File name: Pandora89s1_PaloDuroTX_20250622_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250630T160521.8Z 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_20250622_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: 20250622 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 20250622T120722.3Z 9304.505119 133 1 53.24 2 84.72 65.02 51.08 88.99 0.00 1 0.00 1 0 17 8.254e-01 6.902e-02 3.691e-01 2.778e-02 9.942795e-01 1.757614e-02 1.191708e-02 -6.000000e+00 5.063705e-01 231.77 -2.00 3.36 -2.00 322.29 0.00e+00 -2.845707e-02 8.356721e-03 3.865772e-03 -6.000000e+00 2.974176e-02 285.28 -2.00 20.00 -2.00 321.80 0.00e+00 9.436 0.013 302.00 328.00 3 1.4179e+00 6.6758e-02 9.8128e-02 -6.0000e+00 1.2727e+00 1.8413e+00 7.7815e-02 5.4583e-02 -6.0000e+00 1.3926e+00 -2.0933e+00 4.6143e-02 2.5519e-02 -6.0000e+00 8.1203e-01 7.5220e-01 2.5125e-02 1.8691e-02 -6.0000e+00 3.4764e-01 8.2212e-06 -2.9633e-03 7.9542e-04 3.5396e-04 -6.0000e+00 2.3658e-02 5.9984e-02 0.0000e+00 12 8 8 10 0 0 89.96 26.35 1.55 0.05998 0.03772 16 2 1 5 0 3327.250 34.00 20.00 26.35 28.54 6.0 974.33 900000 -24764 -60656 900000 900000 239264 35275 900000 900000 -27559 900000 143970 355526 290833 900000 46848 252740 900000 -33757 57021 900000 -7135 244095 900000 900000 900000 353113 900000 -15880 900000 -32904 900000 900000 99306 900000 900000 -16642 28085 900000 900000 86100 19881 -1380 900000 24591 900000 598 900000 34870 88514 9903 25303 24151 112764 900000 76186 38332 90587 -5634 212728 59651 -32508 156707 110675 51822 73941 -12212 88582 -2802 27344 75492 84585 13228 2141 36028 -36761 108958 34253 17158 -3901 23154 3192 56381 -16186 36282 57237 11107 -56798 3720 -13680 -1535 4075 1950 15379 11322 -2723 8474 5164 6891 8474 989 1187 4678 25993 -824 -593 -6378 3176 921 2092 -4311 1289 2946 -7111 77 -395 -2520 -7227 4405 2947 3308 2066 15168 -7553 9337 632 -157 -6130 9778 -1526 -2464 -29 -592 2441 -1812 -581 -580 645 1567 1492 -1076 -1983 900000 -2502 -7353 900000 900000 6446 1425 900000 900000 -2660 900000 3879 9578 7835 900000 2524 6809 900000 -3638 2304 900000 -513 6576 900000 900000 900000 9513 900000 -1128 900000 -3223 900000 900000 2675 900000 900000 -1549 2064 900000 900000 5061 2191 -172 900000 1927 900000 54 900000 2391 3902 1067 2541 2662 5523 900000 5971 4318 5546 -800 5731 4091 -6130 4989 5963 4950 5614 -2303 6725 -611 4889 8690 8701 2559 409 4235 -8103 6164 4522 3189 -1062 5614 1066 11848 -7457 10459 13878 4339 -43150 1473 -5971 -558 1383 714 5635 5094 -1650 5342 3770 5068 5821 658 697 2558 12255 -540 -407 -5018 2533 871 2271 -5564 1653 3738 -9712 94 -487 -3307 -10475 5887 3914 4135 2494 15609 -9462 9634 691 -181 -8720 13988 -2786 -5025 -63 -1384 6017 -4965 -1609 -1626 1781 4082 3581 -2434 -4263 SS 20250622T122020.4Z 9304.514125 136 1 54.36 2 82.29 66.75 48.48 90.72 0.00 1 0.00 1 0 17 6.335e-01 1.185e-02 3.007e-01 3.559e-03 8.043863e-01 1.981806e-03 8.963520e-03 -6.000000e+00 3.682467e-01 231.77 -2.00 3.36 -2.00 321.60 0.00e+00 2.994557e-03 1.107502e-03 5.820348e-03 -6.000000e+00 1.774737e-02 285.28 -2.00 20.00 -2.00 321.07 0.00e+00 6.940 0.005 302.00 328.00 3 1.3987e+00 7.4270e-03 7.9166e-02 -6.0000e+00 9.2518e-01 1.7063e-01 1.1383e-02 5.5415e-02 -6.0000e+00 1.0036e+00 -2.8823e-01 1.2413e-02 2.8536e-02 -6.0000e+00 5.9473e-01 1.1778e-01 5.6518e-03 7.9966e-03 -6.0000e+00 2.5257e-01 1.3398e-04 2.5241e-04 9.4360e-05 1.5166e-04 -6.0000e+00 1.7216e-02 6.0494e-02 0.0000e+00 12 8 8 10 0 0 95.76 26.35 0.61 0.06049 0.06239 85 9 1 5 0 639.400 34.00 20.00 26.35 28.58 6.0 974.50 -102109 -308146 -285104 -152211 -62334 -258951 -273841 -50275 900000 -222556 -141315 900000 900000 -23552 38832 -116320 -29849 900000 -62006 -70040 -24035 -44435 114571 244 76039 900000 7621 20447 9471 67987 -30682 -2414 27671 -25773 35545 181420 -39734 30609 14535 1828 -6639 7838 2623 14259 2802 31202 1438 10253 6507 11821 7092 9032 3426 9007 17278 1719 3123 -2484 -6416 11574 5784 2326 9841 -1021 279 340 -3094 5649 642 3441 4167 3310 4157 -4333 -3808 -3006 1008 -747 -918 -2009 985 -1440 2191 -1436 2830 2186 2132 -4544 1580 1 -95 -1148 -2429 -1422 -547 -984 489 -83 462 -549 -1015 -1556 -2569 97 -1546 -1533 -500 849 1030 1005 694 1002 -134 -1353 -425 -765 -376 -354 543 538 1624 710 972 525 -157 -745 369 -316 -61 -178 -598 -85 -204 161 -206 228 721 459 285 81 -961 -732 -354 -5051 -3684 -528 -216 -2530 -3539 -174 900000 -2315 -757 900000 900000 -89 135 -1613 -198 900000 -665 -839 -182 -434 397 2 288 900000 63 149 85 424 -638 -45 422 -652 481 629 -1502 711 484 79 -341 370 135 662 151 1309 86 601 433 848 610 849 376 1009 1875 227 406 -331 -868 1344 788 380 1723 -216 58 71 -706 1318 184 1068 1348 1069 1252 -1291 -1009 -742 246 -213 -318 -838 464 -774 1102 -802 1618 1323 1331 -3036 959 0 -57 -676 -1383 -916 -413 -877 501 -87 485 -599 -997 -1380 -2285 91 -1554 -1629 -569 970 1342 1485 1110 1505 -216 -2111 -633 -1153 -593 -547 861 839 2585 1096 1448 757 -220 -1021 526 -522 -107 -349 -1272 -178 -455 385 -488 551 1757 1119 713 190 -2115 -1541 SS 20250622T123820.8Z 9304.526630 141 1 54.24 2 78.87 69.10 44.86 93.24 0.00 1 0.00 1 0 25 2.696e-01 9.012e-03 1.768e-02 8.331e-04 6.105483e-01 4.332365e-04 6.712776e-03 -6.000000e+00 1.556375e-01 231.77 -2.00 3.36 -2.00 320.04 0.00e+00 2.405290e-03 1.488797e-04 1.686830e-03 -6.000000e+00 6.883224e-03 285.28 -2.00 20.00 -2.00 319.37 0.00e+00 5.000 0.002 302.00 328.00 3 7.8889e-01 1.2845e-03 5.4260e-02 -6.0000e+00 3.9014e-01 2.1861e-02 1.5766e-03 3.1639e-02 -6.0000e+00 4.2221e-01 -8.3517e-02 1.4124e-03 1.6372e-02 -6.0000e+00 2.5100e-01 3.7695e-02 7.2539e-04 5.3076e-03 -6.0000e+00 1.0689e-01 1.5160e-03 4.6281e-04 2.2212e-05 6.2306e-05 -6.0000e+00 7.2541e-03 6.0341e-02 0.0000e+00 11 9 0 11 8 0 33.55 26.36 0.44 0.06034 0.06382 356 38 1 5 0 152.340 34.00 20.00 26.36 28.97 5.9 977.82 -90027 -92540 -95068 -106359 -107492 -95278 -98195 -72299 -68608 -84363 -70423 -59963 -35344 -27063 -12733 -15627 -13532 -31362 -8954 -10602 -15955 -12474 -7639 -8245 -7131 -6689 -13514 -12837 -8488 -6183 -5015 -2509 -3097 -10439 -5810 -4068 -4564 -1073 1252 161 1288 1198 567 2803 2084 2580 1138 344 910 1882 2142 2272 2489 2764 3162 1582 1055 1109 -449 1719 1936 2549 3099 1462 885 -392 -1234 112 554 1109 1345 735 732 -603 -1209 -2648 -3237 -2535 -1894 -1429 -962 -1916 -1206 -676 270 982 1450 1388 1372 953 22 -871 -1318 -1243 -918 137 916 337 -185 -642 -1343 -1227 -984 -1218 -1092 -905 -745 375 849 1096 687 588 -33 -750 -535 -464 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