File name: Pandora252s1_BoulderCO-NCAR_20250915_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250916T070125.6Z 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_20250915_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: 20250915 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 20250915T131506.8Z 9389.552162 237 1 53.96 2 84.56 90.92 14.66 141.97 0.00 1 0.00 1 0 17 3.269e-01 2.580e-02 1.683e-01 9.032e-03 9.586521e-01 5.028827e-03 1.017340e-02 -6.000000e+00 1.915706e-01 228.26 -2.00 3.45 -2.00 322.03 0.00e+00 -6.928555e-05 2.504063e-03 3.600244e-03 -6.000000e+00 8.674173e-03 279.80 -2.00 20.00 -2.00 321.53 0.00e+00 9.258 0.014 302.00 328.00 3 1.3751e+00 1.8277e-02 9.4173e-02 -6.0000e+00 4.7649e-01 1.4016e+00 2.2389e-02 5.7257e-02 -6.0000e+00 5.1831e-01 -1.7991e+00 1.6556e-02 2.5417e-02 -6.0000e+00 3.0821e-01 7.0350e-01 8.1491e-03 7.5997e-03 -6.0000e+00 1.2921e-01 2.2859e-05 -9.0733e-04 2.3703e-04 1.1430e-04 -6.0000e+00 9.6200e-03 -9.0852e-03 -3.6950e-05 12 9 8 11 32 0 -1.59 26.78 0.60 -0.00909 -0.01590 34 3 1 5 0 1586.900 35.50 20.00 26.78 22.05 10.4 970.47 900000 19034 -29898 -64619 -97682 -79869 -74375 -22904 39515 -56450 -99702 900000 -4209 51649 41521 5149 -5827 51847 17446 18700 88842 -3489 7474 6456 -59413 -7700 -14807 1768 136610 12907 3963 -2833 69586 -7143 76434 21184 49268 12985 -1069 123622 22086 -6133 98116 37241 32390 15518 39120 19704 -8837 20352 31475 29254 39874 65167 47292 47531 25490 23116 23938 6504 151 243 7589 9624 16513 -4454 22913 16267 33266 21171 4997 6361 13780 11031 18627 -15143 -6511 6559 -5847 6085 207 5969 -240 1445 -999 671 1976 4493 6686 919 109 -6556 -3057 1825 -7151 -689 -3279 -1956 1181 -5628 -3360 -2117 3173 -4981 -6820 -3331 -4171 615 -489 -2627 -1569 -480 -1480 -1250 770 -1597 751 -2146 -2474 2811 2232 2547 2388 2107 1458 4003 1419 1768 843 1237 669 901 656 -129 -399 -99 836 1196 -600 -223 -616 -1638 -2179 900000 579 -1388 -3621 -6333 -3900 -3393 -642 601 -2214 -6065 900000 -131 1116 1163 231 -308 1577 740 748 1636 -151 287 258 -4661 -351 -676 62 1203 424 168 -150 1950 -429 2019 933 1735 755 -84 3157 1672 -632 3542 2394 2110 1175 2342 1475 -926 1720 2633 2756 3651 4935 4456 4562 3030 2687 2571 790 20 35 1149 1593 2675 -890 3551 2879 5565 4492 1333 1691 3240 2419 3346 -3413 -1301 1236 -1462 1629 69 2165 -102 640 -479 332 999 2235 3185 441 50 -3060 -1400 877 -4408 -475 -2491 -1685 1065 -5397 -2918 -1620 2330 -3991 -5366 -2685 -3636 563 -518 -3295 -2206 -720 -2301 -1917 1125 -2357 1110 -3429 -3801 4509 3478 3754 3387 2911 1970 5143 1888 2589 1457 2261 1378 2015 1585 -312 -1037 -267 2270 3240 -1614 -563 -1438 -3887 -5104 SS 20250915T132906.3Z 9389.561878 240 1 54.78 2 81.89 93.18 13.26 153.04 0.00 1 0.00 1 0 17 5.212e-01 1.056e-02 6.223e-02 1.788e-03 7.690273e-01 9.636652e-04 8.492513e-03 -6.000000e+00 3.053258e-01 228.25 -2.00 3.45 -2.00 320.90 0.00e+00 4.814387e-03 4.257783e-04 1.989692e-03 -6.000000e+00 1.334432e-02 279.80 -2.00 20.00 -2.00 320.34 0.00e+00 6.652 0.005 302.00 328.00 3 1.2605e+00 3.0509e-03 6.8003e-02 -6.0000e+00 7.5952e-01 2.1985e-01 4.0558e-03 4.0372e-02 -6.0000e+00 8.2585e-01 -2.9914e-01 4.0777e-03 2.2503e-02 -6.0000e+00 4.9115e-01 1.1366e-01 1.9745e-03 8.9171e-03 -6.0000e+00 2.0420e-01 2.8029e-04 -5.6145e-04 4.7761e-05 1.1708e-04 -6.0000e+00 1.5257e-02 -9.3662e-03 -3.9598e-05 12 8 8 10 0 0 -3.78 26.77 0.44 -0.00937 -0.01359 150 15 1 5 0 365.140 35.25 19.99 26.77 23.05 10.4 977.98 -181823 -149117 -164898 -146271 -225959 -170556 -171879 -149499 -69838 -172320 -146083 -94494 -137486 -117852 -47703 -69172 -58704 -24459 -61137 -51548 -7958 -51727 -47864 -32146 -56020 -28384 -45403 -53046 -18420 -26067 -29039 -10698 -11651 -18672 -5150 -10832 5683 2289 -2374 10447 7292 -504 10199 3738 4789 9264 1683 6088 1996 4354 5758 8208 6054 6684 5964 4214 4426 2113 5370 37 1508 6045 5132 4517 3049 1691 1957 1187 2674 2618 1739 1423 751 471 -684 -3330 -3674 -2150 -2464 -1371 -801 -907 -1902 -912 -948 -154 -178 769 599 487 211 -671 -580 -1090 -448 -123 490 193 -331 -570 -900 -1026 224 -303 -1759 -1634 -852 -399 366 357 235 -8 18 -269 -260 888 628 206 -235 126 394 728 539 642 681 161 827 679 81 13 -82 -253 85 -17 -418 -102 404 197 -239 -153 -168 -153 -454 -1816 -1253 -1725 -1229 -3940 -1703 -2068 -1616 -378 -2795 -1987 -923 -2709 -2528 -649 -1411 -1239 -409 -1599 -1285 -130 -1326 -1244 -774 -1837 -738 -1409 -1758 -447 -777 -1099 -410 -520 -941 -222 -502 250 125 -166 756 610 -49 939 377 489 934 190 695 255 597 878 1374 1144 1365 1183 887 947 457 1203 8 334 1435 1411 1401 1009 567 664 432 1081 1104 804 679 351 205 -298 -1355 -1447 -885 -1080 -711 -485 -578 -1340 -679 -754 -128 -144 628 484 406 165 -504 -433 -879 -382 -123 529 223 -410 -701 -1029 -1127 227 -313 -1960 -1925 -995 -503 482 533 366 -13 28 -433 -401 1322 956 331 -376 205 658 1159 827 951 1030 237 1205 1012 131 23 -157 -496 177 -37 -906 -231 924 454 -545 -346 -356 -320 -941 SS 20250915T134517.4Z 9389.573118 245 1 54.66 2 78.80 95.83 12.27 168.18 0.00 1 0.00 1 0 17 2.171e-01 8.346e-03 1.095e-02 7.055e-04 6.025168e-01 3.669199e-04 6.757850e-03 -6.000000e+00 1.271655e-01 228.25 -2.00 3.45 -2.00 319.64 0.00e+00 2.585684e-03 1.073795e-04 6.679563e-04 -6.000000e+00 5.557360e-03 279.79 -2.00 20.00 -2.00 319.00 0.00e+00 4.977 0.002 302.00 328.00 3 1.0564e+00 1.0427e-03 5.1303e-02 -6.0000e+00 3.1634e-01 7.4461e-02 1.2357e-03 3.0566e-02 -6.0000e+00 3.4395e-01 -1.1548e-01 1.0157e-03 1.5518e-02 -6.0000e+00 2.0455e-01 4.2496e-02 5.2753e-04 5.2281e-03 -6.0000e+00 8.5057e-02 1.5341e-03 -4.5079e-04 1.9821e-05 5.9391e-05 -6.0000e+00 6.3537e-03 -9.7601e-03 -2.7019e-05 11 8 0 10 0 0 15.46 26.75 0.34 -0.00976 -0.01315 381 38 1 5 0 143.440 35.25 20.00 26.75 24.71 10.5 988.68 -74059 -67314 -67932 -77139 -78490 -78282 -78210 -63510 -58226 -70645 -66433 -51897 -40497 -34862 -21614 -17460 -14943 -8223 -9959 -10446 -6479 -13109 -11804 -10542 -11378 -8953 -12188 -12506 -11108 -8454 -6714 -2413 -1061 -3754 -3748 -4553 -3170 -477 165 1417 764 1386 2152 1955 2554 3039 1970 2162 2021 2573 3320 3140 3554 3034 2580 2076 1704 535 1067 534 1580 2489 2464 2060 1092 593 480 494 1414 839 402 256 -144 -225 -917 -1223 -1667 -1724 -1410 -1594 -1422 -1782 -2226 -1406 -1001 -619 -164 220 159 225 480 23 18 100 -42 87 461 189 -300 -551 -708 -594 411 -148 -1402 -1049 -642 -366 306 325 188 38 83 182 393 723 645 416 57 -341 3 556 374 434 462 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