File name: Pandora89s1_PaloDuroTX_20250817_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250818T065703.3Z 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_20250817_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: 20250817 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 20250817T130815.2Z 9360.547398 224 1 54.64 2 78.94 81.50 10.67 132.88 0.00 1 0.00 1 0 25 3.832e-01 3.317e-02 2.295e-01 1.267e-02 5.626080e-01 7.010290e-03 6.804039e-03 -6.000000e+00 2.261630e-01 230.45 -2.00 3.36 -2.00 320.96 0.00e+00 3.478951e-03 3.100843e-03 4.529691e-03 -6.000000e+00 1.161416e-02 287.56 -2.00 20.00 -2.00 320.29 0.00e+00 5.028 0.002 302.00 328.00 3 4.7856e+00 2.3422e-02 5.7020e-02 -6.0000e+00 5.6508e-01 2.6812e-01 2.9731e-02 3.9659e-02 -6.0000e+00 6.1455e-01 -3.4449e-01 2.5539e-02 1.7052e-02 -6.0000e+00 3.6095e-01 1.3017e-01 1.2529e-02 3.9806e-03 -6.0000e+00 1.5393e-01 2.5670e-05 -7.6213e-04 3.8356e-04 9.2243e-05 -6.0000e+00 1.0777e-02 6.7262e-02 0.0000e+00 12 9 8 11 8 0 99.92 26.45 0.58 0.06726 0.06154 16 2 1 5 0 3414.280 34.00 20.00 26.45 31.11 5.9 990.01 77242 -136944 -158992 900000 900000 900000 -108148 900000 -110609 -118739 900000 900000 118196 900000 15492 -8452 92524 900000 -71994 -27653 900000 -20120 78966 -31853 900000 16470 25838 29266 -11158 900000 -21969 92505 66587 51503 1504 900000 -62668 75613 90133 42904 63097 -10176 -11343 63006 9463 53074 24215 38814 758 23546 6572 9860 -1029 -2313 40440 3472 8081 16234 -4304 14976 10243 -5110 23776 14075 12715 7109 -3460 -4851 1561 -2200 4736 7953 1239 9181 5644 -3114 12121 -4853 -7042 -6250 1010 -660 10339 -1475 1652 9013 141 -21061 -528 -3126 50 -5705 -2784 415 578 -3224 2591 -1026 1814 -243 -1016 1226 209 -1591 -890 1507 -418 1084 1664 -588 -383 1974 390 -2572 508 -3439 -1497 -1192 240 1995 2185 891 3150 763 2825 -894 -18 -582 1280 1060 -102 -887 -410 1060 -28 -752 889 745 1028 -1079 -1689 -1026 952 -5063 -7021 900000 900000 900000 -3029 900000 -3718 -4390 900000 900000 1457 900000 347 -265 1140 900000 -5081 -1270 900000 -857 1327 -1713 900000 572 782 820 -488 900000 -1428 2176 2163 1846 86 900000 -8565 3134 3837 3268 4171 -1459 -1677 4447 1156 4222 2604 3696 110 3279 1199 1883 -236 -564 6628 843 1862 3341 -1066 3138 2449 -1600 6212 4232 3729 2129 -1164 -1793 621 -1006 2113 3411 539 3383 1927 -1067 3525 -1830 -3185 -3258 557 -404 5989 -1027 1193 6365 112 -20789 -410 -2315 33 -3803 -1815 288 460 -3063 2653 -1189 2043 -262 -1003 1082 187 -1574 -927 1612 -486 1345 2276 -905 -620 3104 598 -3806 694 -4891 -2187 -1849 387 3162 3350 1339 4468 1060 3700 -1166 -23 -866 2087 1887 -194 -1775 -861 2351 -60 -1668 1977 1664 2207 -2460 -3668 -2137 SS 20250817T131409.8Z 9360.551502 227 1 7.39 2 77.74 82.31 9.84 138.34 0.00 1 0.00 1 0 17 1.692e-01 8.306e-03 1.128e-01 4.148e-03 5.342965e-01 2.137314e-03 5.821820e-03 -6.000000e+00 9.722661e-02 230.45 -2.00 3.36 -2.00 319.93 0.00e+00 -2.173800e-04 7.108434e-04 1.006552e-03 -6.000000e+00 4.362970e-03 287.56 -2.00 20.00 -2.00 319.19 0.00e+00 4.573 0.001 302.00 328.00 3 2.2990e+00 6.3375e-03 4.8661e-02 -6.0000e+00 2.4274e-01 -3.8219e-02 7.7685e-03 2.7403e-02 -6.0000e+00 2.6286e-01 -3.7706e-02 6.6869e-03 1.3396e-02 -6.0000e+00 1.5666e-01 1.8602e-02 3.4427e-03 3.6960e-03 -6.0000e+00 6.7036e-02 5.3991e-04 9.5543e-04 1.1447e-04 3.9828e-05 -6.0000e+00 4.5523e-03 6.1414e-02 0.0000e+00 12 9 1 12 1 1 -31.18 26.45 0.51 0.06141 0.06859 13 11 1 5 0 527.350 34.00 20.01 26.45 31.40 5.9 991.75 -57674 10529 -40989 22623 -7876 -105468 -74279 -70032 -60886 -31666 -58142 -5454 28382 27399 -24537 -2636 4986 2447 -10467 -7972 -5602 7838 367 372 -3317 5263 -12212 4998 7696 -3127 -8237 -418 -4023 -12268 -13117 -1010 -302 -319 1533 -1404 -1401 -1111 2049 4521 -190 853 1474 -909 -1814 184 1131 1160 440 -617 2571 -84 1039 2596 -1961 243 2635 1870 5340 414 -619 -1215 -465 1307 1505 896 790 471 484 -376 -314 -2052 -2073 -875 -1478 -1582 -1762 -1500 -449 -426 -114 1635 1466 886 785 496 920 -912 -690 -845 -1255 189 506 688 -162 37 -783 -1278 -1136 -1105 -1264 -1096 -648 294 901 817 530 409 -29 -798 -642 -290 -426 -129 156 80 487 845 676 1048 -15 -439 848 -64 -335 127 -421 53 205 117 268 191 283 676 -124 -551 -645 -622 -742 81 -514 137 -64 -2474 -1472 -1530 -1330 -538 -1411 -95 436 521 -923 -88 169 92 -474 -364 -252 323 18 20 -196 292 -775 257 402 -209 -673 -36 -387 -1231 -1310 -99 -35 -45 259 -276 -295 -223 407 971 -40 178 310 -202 -428 47 317 355 147 -221 932 -32 397 953 -742 93 1071 862 2425 206 -298 -571 -220 666 883 587 544 325 317 -229 -172 -1054 -1055 -481 -958 -1100 -1394 -1294 -405 -384 -109 1631 1513 923 790 466 799 -822 -625 -784 -1336 212 603 889 -210 45 -930 -1405 -1267 -1337 -1622 -1385 -869 422 1337 1255 854 655 -45 -1223 -935 -422 -649 -209 252 128 759 1348 1041 1538 -22 -640 1256 -101 -551 226 -752 97 399 232 559 390 587 1402 -262 -1110 -1235 -1213 SS 20250817T131858.8Z 9360.554847 230 1 22.79 2 76.76 82.97 9.22 143.43 0.00 1 0.00 1 0 17 2.625e-01 1.425e-02 2.123e-01 8.113e-03 5.071987e-01 4.277677e-03 5.695818e-03 -6.000000e+00 1.528020e-01 230.45 -2.00 3.36 -2.00 320.37 0.00e+00 6.537457e-04 1.598418e-03 2.171760e-03 -6.000000e+00 7.324556e-03 287.56 -2.00 20.00 -2.00 319.65 0.00e+00 4.258 0.001 302.00 328.00 3 4.3550e+00 1.3238e-02 4.6559e-02 -6.0000e+00 3.8275e-01 3.1434e-02 1.6520e-02 2.8782e-02 -6.0000e+00 4.1576e-01 -6.0678e-02 1.4674e-02 1.3407e-02 -6.0000e+00 2.4571e-01 2.2416e-02 7.4429e-03 3.5296e-03 -6.0000e+00 1.0528e-01 8.7662e-05 5.7767e-04 2.3722e-04 4.7677e-05 -6.0000e+00 7.1290e-03 6.2651e-02 0.0000e+00 12 9 9 12 1 1 99.50 26.45 0.83 0.06265 0.06699 6 2 1 5 0 3254.990 34.00 20.00 26.45 31.64 5.9 993.36 900000 -91388 -134926 50057 900000 -70196 -102135 900000 60917 -17005 900000 137823 55721 21481 21763 -28317 63920 900000 -40872 -30555 19588 11923 -4901 -18725 31821 58179 34046 -20904 7424 18621 -21478 -3393 5343 22327 2280 28668 -22553 5443 10198 9446 3489 940 -10979 10311 5164 7706 3415 935 -3030 2543 1450 724 -3579 533 10563 -3566 -1832 3466 -892 -32 3155 -2143 8307 3992 4752 -1951 -2155 -402 -2910 -751 -737 2101 248 2370 -1783 -3169 1240 -3647 -703 -2143 -919 -1067 1442 -940 1342 3608 2834 -5125 180 -587 -1287 -2442 -1118 845 677 -1277 582 1217 497 82 -254 -1624 -368 -1013 -2024 -333 -737 890 1421 1203 567 1242 1100 -1941 -192 -1546 -748 -260 -81 945 1220 76 614 -59 360 61 -204 -696 569 682 -589 -1680 -516 59 232 86 1169 373 747 -734 -1044 -178 900000 -1838 -4071 396 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