File name: Pandora89s1_PaloDuroTX_20250729_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250730T211210.8Z 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_20250729_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: 20250729 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 20250729T122632.6Z 9341.518433 48 1 54.69 2 84.71 70.97 138.09 47.23 0.00 1 0.00 1 0 17 6.169e-01 2.863e-02 3.322e-01 1.024e-02 9.919442e-01 6.314989e-03 1.024927e-02 -6.000000e+00 3.688635e-01 231.06 -2.00 3.36 -2.00 322.43 0.00e+00 -6.654250e-03 4.241327e-03 1.420975e-03 -6.000000e+00 2.173301e-02 287.42 -2.00 20.00 -2.00 322.00 0.00e+00 9.416 0.013 302.00 328.00 3 5.0703e-01 2.8508e-02 9.9184e-02 -6.0000e+00 9.2529e-01 1.2377e+00 3.9869e-02 5.4626e-02 -6.0000e+00 1.0063e+00 -1.6658e+00 3.5424e-02 2.8033e-02 -6.0000e+00 5.9643e-01 6.5730e-01 1.5869e-02 8.2254e-03 -6.0000e+00 2.5913e-01 2.9706e-05 -9.2038e-04 2.8605e-04 1.1996e-04 -6.0000e+00 1.7569e-02 6.4065e-02 0.0000e+00 12 9 8 11 8 0 19.93 26.36 1.07 0.06407 0.05715 49 5 1 5 0 1116.010 34.00 20.00 26.36 28.00 5.9 968.49 900000 -43062 -151521 900000 900000 -33986 -112210 900000 900000 -155593 900000 900000 900000 900000 900000 -65747 900000 900000 -73677 9583 -32712 67209 900000 -56416 900000 900000 190356 900000 900000 900000 44261 120818 62160 -11849 170153 900000 -38895 29325 207764 57725 97932 93895 33577 256592 59367 900000 94617 77517 43240 118836 93483 56477 11010 93389 188007 60626 51328 80585 -3280 142719 25685 30443 44473 19572 20428 13344 9188 33993 8644 24374 16294 33745 -1875 12049 7009 -11342 40496 8961 17753 4357 12920 2429 21617 -3612 15331 11303 7540 -29084 3077 -4167 3875 -7838 -5716 -2566 2203 -950 -460 -787 -1034 -1684 1107 -2595 -8091 604 13 -3935 -1464 3330 1460 -665 -906 -158 -1049 -2792 -1350 -481 -755 -2243 730 765 3199 2154 2396 2492 3369 1603 -172 -836 928 -291 -34 -1206 563 740 -1211 1235 591 1113 1428 -980 -1584 -2871 900000 -642 -5899 900000 900000 -338 -2417 900000 900000 -5800 900000 900000 900000 900000 900000 -2436 900000 900000 -3063 165 -798 668 900000 -2039 900000 900000 1892 900000 900000 900000 680 1201 955 -353 1691 900000 -1722 795 2065 1565 1859 1867 1183 2551 1502 900000 1710 1751 1485 2148 2450 2583 786 3435 2803 3315 3010 3284 -287 2837 1762 2270 3316 2023 2092 1486 1133 3650 1383 3683 2770 4696 -343 1701 913 -1657 3663 1283 2841 957 3057 717 5630 -1289 4801 3843 2721 -15034 1107 -1504 1225 -2774 -2131 -1082 1062 -563 -319 -615 -826 -1277 730 -1573 -5075 373 9 -2863 -1135 2784 1455 -788 -1191 -215 -1444 -3802 -1764 -632 -1045 -3336 1087 1108 4261 2775 2996 3023 3956 1871 -218 -1259 1473 -531 -69 -2648 1313 1868 -3295 3343 1629 3030 3673 -2374 -3548 -6183 SS 20250729T123845.9Z 9341.526920 51 1 54.05 2 82.33 72.63 136.31 50.67 0.00 1 0.00 1 0 17 7.034e-01 1.156e-02 1.263e-01 1.970e-03 7.982806e-01 1.064235e-03 9.051029e-03 -6.000000e+00 4.048589e-01 231.06 -2.00 3.36 -2.00 321.35 0.00e+00 8.767301e-04 5.670644e-04 6.276293e-03 -6.000000e+00 1.812440e-02 287.42 -2.00 20.00 -2.00 320.78 0.00e+00 6.966 0.005 302.00 328.00 3 4.4831e-01 3.8450e-03 8.0372e-02 -6.0000e+00 1.0123e+00 1.1078e-01 5.6538e-03 5.8427e-02 -6.0000e+00 1.0959e+00 -2.2825e-01 5.9442e-03 2.5486e-02 -6.0000e+00 6.5275e-01 9.7790e-02 2.7519e-03 6.3378e-03 -6.0000e+00 2.7880e-01 3.4858e-04 4.7027e-04 5.0386e-05 1.1624e-04 -6.0000e+00 1.8924e-02 6.3780e-02 0.0000e+00 12 8 8 10 0 0 2.41 26.38 0.48 0.06378 0.06731 200 21 1 5 0 270.230 34.00 20.00 26.38 28.23 5.9 970.43 -284586 -273413 -265045 -223802 -251661 -231203 -248482 -104564 -166041 -229245 -212483 -97658 -32226 -103542 37632 -90492 -42527 -78133 -99754 -72261 -79029 -31484 -16183 -32497 -50703 -1269 -40521 -43795 -37097 15446 -17130 -29633 6261 -34036 -26364 45858 -19819 -559 14744 994 -1052 929 -2042 3481 321 14147 -2247 -42 -840 6516 6706 9201 4007 5703 10426 4587 7321 4886 -4283 9665 2955 5876 8706 2552 50 1381 542 1899 2902 3128 2986 4091 1821 535 -1439 -2344 -2333 -1811 -815 -840 -247 -1591 -683 47 980 1227 1621 -501 1732 431 -620 -2241 -2871 -1638 -1385 -259 144 655 -84 -1075 -1734 -1722 -2251 -1303 -1220 -973 -880 620 926 1136 1036 964 76 -1114 -704 -768 -107 233 328 444 1425 1376 670 447 -312 -426 103 -183 105 -268 -362 -438 -222 58 -98 500 694 550 10 -143 -850 -765 -3429 -3247 -2870 -1485 -2198 -1817 -2691 -310 -1015 -2843 -2598 -495 -113 -958 116 -1059 -384 -1111 -1878 -1069 -1260 -333 -165 -431 -867 -14 -631 -698 -613 187 -355 -831 135 -1066 -760 714 -716 -21 578 51 -60 56 -129 212 21 826 -163 -3 -71 582 684 1022 520 785 1448 704 1096 726 -680 1374 498 1113 1850 622 12 343 143 554 979 1067 1071 1436 677 183 -449 -695 -715 -632 -311 -381 -130 -942 -428 31 692 833 1129 -357 1269 299 -410 -1473 -1997 -1180 -1174 -255 151 758 -98 -1198 -1744 -1691 -2217 -1371 -1254 -1056 -1033 796 1257 1740 1599 1515 118 -1789 -1084 -1196 -174 373 544 723 2343 2179 1033 666 -453 -601 152 -292 192 -514 -751 -910 -491 137 -233 1202 1692 1341 23 -330 -1843 -1595 SS 20250729T125634.5Z 9341.539288 56 1 54.21 2 78.82 75.01 133.56 55.30 0.00 1 0.00 1 0 17 2.423e-01 8.855e-03 1.267e-02 6.210e-04 6.038901e-01 3.209926e-04 6.650614e-03 -6.000000e+00 1.394790e-01 231.06 -2.00 3.36 -2.00 319.92 0.00e+00 1.835501e-03 1.063205e-04 1.649961e-03 -6.000000e+00 6.243724e-03 287.42 -2.00 20.00 -2.00 319.19 0.00e+00 4.979 0.002 302.00 328.00 3 2.6531e-01 9.4432e-04 5.3817e-02 -6.0000e+00 3.4876e-01 1.4899e-02 1.1547e-03 3.1188e-02 -6.0000e+00 3.7755e-01 -7.0782e-02 1.0078e-03 1.5744e-02 -6.0000e+00 2.2488e-01 3.2324e-02 5.2093e-04 4.7063e-03 -6.0000e+00 9.6054e-02 2.6213e-03 5.5383e-04 1.6456e-05 5.5063e-05 -6.0000e+00 6.5192e-03 6.3453e-02 0.0000e+00 11 8 0 10 0 0 22.93 26.38 0.42 0.06345 0.06762 599 64 1 5 0 90.480 33.75 20.00 26.38 29.19 6.0 977.34 -88497 -71501 -79039 -94678 -94823 -92811 -88056 -72169 -65241 -74267 -67982 -50424 -33219 -24949 -15399 -14407 -10407 -16392 -8109 -6401 -11992 -6587 -2858 -6420 -5455 -6545 -10328 -10620 -7788 -6738 -2354 -2239 -2384 -7179 -6796 -4619 -5696 -1368 1720 1266 2037 1028 896 1592 1284 1136 318 -885 486 895 1378 2263 1874 1949 2142 1245 940 657 -77 1602 2101 3319 3171 1524 999 -415 -590 391 538 934 1297 1069 675 -496 -1433 -2352 -3615 -2617 -2016 -1352 -1128 -1934 -1186 -584 178 1049 1375 1657 1447 916 64 -1047 -1144 -1063 -758 309 818 239 -199 -555 -1340 -1371 -833 -1286 -1153 -881 -487 303 930 1097 633 525 44 -686 -639 -484 -14 250 365 379 925 982 483 471 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