File name: Pandora89s1_PaloDuroTX_20250708_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250709T065957.1Z 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_20250708_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: 20250708 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 20250708T121328.1Z 9320.509353 130 1 54.27 2 84.75 66.27 122.27 255.84 0.00 1 0.00 1 0 25 8.585e-01 5.818e-02 4.292e-01 2.151e-02 9.945447e-01 1.391426e-02 1.124507e-02 -6.000000e+00 5.350432e-01 231.56 -2.00 3.36 -2.00 322.42 0.00e+00 -2.126003e-02 7.992238e-03 2.631121e-03 -6.000000e+00 3.317194e-02 286.61 -2.00 20.00 -2.00 321.95 0.00e+00 9.477 0.013 302.00 328.00 3 1.2001e+00 5.7628e-02 9.9069e-02 -6.0000e+00 1.3422e+00 1.6444e+00 7.2635e-02 5.5528e-02 -6.0000e+00 1.4668e+00 -2.0100e+00 5.1218e-02 2.6710e-02 -6.0000e+00 8.6521e-01 7.5800e-01 2.4679e-02 1.6387e-02 -6.0000e+00 3.7062e-01 1.0925e-05 -1.3155e-03 6.2470e-04 2.7420e-04 -6.0000e+00 2.5394e-02 6.0908e-02 0.0000e+00 12 8 8 10 0 0 16.35 26.39 1.72 0.06091 0.05102 23 2 1 5 0 2359.170 34.00 19.99 26.39 26.53 6.0 959.34 900000 83586 -88721 900000 900000 277599 41719 900000 900000 -75254 900000 900000 900000 154613 900000 900000 900000 900000 51390 5743 900000 7742 900000 88457 900000 900000 900000 80042 900000 900000 -17400 335584 900000 73225 321561 900000 35678 900000 159410 900000 173837 183040 -7493 900000 228767 900000 113211 134249 121935 900000 41909 66746 47128 71852 900000 30905 900000 73121 89058 396558 21461 -18615 900000 35980 10390 133506 3036 80157 10418 14790 41337 36097 18802 10077 10793 32551 40510 40733 31621 28723 16453 12160 41088 6644 24068 36560 8359 -55834 -1327 -8200 -1021 -11738 -536 16262 14358 -5435 -8 -3938 6032 -501 7839 4593 -9385 25658 -2171 -2935 -4444 5860 -1498 1101 -2624 4264 1572 -4320 2292 -2918 -3258 -7306 -1383 2323 5148 4006 10309 1842 1814 1258 1687 -3923 4933 -2117 -106 -1813 908 2197 -49 88 -662 -64 1682 -1203 -936 -1644 900000 1741 -8008 900000 900000 5782 869 900000 900000 -6009 900000 900000 900000 3220 900000 900000 900000 900000 1516 249 900000 309 900000 2177 900000 900000 900000 1667 900000 900000 -1021 6990 900000 1803 6698 900000 1419 900000 3320 900000 3621 3813 -709 900000 4765 900000 2572 2796 2771 900000 2619 3539 3302 4218 900000 2985 900000 4154 3879 8260 1788 -2573 900000 3475 1279 4803 425 5768 1736 2605 6372 5714 3250 1679 1551 3458 4050 4582 4676 5205 3941 3419 9243 2242 7219 10052 3099 -38843 -512 -3143 -345 -4376 -191 5657 6041 -3283 -6 -3060 4322 -362 4670 2506 -5747 11865 -1407 -2023 -3379 4516 -1448 1204 -3307 5248 1995 -5651 2721 -3678 -4309 -10622 -1956 3087 6273 4722 11101 2095 2013 1368 1933 -5581 7563 -3965 -214 -4030 2124 5506 -121 222 -1697 -162 4365 -2955 -2105 -3523 SS 20250708T122601.4Z 9320.518072 133 1 54.36 2 82.38 67.95 124.67 257.19 0.00 1 0.00 1 0 25 6.235e-01 1.061e-02 2.492e-01 3.287e-03 7.844866e-01 1.853936e-03 8.467488e-03 -6.000000e+00 3.633682e-01 231.56 -2.00 3.36 -2.00 321.59 0.00e+00 -1.244756e-03 1.059281e-03 4.994858e-03 -6.000000e+00 1.793513e-02 286.61 -2.00 20.00 -2.00 321.05 0.00e+00 7.008 0.005 302.00 328.00 3 1.3084e+00 7.0513e-03 7.8705e-02 -6.0000e+00 9.1189e-01 4.1047e-02 1.0967e-02 5.4705e-02 -6.0000e+00 9.9029e-01 -1.5630e-01 1.1962e-02 2.5653e-02 -6.0000e+00 5.8732e-01 6.4817e-02 5.4161e-03 6.7925e-03 -6.0000e+00 2.5066e-01 1.4918e-04 4.7163e-04 9.0253e-05 9.9430e-05 -6.0000e+00 1.7290e-02 6.1993e-02 0.0000e+00 12 9 8 11 8 0 22.84 26.40 0.76 0.06199 0.06554 98 11 1 5 0 554.590 34.00 20.01 26.40 26.73 6.0 960.28 -295579 -77563 -275961 900000 -216546 -198191 -239646 -165551 900000 -276464 -160634 900000 900000 143426 900000 -21751 -27395 900000 -30374 -53945 -4769 -37977 -4579 -52944 10588 900000 -43539 -69267 69349 900000 -14241 -23256 9204 -38129 900 900000 -18887 -12309 29834 -1243 7572 16555 -3189 11959 -7847 9971 -3712 12901 4318 8071 7873 4499 -848 9941 17179 -1858 7409 2603 -3367 7413 -4882 -1894 9501 710 -281 3387 -1865 -827 -658 -69 3491 2511 613 -1439 -2137 -2904 -1052 -2860 415 -1197 -277 -931 1749 -178 3320 2084 3221 -3954 2142 1197 -590 -4012 -3279 -193 -858 -676 185 567 567 -757 -1215 -1826 -2320 67 -512 -712 -511 726 924 1511 906 612 -295 -1707 220 -491 -142 -666 -42 490 982 749 907 624 -536 -745 476 -597 9 -415 -418 -598 -162 199 -218 412 715 696 319 -113 -739 -695 -2751 -248 -2328 900000 -945 -807 -1743 -674 900000 -4181 -888 900000 900000 459 900000 -95 -143 900000 -194 -455 -25 -298 -29 -616 78 900000 -557 -1130 311 900000 -223 -476 150 -976 16 900000 -538 -414 811 -53 325 689 -166 543 -447 491 -221 698 279 573 642 425 -94 1072 1830 -251 917 328 -440 892 -734 -319 1647 145 -58 676 -414 -204 -189 -22 1134 818 192 -419 -561 -723 -265 -835 142 -495 -132 -498 885 -99 1901 1273 2005 -2648 1303 687 -325 -2236 -1902 -124 -653 -603 190 587 591 -753 -1191 -1625 -2071 63 -514 -758 -538 836 1212 2226 1335 921 -438 -2455 323 -735 -222 -1026 -67 762 1452 1158 1355 901 -759 -1024 680 -916 15 -812 -821 -1248 -360 476 -516 988 1740 1692 744 -264 -1629 -1473 SS 20250708T124426.2Z 9320.530858 138 1 54.12 2 78.85 70.36 128.20 259.18 0.00 1 0.00 1 0 17 2.507e-01 8.770e-03 1.706e-02 8.356e-04 5.891051e-01 4.346806e-04 6.501008e-03 -6.000000e+00 1.445721e-01 231.56 -2.00 3.36 -2.00 320.00 0.00e+00 2.296614e-03 1.478781e-04 1.574825e-03 -6.000000e+00 6.436276e-03 286.61 -2.00 20.00 -2.00 319.30 0.00e+00 4.992 0.002 302.00 328.00 3 8.2965e-01 1.2865e-03 5.3550e-02 -6.0000e+00 3.6205e-01 -1.1771e-03 1.5765e-03 3.0488e-02 -6.0000e+00 3.9181e-01 -6.9916e-02 1.3911e-03 1.5623e-02 -6.0000e+00 2.3315e-01 3.1904e-02 7.1532e-04 4.9714e-03 -6.0000e+00 9.9430e-02 1.5186e-03 4.6487e-04 2.2448e-05 5.7880e-05 -6.0000e+00 6.7440e-03 6.1921e-02 0.0000e+00 11 8 0 10 0 0 18.95 26.38 0.47 0.06192 0.06541 369 40 1 5 0 146.640 34.00 20.00 26.38 27.36 6.0 966.24 -88161 -85388 -78053 -100955 -108558 -85016 -92663 -71900 -62552 -73717 -68076 -55904 -27689 -30499 -14155 -18274 -13172 -3095 -4744 -10256 -12310 -8796 325 -8992 -2221 -5059 -10928 -13636 -6094 -4710 -3989 -1202 -4150 -7972 -7484 -2517 -5117 -2075 795 338 193 839 876 2995 645 1877 537 -478 849 2385 2120 2368 1904 2372 3596 1164 1450 859 -253 1898 1882 3337 3036 1188 294 -500 -892 295 373 674 1124 900 848 -561 -1153 -2303 -3372 -2716 -2088 -1195 -1075 -1946 -1103 -499 297 834 1339 1536 1474 973 -31 -1036 -1149 -955 -739 210 985 388 -277 -529 -1297 -1288 -1052 -1285 -1079 -816 -646 435 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