File name: Pandora89s1_PaloDuroTX_20250715_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250716T065827.4Z 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_20250715_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: 20250715 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 20250715T123046.8Z 9327.521375 202 1 54.26 2 82.19 69.28 47.34 220.36 0.00 1 0.00 1 0 25 6.497e-01 2.141e-02 3.089e-01 5.383e-03 7.977238e-01 3.087521e-03 9.059602e-03 -6.000000e+00 3.807051e-01 231.47 -2.00 3.36 -2.00 321.78 0.00e+00 4.767674e-03 1.834124e-03 7.231996e-03 -6.000000e+00 2.051317e-02 287.19 -2.00 20.00 -2.00 321.25 0.00e+00 6.863 0.005 302.00 328.00 3 2.0711e+00 1.2304e-02 8.1574e-02 -6.0000e+00 9.5368e-01 3.6933e-01 1.7712e-02 5.9889e-02 -6.0000e+00 1.0364e+00 -6.4857e-01 1.7518e-02 2.7060e-02 -6.0000e+00 6.1369e-01 2.7780e-01 7.9331e-03 6.6326e-03 -6.0000e+00 2.6542e-01 7.1931e-05 2.7013e-04 1.5140e-04 1.8204e-04 -6.0000e+00 1.8054e-02 6.1834e-02 0.0000e+00 12 8 8 10 0 0 22.77 26.33 0.88 0.06183 0.06386 50 5 1 5 0 1085.030 34.00 19.99 26.33 26.60 6.0 960.45 900000 -232903 -272293 900000 900000 -79188 -219594 -188249 900000 -236942 900000 900000 900000 145622 900000 -107609 89514 900000 3818 170074 -37330 37557 900000 37777 105143 900000 81878 63226 120842 900000 -64057 -46816 253937 -3388 128188 900000 -32178 23883 112927 4802 33220 39353 -7639 71937 13300 84268 42368 34471 20231 32782 27456 16148 19350 25608 51996 13474 30268 22536 5365 28764 12229 3434 27537 4717 9174 4639 7456 10584 1963 7506 6690 7338 2334 648 358 4128 3194 2995 3833 794 746 110 4346 -1795 868 3655 1893 -12345 1378 -396 1721 -4148 -5131 -1060 -1515 -2481 -1002 145 342 -1588 -886 -1752 -3780 -548 -1974 -2376 -1539 981 224 467 458 634 -625 -2014 -968 -823 271 -1398 1040 894 1921 1627 2699 1354 1462 115 737 -625 924 -107 -167 -157 259 169 -303 356 544 815 607 -387 -1994 -1280 900000 -5542 -9200 900000 900000 -415 -4180 -2867 900000 -6427 900000 900000 900000 762 900000 -2663 469 900000 38 890 -551 268 900000 306 550 900000 429 391 633 900000 -2317 -1671 1329 -81 793 900000 -1256 648 1655 234 1304 1524 -484 2071 703 2250 1796 1678 1228 1973 1969 1428 1813 2399 3892 1524 2868 2218 609 2650 1466 518 3748 867 1599 847 1386 2116 496 1992 1870 2009 629 161 79 828 665 715 1100 279 305 50 2024 -951 478 2057 1117 -8407 790 -216 865 -2156 -2826 -641 -1088 -1927 -894 142 337 -1501 -746 -1340 -2934 -445 -1722 -2205 -1535 1060 279 657 697 982 -961 -3002 -1376 -1183 405 -2257 1559 1441 2923 2390 3797 1862 1947 150 1009 -1001 1535 -201 -339 -337 592 385 -731 872 1348 2010 1430 -858 -4533 -2770 SS 20250715T124813.2Z 9327.533486 207 1 54.19 2 78.82 71.57 49.66 225.15 0.00 1 0.00 1 0 17 3.151e-01 8.416e-03 6.338e-02 1.825e-03 6.244782e-01 9.597805e-04 6.890102e-03 -6.000000e+00 1.816361e-01 231.47 -2.00 3.36 -2.00 320.50 0.00e+00 1.720933e-03 3.864211e-04 2.145876e-03 -6.000000e+00 8.110334e-03 287.19 -2.00 20.00 -2.00 319.83 0.00e+00 4.980 0.002 302.00 328.00 3 2.1768e+00 2.9857e-03 5.4964e-02 -6.0000e+00 4.5467e-01 1.2942e-03 3.8571e-03 3.3587e-02 -6.0000e+00 4.9205e-01 -7.7837e-02 3.6741e-03 1.7016e-02 -6.0000e+00 2.9293e-01 3.3314e-02 1.8344e-03 4.9214e-03 -6.0000e+00 1.2500e-01 3.8238e-04 4.5663e-04 4.9096e-05 6.4830e-05 -6.0000e+00 8.4769e-03 6.2901e-02 0.0000e+00 11 8 0 10 0 0 49.38 26.33 0.62 0.06290 0.06633 98 11 1 5 0 552.910 34.00 20.00 26.33 27.50 5.9 965.86 -66543 -125884 -136492 -110957 -112564 -123133 -140282 -95713 -15550 -109947 -72535 -39548 5935 -10283 -10494 -40235 -6060 -22499 -20427 -12824 -25275 -16533 -387 -8535 225 13380 -21424 -27452 -7571 11383 -14446 -15580 2282 -16393 -6853 15547 -13343 -1710 1839 2263 1627 108 -584 2172 -344 6468 2513 2553 -1139 1734 2215 3445 46 1332 4931 -169 1166 399 -1834 2115 633 1287 3466 709 500 236 -1955 1262 46 972 1461 1352 1496 -78 -504 -1515 -1841 -1956 -1454 -1075 -551 -2039 -272 -924 980 1407 1705 -291 1466 749 270 -1489 -1725 -932 -795 11 772 512 -46 -659 -1051 -1358 -1309 -737 -1277 -844 -560 514 733 1147 593 688 -65 -759 -655 -647 -220 -17 269 289 1014 815 471 580 -335 -220 385 -245 8 -334 -278 -291 -49 71 15 420 612 445 61 -159 -798 -646 -398 -1486 -1766 -1023 -1038 -1374 -2133 -1175 -94 -1800 -916 -450 55 -141 -174 -1017 -121 -576 -545 -329 -738 -465 -10 -266 7 367 -808 -1075 -260 383 -751 -954 127 -1059 -398 797 -1087 -153 193 268 209 15 -83 306 -51 914 381 404 -200 329 470 794 12 332 1240 -46 316 106 -491 617 187 430 1278 284 195 91 -789 543 23 540 847 780 818 -40 -231 -652 -798 -943 -827 -653 -382 -1575 -219 -740 826 1243 1550 -270 1293 620 226 -1216 -1442 -794 -782 11 920 668 -60 -817 -1184 -1507 -1462 -823 -1516 -1052 -745 687 1093 1768 971 1127 -102 -1143 -1004 -996 -331 -27 448 480 1611 1254 748 882 -495 -313 562 -379 14 -600 -531 -581 -97 153 33 914 1353 986 130 -338 -1615 -1260 SS 20250715T125411.4Z 9327.537633 210 1 54.30 2 77.66 72.35 50.50 226.71 0.00 1 0.00 1 0 17 2.201e-01 8.050e-03 2.560e-02 1.241e-03 5.749377e-01 6.432993e-04 6.317261e-03 -6.000000e+00 1.268882e-01 231.47 -2.00 3.36 -2.00 320.03 0.00e+00 1.483498e-03 2.180861e-04 1.415814e-03 -6.000000e+00 5.665060e-03 287.20 -2.00 20.00 -2.00 319.30 0.00e+00 4.545 0.001 302.00 328.00 3 1.9426e+00 1.9080e-03 4.9915e-02 -6.0000e+00 3.1763e-01 -1.5779e-03 2.3538e-03 2.9742e-02 -6.0000e+00 3.4373e-01 -7.0619e-02 2.0709e-03 1.5029e-02 -6.0000e+00 2.0463e-01 3.0995e-02 1.0630e-03 4.4486e-03 -6.0000e+00 8.7327e-02 7.3154e-04 4.6256e-04 3.3456e-05 5.0053e-05 -6.0000e+00 5.9211e-03 6.2255e-02 0.0000e+00 11 8 0 10 0 0 13.17 26.34 0.45 0.06226 0.06573 155 17 1 5 0 350.280 34.00 20.01 26.34 27.56 5.9 966.04 -79510 -80356 -80836 -73026 -85575 -77546 -99057 -66703 -44370 -65414 -64849 -41059 -3523 -10260 -5989 -12641 -4962 255 -3991 -4711 -7694 -6652 -427 -5005 -1067 -1533 -5277 -11136 -3655 1512 -4756 -3761 929 -8601 -7159 -427 -6197 -785 1327 -370 -1111 1302 16 1659 1466 2240 429 -1400 431 994 1414 2066 1521 2450 3058 732 1403 124 -1423 1297 941 2356 3254 1318 92 -583 -1404 686 424 676 840 756 792 88 -717 -1655 -2214 -2052 -1806 -1077 -1006 -1726 -682 -499 433 1089 1405 588 1747 930 -15 -876 -1311 -1169 -763 56 737 484 -1 -568 -1408 -1318 -997 -1153 -1004 -773 -606 558 785 1111 764 568 -22 -733 -427 -496 -144 51 128 230 914 706 527 500 -317 -283 367 -70 20 -170 -290 -253 -23 -95 9 406 662 468 74 -217 -788 -727 -1164 -1283 -1271 -972 -1263 -1145 -2073 -1154 -671 -1274 -1389 -854 -63 -246 -164 -414 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