196728e-03 6.263327e-04 3.676043e-03 -6.000000e+00 1.346646e-02 280.71 -2.00 20.00 -2.00 320.67 0.00e+00 6.764 0.005 302.00 328.00 3 1.0894e+00 4.2788e-03 7.1326e-02 -6.0000e+00 7.4413e-01 1.2305e-01 6.1152e-03 4.1742e-02 -6.0000e+00 8.1070e-01 -2.2641e-01 6.5862e-03 2.3035e-02 -6.0000e+00 4.8353e-01 9.4036e-02 3.1119e-03 7.5543e-03 -6.0000e+00 2.0759e-01 2.3700e-04 1.1153e-03 6.2927e-05 1.1449e-04 -6.0000e+00 1.4464e-02 7.8270e-02 0.0000e+00 12 9 8 11 8 0 14.42 25.39 0.56 0.07827 0.08665 122 13 1 5 0 444.820 33.25 19.99 25.39 14.82 6.1 874.71 -190240 -249493 -218104 -114968 -160885 -224193 -212274 -165798 -24859 -157070 -154973 -80536 900000 -25667 -3118 -63641 -39650 -57825 -36998 -21979 -63431 -23840 13561 -12826 -9678 7605 -27785 -6711 1249 34275 -12223 -17451 16899 -24459 -5214 18747 -2036 -2712 3836 6002 13939 10071 4102 1350 2394 22461 9332 1807 1089 7143 4417 7817 2082 6681 8235 1046 3174 590 -4665 4431 1663 4392 6580 402 1737 -174 -1121 697 1390 1675 2045 1579 485 -1796 -4799 -2627 -1917 -3714 -1766 -1434 -173 -1795 435 -512 1417 1221 2175 1087 1467 680 -291 -2717 -2541 -1808 -951 -16 721 329 117 -729 -1080 -1674 -1846 -1022 -891 -895 -499 1061 891 1367 696 553 -167 -1245 -603 -547 -222 -230 -104 207 1116 1035 856 365 -546 -319 562 -133 24 -342 -153 -287 -95 -318 18 568 854 556 165 -135 -828 -873 -1711 -4381 -2709 -468 -1034 -2976 -2864 -1598 -64 -1614 -1825 -586 900000 -181 -24 -1004 -551 -1049 -575 -300 -1315 -354 153 -205 -160 107 -543 -106 20 492 -340 -600 442 -928 -163 517 -83 -138 220 382 883 700 310 107 192 1524 758 169 112 781 561 1061 329 1075 1368 193 568 105 -858 773 333 988 1651 113 476 -49 -334 229 527 633 801 609 195 -669 -1651 -839 -632 -1435 -806 -700 -96 -1113 280 -357 1033 936 1694 853 1099 478 -195 -1825 -1800 -1456 -817 -16 821 377 134 -847 -1125 -1601 -1798 -1067 -979 -1044 -579 1346 1288 2043 1112 889 -262 -1875 -870 -802 -341 -375 -174 340 1733 1554 1340 553 -808 -459 854 -218 44 -656 -314 -582 -206 -742 41 1319 2009 1302 392 -301 -1741 -1905 SS 20251031T140915.6Z 9435.589763 85 1 54.11 2 78.97 116.29 157.61 352.21 0.00 1 0.00 1 0 25 2.063e-01 8.648e-03 1.640e-02 8.599e-04 5.719069e-01 4.349424e-04 6.277325e-03 -6.000000e+00 1.158157e-01 225.03 -2.00 3.36 -2.00 319.90 0.00e+00 2.293059e-03 1.420289e-04 1.230914e-03 -6.000000e+00 5.170317e-03 280.71 -2.00 20.00 -2.00 319.28 0.00e+00 5.043 0.002 302.00 328.00 3 9.3123e-01 1.2586e-03 5.2445e-02 -6.0000e+00 2.8613e-01 1.0050e-02 1.5304e-03 2.8188e-02 -6.0000e+00 3.1172e-01 -6.3375e-02 1.3590e-03 1.5050e-02 -6.0000e+00 1.8584e-01 2.8696e-02 7.0582e-04 5.4803e-03 -6.0000e+00 7.9744e-02 1.3648e-03 1.1384e-03 2.3051e-05 5.9713e-05 -6.0000e+00 5.5429e-03 7.8979e-02 0.0000e+00 11 8 0 10 0 0 29.01 25.37 0.47 0.07898 0.08753 314 34 1 5 0 172.310 33.25 20.00 25.37 17.44 6.1 893.08 -78869 -85668 -70602 -70935 -76949 -78880 -72461 -58095 -45903 -55186 -57608 -47560 -16184 -15815 -14567 -17448 -11330 -14603 -6169 -6598 -12545 -8717 -2942 -7162 -5665 -5401 -10639 -11162 -4762 -1934 -3947 -2522 -1414 -7802 -5251 -2102 -2980 -807 873 566 1317 1141 1552 2210 276 3015 242 -101 590 2602 2308 2764 2102 2622 2282 998 1058 241 -445 1475 1903 2773 3092 471 354 -793 -1035 142 95 996 936 932 765 -730 -1929 -2821 -3027 -2370 -1963 -1202 -1194 -1941 -1162 -480 657 955 1464 1601 1339 1049 -291 -1070 -1221 -1117 -476 473 805 334 -176 -643 -1183 -1134 -863 -1410 -906 -863 -457 556 812 1245 589 539 -51 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