File name: Pandora89s1_PaloDuroTX_20250822_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250823T065412.5Z 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_20250822_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: 20250822 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 20250822T124416.2Z 9365.530742 53 1 53.90 2 84.47 79.73 76.29 79.45 0.00 1 0.00 1 0 25 6.111e-01 3.627e-02 3.787e-01 1.321e-02 9.064681e-01 8.178076e-03 9.318650e-03 -6.000000e+00 3.673946e-01 230.15 -2.00 3.36 -2.00 322.36 0.00e+00 -4.691891e-03 5.644139e-03 2.425496e-03 -6.000000e+00 2.192394e-02 287.25 -2.00 20.00 -2.00 321.90 0.00e+00 9.109 0.011 302.00 328.00 3 1.2044e+00 3.7107e-02 9.5305e-02 -6.0000e+00 9.1593e-01 1.0016e+00 5.1525e-02 5.3402e-02 -6.0000e+00 9.9492e-01 -1.3808e+00 4.7027e-02 2.5381e-02 -6.0000e+00 5.9381e-01 5.3878e-01 2.1111e-02 7.8257e-03 -6.0000e+00 2.6157e-01 2.2055e-05 -3.5197e-04 3.9274e-04 1.0786e-04 -6.0000e+00 1.7628e-02 6.6010e-02 0.0000e+00 12 9 8 11 8 0 26.34 26.46 1.53 0.06601 0.06337 35 4 1 5 0 1539.940 34.00 20.00 26.46 24.60 6.0 943.67 900000 -149495 -97512 900000 900000 -198440 -123282 900000 900000 40557 900000 900000 900000 900000 900000 900000 900000 42382 -71606 -41026 900000 900000 900000 -30248 900000 900000 49615 900000 900000 900000 -14550 202334 -54147 130798 74296 900000 -54965 125411 900000 165579 199238 -3000 55992 900000 116355 900000 167231 900000 110236 69149 6008 199631 23601 55802 85808 60336 95612 54324 -3824 108023 42290 7169 66911 25149 29274 39282 15904 9618 806 21685 23909 27090 10128 27568 -1190 1838 38771 12962 24892 -3929 8989 11563 29485 7215 14089 15896 1560 -39673 1937 -1982 807 -8387 -4538 -4881 2321 57 -482 -2925 4892 -2432 236 4356 -6744 601 3015 -2116 -3220 1980 1392 -2112 107 1092 1248 -2692 533 -3187 -2148 -2060 -1507 1173 5141 2810 2832 582 2770 -1063 -510 -289 4050 -399 -26 -814 -394 390 86 506 69 36 1440 -198 -2249 -1123 900000 -4788 -1666 900000 900000 -7415 -2369 900000 900000 520 900000 900000 900000 900000 900000 900000 900000 543 -2585 -1051 900000 900000 900000 -775 900000 900000 636 900000 900000 900000 -390 2592 -2586 1676 952 900000 -2881 1607 900000 2121 2553 -161 1630 900000 1762 900000 2142 900000 2054 2175 399 2558 1567 2860 3738 3479 3797 3062 -363 3321 2709 744 4372 2674 2963 3623 1956 1405 149 3584 4013 4304 1765 3603 -183 257 3874 1926 3986 -1002 2349 3289 7479 2440 4729 5478 636 -24295 752 -746 280 -3159 -1756 -2195 1157 34 -343 -2373 3716 -1872 159 2512 -4303 384 1997 -1567 -2628 1725 1416 -2559 139 1452 1645 -3566 664 -4181 -2937 -2985 -2246 1664 6652 3578 3509 715 3247 -1264 -643 -426 6667 -776 -49 -1697 -880 936 220 1309 182 95 3545 -460 -4924 -2558 SS 20250822T125634.4Z 9365.539287 56 1 54.28 2 81.98 81.44 73.90 81.07 0.00 1 0.00 1 0 17 5.980e-01 1.027e-02 1.669e-01 2.183e-03 7.475022e-01 1.173793e-03 8.463744e-03 -6.000000e+00 3.430399e-01 230.15 -2.00 3.36 -2.00 321.26 0.00e+00 2.253196e-03 6.102904e-04 5.262525e-03 -6.000000e+00 1.539966e-02 287.25 -2.00 20.00 -2.00 320.67 0.00e+00 6.708 0.004 302.00 328.00 3 9.1750e-01 4.1728e-03 7.4613e-02 -6.0000e+00 8.5588e-01 7.5385e-02 6.0337e-03 5.0206e-02 -6.0000e+00 9.2723e-01 -1.8513e-01 6.3338e-03 2.3998e-02 -6.0000e+00 5.5266e-01 7.6089e-02 2.9612e-03 6.1587e-03 -6.0000e+00 2.3646e-01 2.8847e-04 3.8560e-04 5.7064e-05 1.1713e-04 -6.0000e+00 1.6087e-02 6.4454e-02 0.0000e+00 12 8 8 10 0 0 16.96 26.46 0.57 0.06445 0.06735 157 17 1 5 0 345.720 34.00 20.00 26.46 25.56 6.1 952.21 -221033 -188521 -147427 -249487 -209030 -246326 -247344 -139085 -79167 -155466 -178881 -77976 23052 -63567 187674 -35166 460 -74244 -40305 -24513 -63858 -18210 -11336 -20340 -22224 34706 -6424 -32676 -5157 29836 -23934 -21977 -7844 -14460 -16685 23872 -26406 5032 -1091 7237 3858 4134 2247 5237 2806 4104 6170 3205 3386 -1254 3484 8665 6128 5282 5284 2259 3428 2639 -6119 5380 3731 4678 4994 1876 902 -1981 -2054 4020 1715 1669 1993 2227 1069 -2758 -1991 -4631 -3949 -4098 -1088 -1511 84 -1350 380 -513 1909 2161 2451 -773 1343 655 -450 -1619 -2014 -1672 -1314 114 696 395 -397 -1206 -1151 -1006 -2155 -1040 -781 -845 -772 509 1203 1443 879 539 50 -893 -712 -704 -170 252 67 537 1224 970 511 377 -309 -726 137 -149 -23 -437 -319 -578 -137 -232 -96 366 826 626 256 -12 -799 -695 -1882 -1277 -656 -2848 -1577 -2955 -3446 -753 -260 -1173 -1973 -407 58 -492 399 -322 3 -1248 -515 -277 -1074 -205 -133 -286 -341 310 -85 -556 -74 368 -621 -664 -225 -431 -504 533 -1169 202 -57 397 238 270 154 356 201 300 465 265 305 -134 404 1060 849 794 835 383 575 433 -1074 869 679 973 1188 494 238 -538 -585 1202 612 603 753 831 419 -1023 -656 -1472 -1280 -1514 -471 -708 45 -811 239 -349 1357 1612 1880 -614 1007 462 -302 -1068 -1393 -1310 -1105 111 719 451 -459 -1321 -1226 -968 -2100 -1083 -858 -984 -895 644 1719 2148 1412 879 80 -1371 -1049 -1048 -265 415 115 901 1953 1495 765 545 -468 -1070 210 -245 -39 -850 -625 -1201 -303 -520 -226 878 2007 1521 597 -27 -1754 -1468 SS 20250822T131218.7Z 9365.550216 61 1 54.12 2 78.78 83.62 70.82 83.16 0.00 1 0.00 1 0 17 2.272e-01 8.563e-03 1.425e-02 7.186e-04 5.838680e-01 3.708410e-04 6.442805e-03 -6.000000e+00 1.303469e-01 230.15 -2.00 3.36 -2.00 319.94 0.00e+00 2.057113e-03 1.235566e-04 1.492564e-03 -6.000000e+00 5.851599e-03 287.25 -2.00 20.00 -2.00 319.22 0.00e+00 4.964 0.002 302.00 328.00 3 5.9538e-01 1.0947e-03 5.2960e-02 -6.0000e+00 3.2521e-01 -4.9513e-03 1.3366e-03 2.9910e-02 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