File name: Pandora89s1_PaloDuroTX_20250815_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250816T065820.9Z 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_20250815_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: 20250815 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 20250815T123857.4Z 9358.527053 205 1 54.52 2 84.56 76.88 18.65 219.34 0.00 1 0.00 1 0 25 6.363e-01 8.198e-02 3.910e-01 3.119e-02 9.678737e-01 1.986178e-02 1.046670e-02 -6.000000e+00 3.954231e-01 230.56 -2.00 3.36 -2.00 322.17 0.00e+00 -1.080451e-02 1.060974e-02 4.792920e-03 -6.000000e+00 2.293889e-02 287.65 -2.00 20.00 -2.00 321.65 0.00e+00 9.230 0.012 302.00 328.00 3 1.5348e+00 7.8876e-02 1.0220e-01 -6.0000e+00 9.9697e-01 2.0116e+00 9.1667e-02 6.7844e-02 -6.0000e+00 1.0982e+00 -1.9045e+00 5.4542e-02 2.3696e-02 -6.0000e+00 6.3616e-01 5.9707e-01 2.9086e-02 1.2562e-02 -6.0000e+00 2.6857e-01 6.9481e-06 -1.9961e-03 9.0084e-04 1.0175e-04 -6.0000e+00 1.9298e-02 6.6245e-02 0.0000e+00 12 9 8 11 8 0 -77.10 26.41 2.08 0.06625 0.05125 15 2 1 5 0 3633.940 34.00 20.00 26.41 28.17 5.9 968.38 900000 -41647 -56495 900000 900000 -36063 900000 900000 -4985 118965 900000 900000 189039 100747 900000 105882 900000 900000 32359 38660 900000 138579 900000 47823 900000 900000 900000 900000 74133 900000 -46999 900000 900000 900000 900000 900000 -38573 104518 900000 154547 900000 6153 -1506 900000 238047 900000 164725 900000 30894 60181 110673 70317 40193 66497 182459 86940 67515 111772 102034 107730 -10241 -32728 159562 120452 56233 60368 10366 87273 13570 39890 11176 29113 4910 51268 14338 -8613 98452 -7595 7860 12824 24150 24515 96444 5851 59107 85989 7171 -58388 -5543 -12381 13334 -1050 11782 5716 8307 -33209 14746 1299 10174 3012 21876 12916 16045 18831 4959 -3275 -3020 11625 4278 -3163 66 965 5787 -9059 6245 -4734 -1336 -5065 4317 2078 2952 -1450 8100 -1681 7609 -1754 -7713 1722 6316 3492 -2952 -504 -2223 1531 -350 -1779 1579 618 1657 -2534 -2427 2358 900000 -4301 -5834 900000 900000 -2180 900000 900000 -264 3596 900000 900000 5714 3045 900000 3200 900000 900000 1956 2045 900000 4189 900000 2409 900000 900000 900000 900000 2241 900000 -6199 900000 900000 900000 900000 900000 -5194 4021 900000 4671 900000 828 -207 900000 7195 900000 4979 900000 2801 4465 5474 5603 4639 6212 5515 6928 6308 6143 5607 5328 -1717 -7644 6138 7281 6335 6469 1908 8153 3020 7453 2856 6000 1174 6762 2364 -1633 7142 -1628 1900 3489 6789 7632 15450 2441 15186 17414 3230 -49768 -2647 -5838 4554 -406 4238 2505 4193 -29812 9538 1068 7750 2313 12365 7027 8196 9961 3177 -2396 -2382 8855 4060 -3728 83 1248 7102 -12458 7116 -6053 -1724 -7149 5716 2738 3632 -1779 8765 -1941 7797 -1919 -9465 2253 9278 5996 -5951 -1068 -5174 3720 -919 -4839 4209 1660 4186 -6165 -5444 4789 SS 20250815T125143.8Z 9358.535924 208 1 54.45 2 82.01 78.64 20.37 226.50 0.00 1 0.00 1 0 17 5.832e-01 1.198e-02 2.564e-01 3.514e-03 7.417619e-01 1.903908e-03 8.359651e-03 -6.000000e+00 3.364670e-01 230.56 -2.00 3.36 -2.00 321.49 0.00e+00 3.532826e-03 1.052804e-03 5.480407e-03 -6.000000e+00 1.510550e-02 287.65 -2.00 20.00 -2.00 320.92 0.00e+00 6.725 0.005 302.00 328.00 3 1.6459e+00 7.1112e-03 7.5067e-02 -6.0000e+00 8.4154e-01 1.0985e-01 1.0471e-02 5.1015e-02 -6.0000e+00 9.1262e-01 -2.6009e-01 1.0930e-02 2.5726e-02 -6.0000e+00 5.4330e-01 1.0799e-01 5.0387e-03 6.9713e-03 -6.0000e+00 2.3128e-01 1.3836e-04 4.3972e-04 9.4122e-05 1.3611e-04 -6.0000e+00 1.5691e-02 6.4035e-02 0.0000e+00 12 9 8 11 8 0 7.33 26.43 0.68 0.06404 0.06734 85 9 1 5 0 640.490 34.00 20.00 26.43 28.35 6.0 970.96 -214095 -259516 -248252 -196244 -100124 -263868 -215650 -136603 -182071 -121901 20159 27927 4686 -22825 3866 -87502 -6480 900000 -38933 -36083 7126 -41587 21417 -35473 20213 107515 -52385 268 -34364 69551 -13999 2801 9970 -28777 -17559 87665 -37266 6676 15220 -8254 13604 3835 -11897 21037 8931 9423 20969 1989 -506 1965 10290 7595 1888 9334 10889 819 2606 -1334 -10317 12470 3442 -1390 9501 2420 788 1570 -357 1220 1936 2352 776 3262 3377 -780 -824 -3397 -4192 -807 -1418 -585 1178 -1667 2977 245 2620 2667 2271 -4402 2934 698 52 -2203 -1976 -1066 -949 -1907 614 315 381 -1081 -1363 -1898 -2195 -827 -996 -1075 -941 625 1017 1112 634 495 -433 -1050 -740 -540 -275 -85 -30 482 1573 888 580 1542 -387 -39 185 -440 136 -232 -291 -333 -141 -42 -84 624 824 454 304 -264 -951 -1000 -1933 -4041 -3401 -1467 -343 -4108 -2350 -766 -1758 -683 69 96 16 -121 19 -1253 -46 900000 -449 -416 53 -531 160 -508 194 442 -1041 3 -624 548 -312 62 225 -927 -499 961 -1698 242 615 -481 690 227 -852 1103 545 591 1228 150 -42 182 994 835 242 1189 1432 123 386 -199 -1654 1645 551 -269 1891 554 181 359 -87 325 597 803 282 1147 1117 -245 -232 -921 -1176 -249 -531 -258 590 -952 1728 143 1593 1706 1504 -3124 1868 425 33 -1386 -1176 -715 -747 -1776 647 336 409 -1207 -1372 -1739 -2020 -811 -1037 -1186 -1120 743 1368 1681 1032 754 -703 -1632 -1104 -813 -434 -142 -49 760 2546 1395 884 2242 -555 -54 269 -737 238 -453 -612 -688 -311 -100 -209 1585 1984 1096 753 -615 -2094 -2122 SS 20250815T130739.2Z 9358.546982 213 1 54.08 2 78.79 80.82 22.78 233.99 0.00 1 0.00 1 0 17 2.206e-01 8.086e-03 2.338e-02 1.004e-03 5.814552e-01 5.190047e-04 6.372732e-03 -6.000000e+00 1.267389e-01 230.56 -2.00 3.36 -2.00 320.09 0.00e+00 1.725753e-03 1.817668e-04 1.441309e-03 -6.000000e+00 5.689853e-03 287.65 -2.00 20.00 -2.00 319.36 0.00e+00 4.969 0.002 302.00 328.00 3 1.2199e+00 1.5586e-03 5.2994e-02 -6.0000e+00 3.1649e-01 -2.6264e-02 1.9351e-03 2.9993e-02 -6.0000e+00 3.4273e-01 -6.0603e-02 1.7181e-03 1.5314e-02 -6.0000e+00 2.0426e-01 2.8274e-02 8.7770e-04 4.6843e-03 -6.0000e+00 8.7356e-02 1.0791e-03 5.4715e-04 2.7040e-05 5.4200e-05 -6.0000e+00 5.9345e-03 6.3878e-02 0.0000e+00 11 8 0 10 0 0 6.08 26.45 0.46 0.06388 0.06799 279 30 1 5 0 193.810 34.00 19.97 26.45 29.48 6.0 979.70 -74785 -80515 -81720 -84445 -72364 -73264 -81212 -69106 -55582 -64742 -65627 -52490 -27363 -21292 -9487 -15082 -7822 -26392 -7499 -7077 -13843 -12251 162 -6578 -6787 3 -11936 -7885 -4482 -4436 -5725 -3763 -2397 -9495 -7681 -2967 -8016 -2928 1518 564 665 737 329 2199 893 2985 1681 312 345 2837 1734 2411 2601 2233 2890 1469 657 178 -831 1535 1570 2403 3083 867 371 -1030 -1298 226 625 392 1192 1005 741 -593 -1208 -2567 -2641 -2205 -2076 -1366 -882 -1689 -1180 -610 270 970 1756 1161 1488 883 -2 -743 -1093 -917 -735 134 1073 342 -177 -524 -1273 -1177 -866 -1203 -1072 -794 -544 405 901 1068 740 673 -31 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