File name: Pandora89s1_PaloDuroTX_20250912_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250913T065040.9Z 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_20250912_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: 20250912 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 20250912T125739.7Z 9386.540043 219 1 54.83 2 84.71 88.87 31.54 257.84 0.00 1 0.00 1 0 25 7.494e-01 3.912e-02 3.582e-01 1.504e-02 8.990047e-01 9.428488e-03 9.462208e-03 -6.000000e+00 4.539056e-01 228.87 -2.00 3.36 -2.00 322.33 0.00e+00 -7.955874e-04 6.363632e-03 4.652180e-03 -6.000000e+00 3.158875e-02 285.96 -2.00 20.00 -2.00 321.87 0.00e+00 9.428 0.013 302.00 328.00 3 1.0575e+00 4.1109e-02 1.0006e-01 -6.0000e+00 1.1217e+00 1.1494e+00 5.2634e-02 5.8069e-02 -6.0000e+00 1.2235e+00 -1.4727e+00 4.6850e-02 2.3709e-02 -6.0000e+00 7.2850e-01 5.7253e-01 2.1969e-02 8.5264e-03 -6.0000e+00 3.2158e-01 1.8246e-05 -1.7565e-03 4.5013e-04 1.2073e-04 -6.0000e+00 2.2254e-02 6.6367e-02 0.0000e+00 12 8 8 10 0 0 59.37 26.41 1.25 0.06637 0.05317 30 3 1 5 0 1827.300 34.00 20.00 26.41 24.03 6.0 938.61 900000 -80388 -147757 900000 900000 -116323 -41615 900000 900000 900000 92518 900000 900000 900000 900000 -11514 900000 -75995 -32930 -68084 900000 -860 900000 900000 900000 900000 900000 88667 900000 900000 -12117 900000 254912 22461 102020 900000 -9167 900000 362013 900000 900000 84283 113337 900000 900000 900000 374645 79636 829 900000 46400 90255 -10391 51262 184513 22193 63789 27446 35206 280626 62769 38736 72412 8374 42385 17989 3037 -102 4181 9550 25314 52450 18817 13828 1985 17862 41735 13484 16750 5347 6334 17517 26532 -3720 5791 15053 2180 -39526 632 -6363 4878 -12772 -5929 5318 1110 -2388 2014 -753 6395 -2322 229 2120 -4458 6547 861 1367 -8785 999 -984 1585 -1225 1289 1442 -2681 -626 -3410 -1420 -3120 -571 1577 3362 1643 6845 340 3097 -1270 -795 650 3229 -755 317 403 -212 -285 -2129 1131 428 889 2797 -1542 -1543 -1652 900000 -2050 -6639 900000 900000 -2825 -606 900000 900000 900000 1348 900000 900000 900000 900000 -290 900000 -3927 -1091 -3067 900000 -18 900000 900000 900000 900000 900000 1292 900000 900000 -385 900000 3715 565 1487 900000 -352 900000 5276 900000 900000 2122 2102 900000 900000 900000 5460 2110 52 900000 2274 3109 -1060 2988 2933 1823 3380 1964 2411 4090 3476 3105 4749 1123 4015 2176 447 -17 774 1851 4353 6726 3126 2156 307 2187 4136 2024 2954 1262 1726 4774 7037 -1420 2135 5287 893 -24480 252 -2541 1642 -5044 -2315 2139 555 -1465 1388 -597 4809 -1800 155 1254 -2761 3902 577 966 -7477 865 -1007 1820 -1591 1691 1877 -3513 -778 -4407 -1891 -4483 -829 2199 4371 2086 8021 411 3556 -1483 -975 919 5194 -1430 650 886 -459 -666 -5372 2821 1090 2249 6610 -3524 -3590 -3659 SS 20250912T131020.3Z 9386.548846 222 1 54.16 2 82.11 90.68 34.01 260.39 0.00 1 0.00 1 0 17 5.124e-01 9.868e-03 1.391e-01 2.345e-03 7.189496e-01 1.256375e-03 7.997432e-03 -6.000000e+00 2.924330e-01 228.87 -2.00 3.36 -2.00 321.18 0.00e+00 1.919383e-03 6.262547e-04 4.029204e-03 -6.000000e+00 1.312195e-02 285.96 -2.00 20.00 -2.00 320.59 0.00e+00 6.805 0.005 302.00 328.00 3 9.7469e-01 4.3224e-03 7.2425e-02 -6.0000e+00 7.2769e-01 9.7251e-02 6.1490e-03 4.3880e-02 -6.0000e+00 7.8936e-01 -1.9641e-01 6.4012e-03 2.2345e-02 -6.0000e+00 4.7062e-01 8.0485e-02 3.0209e-03 6.2788e-03 -6.0000e+00 2.0161e-01 2.5884e-04 4.6191e-04 6.1799e-05 9.9770e-05 -6.0000e+00 1.3779e-02 6.6110e-02 0.0000e+00 12 8 8 10 0 0 77.63 26.41 0.59 0.06611 0.06958 136 15 1 5 0 398.220 34.00 20.00 26.41 24.37 6.0 941.41 -135668 -213306 -203767 -168532 -103375 -213703 -208508 -175088 -68749 -101351 -189988 -92845 -51836 -64483 59401 -45969 15428 51316 -27910 -37158 -19428 -39594 -10235 -2867 -18934 -11059 -31898 -53233 -17155 48536 -11802 -9501 -8766 -43923 -11632 23628 -15538 1691 6115 -1834 6825 812 3139 1446 19 11026 1068 -1873 58 4863 1594 6980 3648 4473 8556 3804 3704 1333 -2013 5267 1408 3395 5941 2249 -575 -1616 -1589 2038 819 1086 2409 1293 1377 -1037 -657 -2061 -2389 -1983 -1691 -1735 -732 -1786 829 164 1699 1620 1743 -958 1487 903 -411 -2730 -2605 -1547 -1269 85 720 285 -22 -586 -1461 -958 -1596 -895 -908 -1153 -553 929 962 1253 557 447 103 -1006 -551 -580 -425 147 -56 449 1316 860 651 401 -201 -647 235 -155 -40 -193 -275 -377 -123 -123 -124 334 744 619 253 -70 -930 -692 -677 -2527 -2160 -1156 -365 -2487 -2644 -1820 -271 -590 -3080 -733 -356 -643 231 -589 120 305 -389 -586 -258 -679 -145 -41 -342 -190 -656 -1339 -329 588 -318 -295 -295 -2029 -386 610 -711 81 340 -126 465 62 242 115 2 844 94 -181 6 538 207 950 565 736 1420 687 670 240 -367 921 283 770 1501 629 -163 -463 -475 654 309 413 948 510 563 -396 -224 -668 -795 -746 -763 -841 -406 -1107 533 114 1242 1247 1382 -782 1141 650 -282 -1859 -1845 -1229 -1079 83 811 327 -25 -692 -1564 -926 -1559 -939 -1009 -1359 -645 1178 1381 1869 893 725 163 -1527 -800 -850 -653 240 -96 748 2081 1318 968 619 -303 -946 357 -251 -73 -367 -563 -764 -266 -285 -286 782 1765 1468 612 -158 -2002 -1435 SS 20250912T132546.9Z 9386.559571 227 1 48.65 2 78.95 92.91 37.05 263.20 0.00 1 0.00 1 0 17 2.576e-01 9.739e-03 1.357e-01 3.337e-03 5.570244e-01 1.735870e-03 6.309216e-03 -6.000000e+00 1.470505e-01 228.87 -2.00 3.36 -2.00 320.47 0.00e+00 3.268086e-03 6.806475e-04 2.488648e-03 -6.000000e+00 6.595587e-03 285.96 -2.00 20.00 -2.00 319.81 0.00e+00 5.033 0.002 302.00 328.00 3 3.0362e+00 5.3820e-03 5.3180e-02 -6.0000e+00 3.6593e-01 2.9478e-02 6.8398e-03 3.0311e-02 -6.0000e+00 3.9689e-01 -6.8612e-02 6.3568e-03 1.6182e-02 -6.0000e+00 2.3663e-01 2.7173e-02 3.1942e-03 5.2937e-03 -6.0000e+00 1.0141e-01 1.6637e-04 7.3887e-04 9.2999e-05 7.2243e-05 -6.0000e+00 6.9256e-03 6.3828e-02 0.0000e+00 12 9 9 12 1 1 99.93 26.38 0.58 0.06383 0.06938 38 5 1 5 0 1247.190 33.75 20.00 26.38 25.29 6.0 948.17 -16168 -66664 -127427 -55006 162197 -92085 -105388 -36177 -46440 -42706 -37859 -13606 -39868 29 6406 14389 14201 -60822 -9119 -54789 7587 -34492 -9694 8071 12622 8944 -8189 -15495 -3764 26909 -6540 -1849 7442 -6133 -21019 18148 -5574 5140 4430 380 3478 -4511 -827 -860 832 3368 1210 2622 -104 -1019 3022 4965 970 2640 4924 2012 171 -325 -1505 4254 2980 1820 4768 2394 933 -2896 -859 309 688 2484 1111 1883 208 -180 -907 -3089 -3455 -2187 -1066 -2400 -1038 -1583 270 -1597 421 1180 1355 -2051 1404 673 -352 -1715 -1221 -610 -809 31 861 713 338 -203 -1370 -882 -1044 -892 -966 -318 -624 934 942 419 995 1005 -173 -952 -219 -973 -557 28 35 239 964 1034 1078 691 -1093 -637 256 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