File name: Pandora89s1_PaloDuroTX_20260618_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20260619T065443.4Z 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 v1.8.88 Instrument operation file used: Pandora89_OF_v3d20240314.txt Instrument calibration file used: Pandora89s1_CF_v2d20241101.txt Level 1 file used: Pandora89s1_PaloDuroTX_20260618_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: 20260618 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 20260618T120604.2Z 9665.504216 51 1 54.30 2 84.80 64.99 121.16 32.51 0.00 1 0.00 1 0 25 5.623e-01 3.414e-02 3.560e-01 1.624e-02 1.016769e+00 1.003217e-02 1.046945e-02 -6.000000e+00 3.399682e-01 231.82 -2.00 3.36 -2.00 322.53 0.00e+00 3.451947e-03 6.682471e-03 2.816991e-03 -6.000000e+00 2.102895e-02 284.94 -2.00 20.00 -2.00 322.10 0.00e+00 9.550 0.013 302.00 328.00 3 8.0547e-01 4.4592e-02 1.0505e-01 -6.0000e+00 8.5350e-01 1.6331e+00 5.4697e-02 7.0703e-02 -6.0000e+00 9.3155e-01 -2.1214e+00 4.0082e-02 2.6738e-02 -6.0000e+00 5.4615e-01 8.2589e-01 1.9490e-02 1.3958e-02 -6.0000e+00 2.3468e-01 1.7331e-05 3.4856e-04 4.4364e-04 1.7099e-04 -6.0000e+00 1.6260e-02 8.1369e-02 0.0000e+00 12 9 8 11 8 0 1.50 26.32 1.41 0.08137 0.08399 33 4 1 5 0 1645.340 34.00 20.00 26.32 28.52 6.0 965.38 900000 -71664 -12726 900000 900000 -59231 -91979 900000 900000 98871 900000 900000 60154 900000 900000 -586 150704 900000 -14613 57790 900000 14767 900000 57840 900000 900000 900000 900000 224282 900000 11565 900000 84253 65462 900000 900000 -51701 27026 296450 95319 900000 -6542 -14336 900000 31286 900000 172653 72477 70116 56555 110528 60283 -11412 27851 900000 -1011 49145 61301 8938 167779 26260 23777 108334 22500 38212 34700 -1151 43376 21142 6996 7619 26656 52732 -7371 17100 -2612 64767 -9609 37508 1747 4746 3345 38322 -2725 26963 30563 8420 -13210 -2939 -15075 8051 -15426 -12697 2641 2058 -3833 -3255 -3047 4761 -6203 -854 -3442 -3843 7404 317 -6201 -399 2663 433 479 -1606 182 1395 -6587 -1869 -3659 -1772 -2474 1359 1995 8107 40 4693 -888 1187 -492 1329 -1109 3707 952 -179 -853 -1705 1637 272 258 452 1570 2733 -198 -3291 -3107 900000 -5269 -434 900000 900000 -2099 -4468 900000 900000 1558 900000 900000 948 900000 900000 -24 2374 900000 -712 1241 900000 423 900000 1077 900000 900000 900000 900000 3533 900000 398 900000 1569 1313 900000 900000 -3628 1006 4670 2184 900000 -422 -965 900000 1255 900000 2720 2076 2209 2268 2849 2763 -1144 1954 900000 -96 2675 2722 627 2643 1692 1985 4437 2304 3311 3171 -160 4305 2998 1234 1356 3737 5150 -1150 1832 -325 4387 -1620 4845 385 1181 933 7969 -906 7009 7944 2772 -5327 -1018 -5486 2220 -5419 -4761 1007 953 -2252 -2241 -2313 3353 -4544 -524 -1930 -2161 4001 194 -4337 -290 2152 422 541 -2029 235 1765 -8768 -2329 -4767 -2395 -3562 1921 2694 9694 50 5427 -1056 1350 -562 1637 -1674 6272 1879 -392 -1848 -4035 4052 715 688 1216 4114 6639 -454 -7865 -7112 SS 20260618T121839.2Z 9665.512954 54 1 54.28 2 82.44 66.67 119.83 35.45 0.00 1 0.00 1 0 25 7.478e-01 1.175e-02 1.962e-01 2.620e-03 8.315268e-01 1.431884e-03 9.739037e-03 -6.000000e+00 4.315104e-01 231.82 -2.00 3.36 -2.00 321.59 0.00e+00 3.299740e-03 7.993132e-04 8.994867e-03 -6.000000e+00 1.909191e-02 284.94 -2.00 20.00 -2.00 321.05 0.00e+00 7.063 0.005 302.00 328.00 3 7.9069e-01 5.3404e-03 8.7214e-02 -6.0000e+00 1.0823e+00 1.7697e-01 8.1984e-03 7.1145e-02 -6.0000e+00 1.1733e+00 -2.9556e-01 8.8978e-03 3.4229e-02 -6.0000e+00 6.9764e-01 1.1898e-01 4.0314e-03 8.2864e-03 -6.0000e+00 2.9525e-01 2.1816e-04 1.6832e-03 6.6287e-05 2.0060e-04 -6.0000e+00 2.0129e-02 8.3458e-02 0.0000e+00 12 9 8 11 8 0 39.07 26.31 0.61 0.08346 0.09611 145 16 1 5 0 374.330 33.75 20.00 26.31 28.84 6.1 968.25 -239322 -291152 -267481 -297939 -247827 -250414 -284974 -254453 -41901 -194863 -228824 -128134 -94488 -99716 900000 77600 -42023 -77825 -8874 -31549 -75516 -43590 49923 -57305 21771 16199 -65530 -24741 -45950 82865 9692 697 -26249 -23945 -15952 39106 -30421 -16 31560 -10218 10018 -2388 2331 13477 -2706 579 1705 -1522 8025 -3408 5536 10972 9145 4170 7304 4986 5793 2480 -3995 11979 5347 9736 6795 3995 3137 1892 388 2783 5293 4840 1591 823 2018 -2770 -1165 -4630 -6221 -4075 -2691 -538 -133 -1160 1251 427 1672 2022 2275 1135 1125 -301 -1157 -2674 -2357 -1598 -1050 396 188 307 -261 -1489 -1785 -1723 -1553 -1616 -1095 -1409 -524 963 1360 637 541 772 -227 -1402 -1006 -410 -148 252 407 634 1439 1374 659 406 -411 -684 491 -344 144 -387 -229 -641 -271 51 1 656 972 316 146 -267 -667 -977 -1556 -3448 -2422 -3390 -1726 -1977 -3640 -2718 -107 -1358 -2710 -744 -527 -764 900000 198 -293 -849 -52 -234 -877 -395 217 -790 145 116 -1038 -265 -704 445 134 12 -657 -563 -350 559 -1057 0 887 -493 427 -122 117 616 -151 33 101 -101 535 -292 495 1034 969 497 888 641 731 312 -529 1414 759 1544 1276 818 645 403 90 713 1539 1553 546 278 626 -812 -302 -1193 -1731 -1303 -1034 -240 -62 -604 677 250 1028 1297 1490 747 708 -179 -660 -1537 -1455 -1139 -883 355 195 347 -294 -1575 -1684 -1613 -1357 -1524 -1082 -1487 -597 1214 1811 963 874 1257 -364 -2172 -1509 -625 -237 396 653 1059 2266 2088 974 581 -574 -939 723 -594 264 -738 -471 -1405 -596 120 3 1637 2451 793 348 -631 -1478 -2117 SS 20260618T122920.6Z 9665.520378 57 1 54.25 2 80.42 68.07 118.61 37.86 0.00 1 0.00 1 0 25 4.703e-01 9.559e-03 3.713e-02 1.147e-03 7.041285e-01 6.072679e-04 7.930618e-03 -6.000000e+00 2.706278e-01 231.82 -2.00 3.36 -2.00 320.72 0.00e+00 2.283536e-03 2.601993e-04 4.076021e-03 -6.000000e+00 1.200142e-02 284.95 -2.00 20.00 -2.00 320.10 0.00e+00 5.732 0.003 302.00 328.00 3 6.6089e-01 1.9294e-03 6.4253e-02 -6.0000e+00 6.7846e-01 4.2566e-02 2.5611e-03 4.1999e-02 -6.0000e+00 7.3505e-01 -1.2977e-01 2.5458e-03 2.1218e-02 -6.0000e+00 4.3688e-01 5.7365e-02 1.2442e-03 5.9630e-03 -6.0000e+00 1.8531e-01 8.6024e-04 1.5282e-03 2.9531e-05 9.7803e-05 -6.0000e+00 1.2658e-02 8.3691e-02 0.0000e+00 12 8 8 10 0 0 5.86 26.32 0.50 0.08369 0.09517 298 32 1 5 0 182.030 33.75 20.00 26.32 29.34 6.0 970.95 -187035 -176750 -139357 -183030 -175335 -151424 -155635 -152272 -129946 -141092 -117314 -102005 -76121 -57182 -22223 -22874 -24270 -10069 -18422 -32104 -29555 -19535 -12516 -20095 -16164 -13894 -30661 -26601 -16116 1099 -13845 -1972 -9057 -14160 -15847 -3056 -8178 -2035 490 233 1204 -408 -1055 1075 630 4110 1165 -480 395 543 2442 4226 2537 3240 3856 1840 1815 592 -970 2890 2214 4224 4174 1482 1330 653 192 1154 2160 2135 1820 1257 1348 -775 -612 -2593 -3451 -2815 -1562 -992 -966 -1668 -711 -77 491 1079 1778 1615 1385 635 -751 -1317 -1584 -1506 -1087 108 470 -110 -225 -1075 -1567 -1393 -1096 -1243 -972 -699 -291 725 1027 1073 738 378 -253 -805 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