File name: Pandora89s1_PaloDuroTX_20251228_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20251229T065335.8Z 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_20251228_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: 20251228 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 20251228T142642.5Z 9493.601881 72 1 54.25 2 84.96 122.99 133.25 23.72 0.00 1 0.00 1 0 17 5.365e-01 2.538e-02 3.192e-01 8.441e-03 8.541495e-01 4.936333e-03 8.656969e-03 -6.000000e+00 3.117706e-01 223.58 -2.00 3.36 -2.00 322.27 0.00e+00 5.060064e-03 2.974391e-03 6.306085e-03 -6.000000e+00 1.858329e-02 275.41 -2.00 20.00 -2.00 321.84 0.00e+00 9.809 0.014 302.00 328.00 3 2.2519e-01 1.8795e-02 1.0572e-01 -6.0000e+00 7.7000e-01 8.4581e-01 2.6802e-02 7.0522e-02 -6.0000e+00 8.4692e-01 -1.1915e+00 2.8251e-02 2.4085e-02 -6.0000e+00 4.9483e-01 4.8734e-01 1.2862e-02 1.2289e-02 -6.0000e+00 2.1559e-01 3.7403e-05 -3.9603e-04 2.4528e-04 1.0542e-04 -6.0000e+00 1.5344e-02 7.9177e-02 0.0000e+00 12 8 8 10 0 0 26.95 25.57 1.26 0.07918 0.07620 62 7 1 5 0 874.980 33.50 20.00 25.57 17.51 6.0 891.38 900000 -199485 -192848 900000 900000 -90772 -162553 900000 900000 900000 -24482 900000 900000 46356 74498 -37358 59537 46398 -68641 -30575 -59620 -32821 900000 29437 900000 900000 182364 179156 900000 900000 -6254 29267 900000 -20589 900000 900000 24368 77834 900000 900000 63305 63372 52523 195729 63716 900000 113181 91173 33079 73137 52040 36394 20463 73826 136150 36304 52396 27120 4799 43741 21672 17355 39632 3566 6799 15953 9437 24558 990 -2701 9999 10845 8094 -12729 -9119 -2509 37092 4450 7971 9344 4241 535 11186 -1729 15716 4657 5387 -8906 1574 -1608 5504 -7703 -10393 2690 -3610 -1800 -1291 -1678 1671 -1678 2165 -3090 -7607 4568 -903 -7148 -1648 2783 -1427 2114 -1900 -1946 -103 -3906 -1562 -438 -568 -2371 -147 1146 3338 1408 4195 1535 1658 1211 606 239 798 719 -84 169 615 127 -385 937 410 281 908 114 -1969 -2677 900000 -8040 -6586 900000 900000 -947 -3634 900000 900000 900000 -201 900000 900000 380 611 -752 488 449 -2097 -615 -1511 -636 900000 329 900000 900000 1495 1469 900000 900000 -144 545 900000 -614 900000 900000 545 1218 900000 900000 1557 1606 1487 1604 1614 900000 1855 1970 1518 2518 2474 2208 1577 3510 3571 2619 3135 1978 421 2653 1812 1750 3671 506 925 2001 1331 3321 196 -607 2041 2133 1513 -2619 -1607 -393 4105 795 1679 2313 1283 186 3713 -697 5655 1958 2305 -4380 670 -659 1994 -3157 -4694 1242 -2119 -1230 -1029 -1483 1435 -1396 1546 -2092 -5400 3100 -686 -6163 -1471 2681 -1662 2470 -2507 -2631 -135 -5108 -1941 -549 -752 -3398 -213 1594 4318 1971 5553 2024 2128 1530 830 349 1349 1365 -175 373 1458 326 -959 2342 1045 714 2366 278 -4550 -5999 SS 20251228T143847.1Z 9493.610267 75 1 54.12 2 82.91 124.86 132.18 27.31 0.00 1 0.00 1 0 17 5.483e-01 1.234e-02 1.835e-01 3.057e-03 7.057807e-01 1.619517e-03 7.873943e-03 -6.000000e+00 3.079942e-01 223.58 -2.00 3.36 -2.00 321.39 0.00e+00 5.190499e-03 8.061654e-04 4.135814e-03 -6.000000e+00 1.436920e-02 275.41 -2.00 20.00 -2.00 320.92 0.00e+00 7.466 0.006 302.00 328.00 3 8.9610e-01 5.4870e-03 7.5721e-02 -6.0000e+00 7.6287e-01 1.2956e-01 8.0264e-03 3.9930e-02 -6.0000e+00 8.3408e-01 -2.0242e-01 9.0768e-03 2.5940e-02 -6.0000e+00 4.9216e-01 8.3890e-02 4.2724e-03 1.1485e-02 -6.0000e+00 2.1104e-01 1.6754e-04 1.1419e-03 8.3523e-05 1.7211e-04 -6.0000e+00 1.4997e-02 7.6994e-02 0.0000e+00 12 8 8 10 0 0 99.93 25.57 0.59 0.07699 0.08557 149 16 1 5 0 363.200 33.50 20.00 25.57 18.02 6.0 895.34 -103124 -261888 -257230 900000 -200725 -242280 -244247 900000 900000 83571 -90239 -67655 900000 -35021 -38860 -70619 -46823 -1846 -40932 -82008 -48527 -31931 19276 -33090 2301 91456 -29355 20726 81584 82201 -1580 14571 38774 -34755 8498 135372 -699 618 17439 6710 23866 8583 4877 12569 4874 11400 13450 9977 -2562 9958 8103 6189 3693 8075 15277 2861 4394 2154 -8811 9184 4482 4431 5883 368 2493 -317 1861 1911 528 2750 808 1196 454 -4111 -4855 -3808 -3281 -1744 -1085 277 -838 -949 -370 -507 2709 655 2069 -933 1432 -3 -758 -3310 -2670 -1265 -1448 290 936 307 950 -848 -389 -1739 -2358 -801 -887 -1399 -482 1485 693 1289 426 315 -112 -1396 -813 -673 -186 -369 472 224 1594 1043 930 428 -142 -387 703 -249 -37 -445 -838 -352 -51 140 55 688 558 479 356 -130 -973 -904 -363 -4892 -4457 900000 -1793 -3542 -4100 900000 900000 249 -489 -385 900000 -247 -347 -994 -583 -16 -554 -1710 -723 -424 184 -572 29 490 -516 222 535 661 -36 330 739 -1325 210 1048 -25 27 774 374 1208 537 327 797 345 784 953 778 -246 955 893 767 514 1142 2097 457 687 334 -1509 1373 786 899 1340 94 610 -80 482 553 180 1008 314 455 163 -1404 -1499 -1103 -982 -591 -440 131 -460 -520 -214 -315 1741 451 1444 -670 964 -2 -457 -2000 -1688 -901 -1213 279 947 340 1039 -881 -393 -1625 -2255 -816 -955 -1472 -544 1822 973 1854 655 487 -168 -2181 -1219 -1024 -296 -578 759 355 2582 1643 1418 632 -204 -543 1039 -394 -66 -882 -1656 -730 -111 332 127 1615 1336 1141 866 -299 -2114 -1911 SS 20251228T144923.0Z 9493.617627 78 1 54.20 2 81.14 126.55 131.14 30.35 0.00 1 0.00 1 0 25 3.064e-01 8.574e-03 3.470e-02 1.205e-03 6.131054e-01 6.123537e-04 6.727831e-03 -6.000000e+00 1.710920e-01 223.58 -2.00 3.36 -2.00 320.47 0.00e+00 2.581843e-03 2.324768e-04 2.072988e-03 -6.000000e+00 7.512702e-03 275.41 -2.00 20.00 -2.00 319.95 0.00e+00 6.155 0.003 302.00 328.00 3 5.6754e-01 1.8271e-03 6.1905e-02 -6.0000e+00 4.2209e-01 4.2691e-02 2.3375e-03 3.1152e-02 -6.0000e+00 4.6070e-01 -9.1537e-02 2.3599e-03 1.7937e-02 -6.0000e+00 2.7411e-01 3.9431e-02 1.1929e-03 7.0258e-03 -6.0000e+00 1.1749e-01 7.6158e-04 1.3471e-03 3.2222e-05 8.2562e-05 -6.0000e+00 8.2288e-03 7.7210e-02 0.0000e+00 11 8 0 10 0 0 99.92 25.57 0.50 0.07721 0.08733 329 35 1 5 0 164.720 33.50 19.99 25.57 18.61 6.0 899.26 -111058 -134616 -115849 -109600 -110158 -110397 -129185 -51440 -46013 -81522 -91393 -60971 -13572 -32473 -17629 -33426 -21852 -21674 -14869 -24427 -19057 -13921 -5084 -11196 -14840 2074 -16153 -13549 -532 -1967 -5006 -5043 990 -14065 -6424 4458 -6684 -1440 1297 912 1973 675 292 2279 -12 4129 1171 -633 -1340 2718 2675 1715 2467 3048 3851 695 -102 57 -1947 605 2046 3192 3688 671 876 -546 -457 1607 1107 975 1062 1419 1361 -481 -1038 -2084 -2457 -1781 -1425 -897 -885 -1773 -1235 -866 721 633 1461 1410 1220 726 -368 -1480 -1764 -1041 -737 163 881 436 -316 -577 -1127 -1278 -832 -1145 -923 -1038 -363 724 855 1238 755 419 -147 -1026 -645 -573 -2 92 216 410 1197 820 499 222 -552 -314 246 -203 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