File name: Pandora252s1_BoulderCO-NCAR_20251009_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20251010T065427.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Ivan Ortega Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 252 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora252_OF_v3d20221123.txt Instrument calibration file used: Pandora252s1_CF_v3d20230118.txt Level 1 file used: Pandora252s1_BoulderCO-NCAR_20251009_L1_smca1c3d20230118p1-8.txt Full location name: National Center for Atmospheric Research Short location name: BoulderCO-NCAR Country of location: United States Location latitude [deg]: 40.0375 Location longitude [deg]: -105.2420 Location altitude [m]: 1616 Local noon date: 20251009 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: Updated OoB with correct parameters based on session 2 First and last pixel inside fitting window: 192 334 Nominal wavelengths inside fitting window [nm]: 305.0965 305.2374 305.3783 305.5193 305.6602 305.8010 305.9419 306.0828 306.2237 306.3645 306.5053 306.6462 306.7870 306.9278 307.0686 307.2094 307.3501 307.4909 307.6316 307.7724 307.9131 308.0538 308.1945 308.3352 308.4759 308.6166 308.7572 308.8979 309.0385 309.1792 309.3198 309.4604 309.6010 309.7416 309.8821 310.0227 310.1633 310.3038 310.4443 310.5848 310.7253 310.8658 311.0063 311.1468 311.2873 311.4277 311.5682 311.7086 311.8490 311.9894 312.1298 312.2702 312.4106 312.5509 312.6913 312.8316 312.9719 313.1123 313.2526 313.3929 313.5332 313.6734 313.8137 313.9539 314.0942 314.2344 314.3746 314.5148 314.6550 314.7952 314.9354 315.0755 315.2157 315.3558 315.4960 315.6361 315.7762 315.9163 316.0564 316.1964 316.3365 316.4765 316.6166 316.7566 316.8966 317.0366 317.1766 317.3166 317.4566 317.5965 317.7365 317.8764 318.0164 318.1563 318.2962 318.4361 318.5759 318.7158 318.8557 318.9955 319.1353 319.2752 319.4150 319.5548 319.6946 319.8344 319.9741 320.1139 320.2536 320.3934 320.5331 320.6728 320.8125 320.9522 321.0918 321.2315 321.3712 321.5108 321.6504 321.7901 321.9297 322.0693 322.2088 322.3484 322.4880 322.6275 322.7671 322.9066 323.0461 323.1856 323.3251 323.4646 323.6041 323.7435 323.8830 324.0224 324.1618 324.3012 324.4406 324.5800 324.7194 324.8588 324.9981 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20251009T133844.1Z 9413.568566 249 1 54.24 2 84.62 103.15 62.85 276.45 0.00 1 0.00 1 0 17 4.459e-01 2.462e-02 2.577e-01 8.095e-03 8.856738e-01 4.528201e-03 9.617272e-03 -6.000000e+00 2.612181e-01 225.80 -2.00 3.45 -2.00 322.02 0.00e+00 1.057493e-02 2.462448e-03 2.307298e-03 -6.000000e+00 1.156071e-02 276.64 -2.00 20.00 -2.00 321.57 0.00e+00 9.345 0.014 302.00 328.00 3 1.3403e+00 1.6450e-02 9.0260e-02 -6.0000e+00 6.4944e-01 1.0545e+00 2.1040e-02 4.7815e-02 -6.0000e+00 7.0973e-01 -1.4039e+00 1.8723e-02 2.4359e-02 -6.0000e+00 4.2028e-01 5.6162e-01 8.9063e-03 1.2718e-02 -6.0000e+00 1.7378e-01 2.5854e-05 -7.5113e-04 2.2360e-04 2.2756e-04 -6.0000e+00 1.3096e-02 -9.2122e-03 -2.8941e-05 12 9 8 11 8 0 45.08 26.76 0.85 -0.00921 -0.01486 38 4 1 5 0 1427.340 35.25 20.01 26.76 17.48 10.2 938.41 -39329 -82478 -136932 -56066 -119247 118273 -102552 -11039 900000 -116112 -126474 71833 -64079 138061 900000 96877 -60948 900000 -47451 6808 900000 41947 -56587 23132 -55904 60373 -44284 -9420 133804 14130 37835 18623 56806 -5013 68036 -6414 53686 32741 -2079 145919 4824 23057 93276 20262 50316 41519 84554 33718 -2301 20261 56569 36341 27656 63016 43972 83557 67771 28437 46889 2656 19475 25167 11821 11423 23148 1708 15419 20160 17757 17220 5071 25 13406 12448 7741 -14329 -10124 777 -7926 -2847 1345 7771 4469 -371 6444 66 -1247 2897 3439 -249 1213 -5972 -991 -8418 -3451 -353 -1472 539 -1409 -3282 -3825 -4168 1905 653 -5107 -6089 -3493 -436 -557 -976 -853 -1443 -1945 -726 -46 -516 -357 487 -1283 2974 2573 3405 1632 2267 1065 808 902 -139 992 1222 684 1366 1643 -348 -2072 140 824 437 -633 598 -686 -1607 -1427 -762 -2662 -7463 -1206 -4105 933 -2574 -111 900000 -3247 -3991 567 -1608 1089 900000 903 -3016 900000 -2212 181 900000 692 -2435 448 -2365 779 -1556 -223 1055 304 787 561 1434 -216 1449 -278 1355 1162 -121 2187 320 1328 2722 1231 2262 2063 2801 1942 -201 1534 3302 2867 2574 4374 3816 4943 4651 2782 3625 312 2012 2740 1688 1838 3488 319 2554 3387 3418 3749 1336 7 3151 2700 1569 -3267 -2148 159 -2088 -862 462 2857 1858 -172 2958 34 -677 1531 1780 -128 576 -2916 -464 -4655 -2123 -252 -1140 470 -1354 -3194 -3470 -3392 1482 519 -4150 -5306 -3181 -423 -617 -1251 -1230 -2055 -2835 -1027 -69 -760 -539 702 -1977 4452 3753 5117 2403 3222 1487 1103 1240 -213 1599 2261 1419 3048 3623 -842 -5439 373 2227 1191 -1707 1505 -1621 -3580 -3123 SS 20251009T135248.3Z 9413.578337 252 1 54.58 2 82.02 105.49 65.40 278.50 0.00 1 0.00 1 0 17 4.665e-01 1.052e-02 5.764e-02 1.810e-03 7.108587e-01 9.581144e-04 7.916069e-03 -6.000000e+00 2.707190e-01 225.80 -2.00 3.45 -2.00 320.75 0.00e+00 4.560316e-03 3.970409e-04 2.056910e-03 -6.000000e+00 1.178762e-02 276.64 -2.00 20.00 -2.00 320.22 0.00e+00 6.747 0.005 302.00 328.00 3 1.3125e+00 2.9363e-03 6.6446e-02 -6.0000e+00 6.7030e-01 1.6363e-01 3.8365e-03 3.7018e-02 -6.0000e+00 7.3056e-01 -2.3421e-01 3.8591e-03 2.1055e-02 -6.0000e+00 4.3451e-01 8.7420e-02 1.8985e-03 8.3978e-03 -6.0000e+00 1.8103e-01 2.7361e-04 -5.4327e-04 4.9815e-05 1.0976e-04 -6.0000e+00 1.3644e-02 -8.8048e-03 -3.8857e-05 12 9 8 11 8 0 36.55 26.77 0.40 -0.00880 -0.01289 142 14 1 5 0 384.330 35.25 20.00 26.77 18.47 10.2 946.04 -184758 -99263 -160243 -78500 -193119 -134274 -191239 -142018 -84866 -154166 -151904 -90593 -106499 -99218 -50799 -47319 -48551 -22601 -53918 -54222 28096 -19435 -38152 -23974 -51962 -24068 -34182 -33409 -25807 -915 -23761 -7809 -4024 -5495 -4279 -7307 7575 -6433 -2353 8101 3885 786 5592 5119 5694 10896 5703 3924 2435 5835 6342 7593 5016 8974 4656 1579 3844 990 4418 1730 867 5105 3212 3237 2361 1433 984 1899 3256 1727 1391 951 1196 -184 -801 -2979 -3337 -2293 -2381 -1197 -1274 -662 -1812 -536 -1117 -213 229 593 689 208 78 -619 -1031 -662 -600 -167 527 25 -521 -644 -790 -1067 331 -347 -1522 -1614 -636 -593 481 234 201 138 -114 -189 8 744 688 324 147 232 277 629 702 665 588 62 604 913 96 -156 -208 -37 24 -110 -336 -222 340 90 -152 -114 -71 -441 -174 -2519 -669 -2108 -485 -3191 -1351 -3678 -1880 -704 -2748 -2868 -1103 -1973 -2241 -896 -969 -1148 -459 -1618 -1713 397 -446 -1111 -656 -2017 -739 -1170 -1120 -824 -26 -1019 -345 -196 -285 -214 -384 384 -450 -192 702 393 88 629 594 672 1258 718 528 354 896 1087 1440 978 1823 1045 381 923 242 1018 408 217 1372 1005 1128 868 528 367 743 1412 793 695 492 602 -88 -349 -1315 -1422 -1018 -1116 -659 -821 -445 -1344 -419 -869 -174 196 514 589 171 65 -490 -810 -553 -530 -160 582 29 -659 -806 -919 -1198 344 -370 -1748 -1841 -765 -772 649 336 317 217 -179 -304 13 1102 1040 516 234 377 441 1011 1087 996 900 92 888 1361 155 -284 -395 -71 49 -229 -744 -490 763 205 -342 -255 -149 -920 -359 SS 20251009T141006.4Z 9413.590352 257 1 54.55 2 78.85 108.44 68.52 280.98 0.00 1 0.00 1 0 25 1.605e-01 7.729e-03 8.924e-03 6.784e-04 5.559325e-01 3.488004e-04 6.279637e-03 -6.000000e+00 9.317509e-02 225.80 -2.00 3.45 -2.00 319.41 0.00e+00 2.307557e-03 9.398088e-05 5.842368e-04 -6.000000e+00 4.056968e-03 276.64 -2.00 20.00 -2.00 318.81 0.00e+00 4.998 0.002 302.00 328.00 3 1.0520e+00 9.7241e-04 4.9657e-02 -6.0000e+00 2.3070e-01 5.3649e-02 1.1362e-03 2.7863e-02 -6.0000e+00 2.5144e-01 -9.1204e-02 9.0539e-04 1.4152e-02 -6.0000e+00 1.4955e-01 3.2417e-02 4.7471e-04 4.7220e-03 -6.0000e+00 6.2307e-02 1.6417e-03 -4.2327e-04 1.9530e-05 5.4138e-05 -6.0000e+00 4.6959e-03 -8.9056e-03 -3.8845e-05 11 8 0 10 0 0 8.94 26.73 0.37 -0.00891 -0.01209 388 38 1 5 0 140.580 35.25 20.00 26.73 20.93 10.3 963.30 -53315 -50997 -52439 -49994 -65630 -56796 -57810 -50984 -41135 -52570 -45067 -37654 -33142 -25121 -15962 -13310 -8237 -5234 -5941 -7862 -3302 -7234 -4395 -6874 -7717 -5924 -8446 -8878 -7168 -5432 -3848 -978 -999 -3920 -2543 -3588 -1698 -173 347 881 1000 747 1864 1378 2001 2172 1393 1259 1120 2026 2372 2515 2873 2863 2154 1617 1049 449 645 600 1526 2185 2454 1827 1034 821 317 450 1335 601 436 121 -180 -582 -574 -1062 -1303 -1561 -1349 -1263 -1431 -1814 -2242 -1232 -1124 -674 -135 155 171 290 633 181 72 195 -51 110 554 196 -400 -556 -737 -676 335 -108 -1321 -1156 -641 -448 350 361 199 28 103 79 373 798 699 629 117 -295 31 399 402 374 443 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