File name: Pandora89s1_PaloDuroTX_20250813_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250814T065852.4Z 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_20250813_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: 20250813 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 20250813T123725.8Z 9356.525993 204 1 52.46 2 84.59 76.10 43.52 240.36 0.00 1 0.00 1 0 25 6.047e-01 8.360e-02 3.770e-01 3.092e-02 9.449723e-01 1.989257e-02 1.110546e-02 -6.000000e+00 3.807633e-01 230.62 -2.00 3.36 -2.00 322.24 0.00e+00 -2.871668e-02 1.165484e-02 3.479261e-03 -6.000000e+00 2.899643e-02 287.62 -2.00 20.00 -2.00 321.73 0.00e+00 9.267 0.012 302.00 328.00 3 1.6922e+00 8.4116e-02 9.5859e-02 -6.0000e+00 9.7083e-01 1.7443e+00 9.8616e-02 5.4853e-02 -6.0000e+00 1.0670e+00 -1.7764e+00 6.5126e-02 2.4289e-02 -6.0000e+00 6.0419e-01 5.7001e-01 3.3946e-02 1.9088e-02 -6.0000e+00 2.6807e-01 7.0561e-06 -1.4201e-03 9.3444e-04 3.4147e-04 -6.0000e+00 1.8593e-02 6.3189e-02 0.0000e+00 12 9 8 11 8 0 -23.00 26.48 2.23 0.06319 0.05252 15 2 1 5 0 3497.230 34.00 20.00 26.48 28.29 5.9 970.25 900000 7094 -89219 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 133268 19953 900000 900000 -3288 17402 900000 85621 14677 168644 900000 900000 900000 94335 -16426 900000 17640 900000 173262 900000 157790 900000 -75519 183434 900000 90352 900000 69345 6106 900000 900000 900000 60440 900000 23951 88210 54830 87323 28745 75709 900000 40090 18630 172563 87343 104677 8734 -27902 255202 45406 89568 78298 17290 44356 14462 36777 12011 52265 18176 68659 17159 -7986 96667 -20628 37308 539 19652 13123 72901 -4148 10402 89241 18117 -70282 7561 -9407 7703 -1842 38670 22558 26753 3528 9890 -2107 9893 9706 7264 6551 4435 8752 371 -296 1516 3503 2572 -4308 -2510 1110 7354 -6541 4710 -11203 -3429 -9543 2299 6524 2682 7098 8411 3645 5276 -79 -2024 -1712 3638 -959 -2354 -549 -465 2685 34 -2621 1534 -150 5218 -2546 -3413 320 900000 301 -8462 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 3991 1096 900000 900000 -213 869 900000 2564 879 5051 900000 900000 900000 2825 -1025 900000 1009 900000 5189 900000 4726 900000 -13160 5494 900000 5166 900000 4909 748 900000 900000 900000 3291 900000 2022 4323 4180 5231 3365 5978 900000 5021 2841 5168 5470 5130 1142 -5774 7643 5316 6585 6396 2730 5918 2993 6709 2911 8254 3712 7478 2710 -1479 6949 -4830 6369 156 5474 4363 14192 -1851 4237 17106 7163 -60087 3102 -4226 2746 -712 10539 8243 10977 2124 6458 -1717 7230 6686 4590 3708 2511 5085 248 -209 1135 2864 2450 -5058 -3187 1412 8766 -8659 5375 -15032 -4437 -13833 3057 8129 3286 7972 9069 3995 5546 -85 -2346 -2308 5437 -1700 -4652 -1149 -1049 6385 88 -7152 4074 -404 12690 -6191 -7748 666 SS 20250813T125008.2Z 9356.534817 207 1 53.97 2 82.06 77.85 45.73 243.41 0.00 1 0.00 1 0 17 6.290e-01 1.034e-02 2.805e-01 3.515e-03 7.614974e-01 1.912420e-03 8.310775e-03 -6.000000e+00 3.647381e-01 230.62 -2.00 3.36 -2.00 321.52 0.00e+00 -1.556967e-04 1.068858e-03 4.813388e-03 -6.000000e+00 1.656624e-02 287.62 -2.00 20.00 -2.00 320.96 0.00e+00 6.761 0.005 302.00 328.00 3 1.5960e+00 7.1921e-03 7.5616e-02 -6.0000e+00 9.1137e-01 9.7756e-02 1.0754e-02 5.1808e-02 -6.0000e+00 9.8844e-01 -2.4356e-01 1.1387e-02 2.4214e-02 -6.0000e+00 5.8713e-01 1.0102e-01 5.2307e-03 6.3655e-03 -6.0000e+00 2.4950e-01 1.3950e-04 4.1747e-04 9.3520e-05 9.8215e-05 -6.0000e+00 1.6924e-02 6.3522e-02 0.0000e+00 12 8 8 10 0 0 -10.80 26.48 0.72 0.06352 0.06666 88 9 1 5 0 613.250 34.00 20.00 26.48 29.01 5.9 976.34 -206984 -265081 -161227 -235367 900000 -109307 -241071 -124064 -57564 -62449 -154525 -67640 -71539 -29597 267925 -105113 -10803 900000 -52126 -9725 -63376 -88811 -50201 -14978 -7814 86643 -45546 -30312 8029 264605 5443 5467 16169 -31432 35891 132527 -35906 23304 14119 -2279 -2758 7058 -10012 -2027 -603 20678 7557 3147 -1057 -986 1984 3461 -2898 4913 12516 2245 7540 2388 -9358 13287 3160 1358 6277 2357 1989 -1782 1463 -1585 2106 1386 308 3032 3030 -3409 -2812 -520 -1313 -1579 242 46 164 -2121 1436 213 1380 3173 2755 -3441 717 901 535 -1716 -1812 -1744 -1104 206 -26 547 288 -776 -1171 -416 -2512 -1694 -729 -1415 70 488 1010 1570 603 375 -173 -1043 -527 -757 -421 -150 -61 573 1320 992 532 601 179 -813 293 -463 134 -333 -363 -772 -102 202 122 532 484 794 246 -296 -942 -649 -1418 -3550 -753 -2126 900000 -375 -2928 -541 -197 -214 -1251 -295 -423 -148 918 -1572 -71 900000 -601 -76 -849 -1632 -704 -163 -94 416 -796 -447 88 907 91 109 316 -958 553 863 -1513 679 551 -120 -159 389 -672 -127 -38 1091 476 221 -84 -89 198 379 -374 633 1578 327 1044 337 -1449 1684 489 247 1245 522 438 -409 341 -426 636 470 111 1052 991 -1083 -795 -135 -352 -483 88 20 82 -1094 763 123 842 2001 1799 -2393 462 541 334 -1067 -1072 -1174 -868 187 -28 581 309 -861 -1173 -374 -2308 -1668 -753 -1557 82 577 1353 2357 907 574 -281 -1632 -788 -1147 -667 -232 -99 903 2138 1553 810 880 255 -1135 425 -776 236 -654 -769 -1616 -226 482 308 1272 1178 1926 614 -695 -2082 -1377 SS 20250813T130620.9Z 9356.546075 212 1 54.23 2 78.79 80.06 48.64 247.01 0.00 1 0.00 1 0 17 2.410e-01 8.268e-03 2.284e-02 9.858e-04 5.897350e-01 5.102361e-04 6.481922e-03 -6.000000e+00 1.385141e-01 230.62 -2.00 3.36 -2.00 320.11 0.00e+00 2.066991e-03 1.795465e-04 1.539928e-03 -6.000000e+00 6.216244e-03 287.62 -2.00 20.00 -2.00 319.38 0.00e+00 4.968 0.002 302.00 328.00 3 1.1703e+00 1.5329e-03 5.3279e-02 -6.0000e+00 3.4594e-01 -1.5276e-02 1.9072e-03 3.0490e-02 -6.0000e+00 3.7462e-01 -6.2890e-02 1.7016e-03 1.5684e-02 -6.0000e+00 2.2324e-01 2.7791e-02 8.6848e-04 4.8968e-03 -6.0000e+00 9.5464e-02 1.1138e-03 4.2883e-04 2.6486e-05 5.7431e-05 -6.0000e+00 6.4843e-03 6.3706e-02 0.0000e+00 11 9 0 11 8 0 11.82 26.47 0.50 0.06371 0.06693 290 31 1 5 0 186.960 34.00 20.00 26.47 30.61 5.9 987.93 -106488 -93172 -74041 -89591 -109237 -76402 -82550 -78659 -58290 -47461 -60106 -42623 -24327 -16573 -15088 -18252 -9529 -5769 -7324 -13238 -17289 -8105 -8462 -3675 -7693 -5358 -14762 -8180 -7176 -3847 -2870 -4181 -3933 -8037 -7572 -2286 -7741 -1367 801 -483 604 1884 682 2523 1484 1913 652 8 755 1923 2776 3178 2416 2301 2713 1156 541 515 -1566 2005 1086 2534 3024 1007 477 -1054 -696 -13 504 782 1281 796 1052 -502 -1153 -2471 -3012 -2267 -1835 -1245 -1119 -1820 -1015 -691 257 924 1499 1158 1333 1070 -78 -934 -962 -828 -591 342 1036 464 -189 -652 -1326 -1197 -861 -1184 -1123 -798 -516 432 776 1170 601 635 -149 -612 -523 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