File name: Pandora89s1_PaloDuroTX_20260706_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20260707T070900.7Z 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_20260706_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: 20260706 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 20260706T121222.6Z 9683.508595 188 1 54.67 2 84.74 65.97 34.76 194.98 0.00 1 0.00 1 0 17 6.384e-01 5.488e-02 3.873e-01 2.935e-02 1.015367e+00 1.898144e-02 1.075365e-02 -6.000000e+00 3.996579e-01 231.59 -2.00 3.36 -2.00 322.47 0.00e+00 -1.614928e-02 1.184608e-02 6.882642e-03 -6.000000e+00 3.075804e-02 286.44 -2.00 20.00 -2.00 322.03 0.00e+00 9.470 0.013 302.00 328.00 3 1.4847e+00 8.4022e-02 1.0455e-01 -6.0000e+00 1.0085e+00 1.9632e+00 9.2941e-02 5.8645e-02 -6.0000e+00 1.1132e+00 -2.3162e+00 4.9680e-02 2.3893e-02 -6.0000e+00 6.4551e-01 8.3183e-01 2.8999e-02 6.7253e-03 -6.0000e+00 2.7463e-01 7.0337e-06 1.4997e-03 8.5206e-04 2.0749e-04 -6.0000e+00 1.9128e-02 8.1141e-02 0.0000e+00 12 8 8 10 0 0 -1.44 26.37 2.01 0.08114 0.09241 18 2 1 5 0 3036.810 34.00 20.00 26.37 26.81 6.1 953.57 900000 -32710 -13187 900000 900000 66511 192140 900000 900000 900000 900000 900000 900000 900000 900000 38386 900000 900000 13752 44134 900000 -24229 900000 190539 900000 900000 900000 36685 43637 900000 26299 900000 900000 900000 -53889 900000 -43080 107451 900000 900000 900000 -11644 42912 900000 44779 900000 137258 278913 -16761 900000 84851 37539 24148 128926 900000 11949 161260 67551 210011 228738 14980 -19382 91599 95180 28399 127946 19854 35678 8926 41495 44614 26426 1450 52408 -2852 22199 900000 -17551 3944 12287 3285 9739 95367 -10960 8903 79452 2597 -25770 -16015 -27088 11004 -22676 21480 2068 23144 -5872 7321 -4791 10209 889 14475 1530 -10159 32173 -3473 -13008 1650 -1319 2920 -448 -7977 872 11616 -9065 -781 -389 -3179 -7936 -287 2070 5579 1175 17785 -110 1695 899 -1574 1007 5772 -476 606 -598 -587 3216 201 -2658 10 514 1658 447 -2644 -1710 900000 -4570 -1218 900000 900000 2047 5459 900000 900000 900000 900000 900000 900000 900000 900000 2454 900000 900000 977 2090 900000 -2123 900000 5414 900000 900000 900000 1303 1447 900000 1427 900000 900000 900000 -5707 900000 -5008 3331 900000 900000 900000 -1414 2771 900000 2429 900000 3900 7925 -1775 900000 3945 3006 2370 4662 900000 1451 4582 4013 5967 6499 1393 -2854 4969 5163 2934 4957 2410 4147 1545 5574 5877 3959 251 4738 -390 2236 900000 -3541 773 2618 887 2712 11923 -4204 2934 13319 945 -12155 -6462 -11314 3002 -8763 5859 805 8680 -3470 4410 -3553 6469 573 7197 778 -5860 13073 -2122 -9314 1120 -1053 2622 -480 -10064 1041 12377 -11513 -894 -454 -4019 -11094 -377 2552 6261 1328 16575 -119 1763 932 -1847 1374 8791 -873 1208 -1303 -1388 7940 537 -7410 27 1381 4121 1032 -5808 -3601 SS 20260706T122509.8Z 9683.517475 191 1 54.28 2 82.33 67.68 35.49 200.30 0.00 1 0.00 1 0 25 7.612e-01 1.075e-02 3.539e-01 3.631e-03 8.286554e-01 2.028026e-03 9.008473e-03 -6.000000e+00 4.412280e-01 231.59 -2.00 3.36 -2.00 321.72 0.00e+00 1.793762e-03 1.185953e-03 5.934951e-03 -6.000000e+00 2.120874e-02 286.44 -2.00 20.00 -2.00 321.20 0.00e+00 6.973 0.005 302.00 328.00 3 1.4216e+00 7.8476e-03 8.0332e-02 -6.0000e+00 1.1022e+00 1.2415e-01 1.2461e-02 5.7268e-02 -6.0000e+00 1.1960e+00 -2.8928e-01 1.3705e-02 2.9275e-02 -6.0000e+00 7.1232e-01 1.2061e-01 6.1411e-03 8.0275e-03 -6.0000e+00 3.0215e-01 1.2960e-04 1.4112e-03 9.4782e-05 1.5130e-04 -6.0000e+00 2.0932e-02 8.4431e-02 0.0000e+00 12 8 8 10 0 0 15.93 26.38 0.74 0.08443 0.09504 91 10 1 5 0 596.400 34.00 20.00 26.38 27.71 6.1 959.65 -238129 -320564 -227209 -177210 -212530 -294974 -271036 -166007 22604 -79119 -185759 900000 66281 202266 900000 -19101 -6688 97933 -96330 -69776 -53996 -7833 67044 101240 900000 900000 18184 -6383 137315 339835 -32289 -7184 -6514 -75621 -33744 900000 -36005 10067 13604 9588 2377 -6023 -4288 8756 3933 53717 3886 6157 -10768 617 2977 20255 1008 15069 13116 1581 4450 293 -10945 6065 8551 5693 13660 -1878 -1781 3190 -1459 5389 2105 1354 2185 567 5157 -3851 -3262 -1861 -648 -3056 3013 -746 15 -1805 575 -964 1646 2961 2719 110 1481 -687 -1014 -2170 -3018 -2362 -420 -253 772 375 407 -1317 -969 -1447 -1990 266 -860 -735 -230 646 467 1110 587 349 -297 -1602 261 -798 -734 -68 -172 164 1786 851 892 435 -775 -238 278 -449 324 -449 -67 -533 -64 2 35 900 540 370 38 -108 -885 -761 -1302 -4329 -1169 -627 -888 -3130 -2614 -640 80 -280 -1254 900000 234 715 900000 -80 -28 346 -1146 -651 -434 -43 237 358 900000 900000 99 -45 486 1202 -582 -119 -115 -2567 -764 900000 -1146 253 399 332 96 -279 -200 365 178 1539 195 327 -750 44 237 1511 101 1407 1317 184 501 33 -1363 665 1028 821 2092 -357 -336 587 -300 1178 554 395 656 169 1368 -1008 -762 -412 -150 -852 962 -294 7 -918 304 -506 896 1668 1572 65 825 -401 -565 -1215 -1835 -1508 -312 -221 774 410 442 -1351 -882 -1206 -1701 240 -827 -752 -255 731 608 1620 920 554 -463 -2418 376 -1188 -1151 -113 -269 268 2736 1270 1286 609 -1062 -319 401 -759 575 -893 -143 -1130 -146 4 88 2315 1320 898 93 -249 -1912 -1598 SS 20260706T124320.8Z 9683.530102 196 1 54.18 2 78.86 70.06 36.90 207.49 0.00 1 0.00 1 0 17 2.977e-01 8.950e-03 2.286e-02 9.186e-04 6.244061e-01 4.780465e-04 6.805581e-03 -6.000000e+00 1.711722e-01 231.59 -2.00 3.36 -2.00 320.23 0.00e+00 1.590628e-03 1.752583e-04 1.961131e-03 -6.000000e+00 7.645968e-03 286.45 -2.00 20.00 -2.00 319.54 0.00e+00 4.995 0.002 302.00 328.00 3 9.7880e-01 1.4505e-03 5.4759e-02 -6.0000e+00 4.2866e-01 -1.8186e-02 1.8255e-03 3.2848e-02 -6.0000e+00 4.6440e-01 -7.9500e-02 1.6619e-03 1.6843e-02 -6.0000e+00 2.7632e-01 3.8123e-02 8.3904e-04 5.0941e-03 -6.0000e+00 1.1740e-01 1.2776e-03 1.4613e-03 2.4272e-05 6.3283e-05 -6.0000e+00 8.0134e-03 8.4855e-02 0.0000e+00 11 8 0 10 0 0 5.50 26.37 0.50 0.08485 0.09584 341 37 1 5 0 158.880 33.75 20.00 26.37 28.96 6.0 968.47 -105758 -85584 -99682 -122471 -129887 -106897 -112465 -92428 -52581 -71292 -82826 -74480 -40555 -30638 -8635 -18554 -18998 -30451 -5394 -8925 -20847 -6228 -7941 -10756 -5706 -12613 -12926 -16955 -13605 -2845 -6120 -4438 -6219 -10768 -11333 -2756 -6788 -1284 1080 302 961 1387 1203 1810 879 1333 571 -328 650 1992 2146 2346 2293 2611 2609 1363 793 973 -119 1949 2334 4306 3389 1786 803 -330 -243 979 481 1202 1045 924 801 -792 -1321 -3011 -3486 -2600 -1892 -1283 -1340 -1862 -942 -653 506 924 1413 1714 1238 924 -295 -956 -1148 -1170 -735 446 816 308 -309 -871 -1375 -1230 -923 -1323 -885 -800 -278 462 976 1028 737 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