File name: Pandora89s1_PaloDuroTX_20250623_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250630T160452.2Z 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_20250623_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: 20250623 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 20250623T120621.5Z 9305.504415 108 1 53.34 2 84.95 64.87 61.50 77.28 0.00 1 0.00 1 0 25 7.850e-01 9.223e-02 3.984e-01 2.351e-02 9.733809e-01 1.536200e-02 1.140536e-02 -6.000000e+00 4.889817e-01 231.75 -2.00 3.36 -2.00 322.44 0.00e+00 -3.147304e-02 8.859497e-03 7.682411e-03 -6.000000e+00 3.146152e-02 285.36 -2.00 20.00 -2.00 321.98 0.00e+00 9.764 0.014 302.00 328.00 3 1.0214e+00 6.4982e-02 1.3047e-01 -6.0000e+00 1.2272e+00 1.7497e+00 7.7250e-02 1.3383e-01 -6.0000e+00 1.3390e+00 -1.8936e+00 5.0655e-02 2.4947e-02 -6.0000e+00 7.9211e-01 6.4808e-01 2.5863e-02 3.5918e-02 -6.0000e+00 3.4173e-01 9.5740e-06 -2.6565e-03 7.1979e-04 3.0012e-04 -6.0000e+00 2.3650e-02 6.0502e-02 0.0000e+00 12 9 8 11 8 0 96.23 26.40 1.55 0.06050 0.04054 21 2 1 5 0 2539.850 34.00 20.00 26.40 28.28 5.9 972.00 900000 -11740 -99192 900000 900000 -14452 79516 900000 900000 1551 900000 900000 900000 900000 900000 71257 900000 900000 76319 224491 900000 54532 900000 900000 900000 900000 900000 900000 900000 900000 -27928 183637 900000 230667 900000 900000 30862 900000 201800 230361 44706 25473 43445 900000 271511 900000 152332 900000 65446 67013 143594 200910 53800 79151 900000 42576 84008 98624 76145 900000 114433 -8410 234450 71595 78056 103224 37099 107858 9055 32122 56657 96767 6762 39302 69389 35759 147648 53615 19372 22232 33419 33643 88248 9195 46039 74271 28834 -83596 21341 205 17652 -358 6351 31243 16229 -941 5356 6580 11329 8620 7621 6684 5668 24094 4081 266 -2041 5691 -1552 360 724 4280 4841 -2273 -1164 -2693 -2521 -8243 70 3813 2662 3274 9735 -2719 7692 264 276 -1030 5018 -2524 -2598 -2559 665 1567 -2452 -1009 -550 1397 3070 23 -1270 -427 900000 -601 -10348 900000 900000 -521 1810 900000 900000 79 900000 900000 900000 900000 900000 2162 900000 900000 2027 5110 900000 1655 900000 900000 900000 900000 900000 900000 900000 900000 -2196 4180 900000 5250 900000 900000 1596 900000 4593 5243 3700 2477 3236 900000 6180 900000 3467 900000 3115 3466 3862 4573 4230 5241 900000 4581 5910 5510 4727 900000 4499 -1235 5336 5629 5653 5767 4222 6695 1742 5450 7854 9691 1399 5725 6475 4232 5713 5857 3527 4655 7302 8270 13457 3286 12051 15214 9450 -75589 7092 78 5303 -127 2226 9742 6907 -554 3438 4658 7813 5788 4649 3651 3032 11461 2517 179 -1519 4365 -1480 390 869 5192 5862 -2871 -1404 -3298 -3208 -11707 95 4877 3259 3808 10326 -3169 7879 283 309 -1360 7332 -4527 -5150 -5474 1491 3788 -6581 -2735 -1504 3745 7722 55 -2842 -896 SS 20250623T122757.6Z 9305.519417 114 1 10.05 2 80.90 67.74 57.28 79.67 0.00 1 0.00 1 0 25 4.125e-01 1.019e-02 1.620e-01 4.243e-03 6.917007e-01 2.264872e-03 7.709318e-03 -6.000000e+00 2.397465e-01 231.75 -2.00 3.36 -2.00 320.82 0.00e+00 3.052406e-03 9.970202e-04 3.401774e-03 -6.000000e+00 1.058384e-02 285.36 -2.00 20.00 -2.00 320.21 0.00e+00 5.999 0.003 302.00 328.00 3 1.2062e+00 7.3600e-03 6.5169e-02 -6.0000e+00 6.0090e-01 1.0068e-01 9.9072e-03 3.9973e-02 -6.0000e+00 6.5062e-01 -1.7588e-01 9.8148e-03 2.1137e-02 -6.0000e+00 3.8537e-01 7.2291e-02 4.7649e-03 6.4275e-03 -6.0000e+00 1.6353e-01 3.9593e-04 3.2187e-04 1.1170e-04 9.2983e-05 -6.0000e+00 1.1202e-02 6.0719e-02 0.0000e+00 12 9 9 12 1 1 83.13 26.38 0.64 0.06072 0.06314 24 15 1 5 0 401.830 34.00 20.00 26.38 28.82 5.9 975.85 -115995 -181846 -124184 -158885 -134786 900000 -172963 -165438 -49064 -109036 -104101 -113819 -66786 -79400 26838 -8414 -42973 -23111 -46315 -11415 -49473 -19700 15015 -31939 -24244 -45963 -15909 -38370 -20215 4739 -17008 -9842 -22646 -18696 -1978 -1853 -15564 -3382 -4978 -975 3329 2284 1030 -816 3082 8557 2114 -4798 1655 3369 7250 7065 1949 4096 8244 2041 427 3419 -4612 2255 2313 428 6745 3185 2097 1246 -57 2418 -265 3124 1849 781 2397 -1325 -1684 -2797 -3534 -2811 -1208 -1501 -1345 -1898 -759 -259 -141 1344 1879 357 1756 1247 -296 -1542 -1632 -1170 -1072 -348 1122 435 -594 -1291 -1331 -1542 -1471 -1426 -1261 -653 -124 230 771 1428 716 860 -412 -718 -105 -443 -152 -72 9 461 1043 612 652 477 244 -297 151 -149 127 -575 -207 -380 -69 -77 59 193 796 457 513 -56 -1055 -934 -741 -2461 -934 -1553 -1014 900000 -2341 -2364 -264 -1127 -1163 -1789 -856 -1478 211 -108 -871 -421 -1130 -203 -1289 -399 236 -872 -652 -1578 -395 -1174 -560 123 -668 -423 -1208 -928 -82 -84 -966 -229 -416 -89 315 231 109 -89 334 902 247 -635 221 496 1160 1251 398 876 1770 483 103 776 -1114 524 592 128 1958 1021 669 397 -19 871 -114 1444 909 385 1100 -577 -659 -1032 -1330 -1180 -597 -877 -829 -1299 -546 -198 -116 1143 1640 317 1487 990 -224 -1133 -1237 -992 -977 -367 1249 536 -743 -1530 -1532 -1611 -1536 -1609 -1397 -759 -155 313 1095 2249 1136 1374 -645 -1140 -158 -676 -243 -115 14 754 1627 987 1015 714 353 -417 220 -247 224 -1054 -406 -741 -143 -170 130 437 1821 1049 1128 -122 -2194 -1868 SS 20250623T123840.8Z 9305.526861 119 1 54.16 2 78.85 69.12 55.17 80.87 0.00 1 0.00 1 0 25 2.239e-01 8.517e-03 1.543e-02 7.505e-04 5.894430e-01 3.892848e-04 6.464064e-03 -6.000000e+00 1.292362e-01 231.75 -2.00 3.36 -2.00 319.94 0.00e+00 2.271457e-03 1.281730e-04 1.484278e-03 -6.000000e+00 5.718372e-03 285.36 -2.00 20.00 -2.00 319.24 0.00e+00 4.993 0.002 302.00 328.00 3 6.2435e-01 1.1451e-03 5.3474e-02 -6.0000e+00 3.2394e-01 1.7954e-02 1.3945e-03 3.0320e-02 -6.0000e+00 3.5057e-01 -6.8917e-02 1.2197e-03 1.5635e-02 -6.0000e+00 2.0842e-01 3.0058e-02 6.2975e-04 5.0741e-03 -6.0000e+00 8.8758e-02 1.8413e-03 5.0757e-04 1.9931e-05 5.7869e-05 -6.0000e+00 6.0241e-03 6.0831e-02 0.0000e+00 11 9 0 11 8 0 31.28 26.37 0.43 0.06083 0.06465 420 45 1 5 0 128.930 33.75 20.01 26.37 29.40 6.0 981.51 -76787 -62420 -68986 -91214 -105768 -73092 -74264 -70355 -58498 -69274 -66240 -49529 -25784 -21247 -12998 -13710 -8242 -15248 -3741 -6853 -10146 -9202 -6211 -4032 -5264 -4607 -10141 -7959 -10635 -6131 -4054 -3855 -3509 -6917 -5298 -3486 -5356 -926 846 -329 393 891 602 1521 1448 1145 806 -832 1426 1854 1353 2515 2361 2437 2842 1359 973 547 -427 1986 2137 2814 3055 982 596 -733 -1070 142 448 1054 1262 843 682 -249 -1319 -2524 -3279 -2409 -1761 -1329 -900 -1863 -1193 -684 180 1040 1454 1320 1378 888 38 -908 -1247 -1217 -644 283 936 362 -145 -558 -1229 -1273 -812 -1199 -968 -876 -628 349 869 1128 676 478 41 -716 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