File name: Pandora252s1_BoulderCO-NCAR_20250826_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250827T070810.7Z 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_20250826_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: 20250826 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 20250826T130912.3Z 9369.548060 60 1 54.29 2 82.23 83.18 119.93 72.76 0.00 1 0.00 1 0 17 5.489e-01 1.502e-02 2.338e-01 5.191e-03 8.009641e-01 2.972732e-03 8.666479e-03 -6.000000e+00 3.304020e-01 229.79 -2.00 3.45 -2.00 321.43 0.00e+00 1.243435e-03 1.514224e-03 8.622648e-04 -6.000000e+00 1.527217e-02 281.54 -2.00 20.00 -2.00 320.92 0.00e+00 6.903 0.006 302.00 328.00 3 2.7917e+00 1.0362e-02 7.1390e-02 -6.0000e+00 8.3043e-01 3.1091e-01 1.4793e-02 4.3783e-02 -6.0000e+00 9.0239e-01 -4.5004e-01 1.5313e-02 2.3311e-02 -6.0000e+00 5.3134e-01 1.7687e-01 7.1344e-03 7.4675e-03 -6.0000e+00 2.2291e-01 4.7718e-05 -1.5879e-03 1.4691e-04 9.9329e-05 -6.0000e+00 1.6319e-02 5.6341e-02 -2.1499e-04 12 9 8 11 32 0 1.47 26.91 0.50 0.05634 0.04441 32 3 1 5 0 1696.310 35.50 20.00 26.91 20.34 10.5 960.47 -246937 -50419 -65726 -172901 -229885 -149877 -172188 900000 900000 -212815 -220627 900000 -88491 -110112 900000 -74304 -60071 900000 -66914 79282 900000 3522 -78251 -13760 -53206 -72708 -92526 17030 101052 24085 13905 -13229 -8168 -35874 53136 -21729 19561 7041 -1363 92312 -6321 1398 22094 4666 4819 21401 1135 2572 -12703 15457 23815 9976 585 22220 10629 17114 5273 4231 17573 -2119 9010 7277 5758 4146 3628 -4226 1131 2932 13350 2742 2773 -1731 2076 6002 2196 -9872 -3745 -2244 -4672 599 1386 1904 -1165 928 -348 1006 -874 2255 1984 -334 -215 -3757 -31 -3106 -1538 133 571 -481 -150 -1500 -942 -2457 -1161 847 -1630 -2256 -1393 -99 632 -369 -605 -620 -21 139 884 355 918 -293 -1532 1605 996 1321 620 544 753 1065 393 658 18 75 -330 302 913 -278 -979 272 613 34 -525 39 -627 -520 900000 -4426 -255 -332 -1510 -3381 -1033 -1662 900000 900000 -4108 -5172 900000 -895 -1771 900000 -1195 -939 900000 -1421 401 900000 39 -2136 -216 -1318 -2242 -3415 207 562 341 267 -395 -256 -1487 887 -813 564 281 -72 2194 -441 95 1262 321 336 1298 88 208 -1297 1328 2131 1145 81 2674 1515 2371 826 652 2301 -341 1398 1306 1197 956 858 -1083 285 798 3746 957 1025 -670 736 1872 639 -3009 -1081 -708 -1793 260 630 965 -657 547 -221 665 -607 1525 1308 -213 -129 -2261 -18 -2138 -1217 121 551 -521 -167 -1628 -925 -2419 -1091 816 -1571 -2317 -1526 -117 847 -520 -930 -986 -34 209 1274 512 1365 -464 -2553 2581 1554 1964 896 761 1099 1513 580 1002 32 137 -659 641 1919 -632 -2372 671 1528 86 -1277 88 -1338 -1136 900000 SS 20250826T132715.4Z 9369.560594 65 1 54.70 2 78.79 86.03 116.77 76.11 0.00 1 0.00 1 0 17 2.325e-01 7.954e-03 2.129e-02 1.185e-03 6.029092e-01 6.316369e-04 6.834302e-03 -6.000000e+00 1.382667e-01 229.79 -2.00 3.45 -2.00 319.83 0.00e+00 1.997246e-03 1.964902e-04 5.885706e-04 -6.000000e+00 6.034346e-03 281.54 -2.00 20.00 -2.00 319.19 0.00e+00 4.972 0.002 302.00 328.00 3 2.0341e+00 1.8160e-03 5.1714e-02 -6.0000e+00 3.4511e-01 5.1947e-02 2.1806e-03 3.1223e-02 -6.0000e+00 3.7358e-01 -1.1355e-01 1.8654e-03 1.5749e-02 -6.0000e+00 2.2201e-01 4.1472e-02 9.6395e-04 4.9413e-03 -6.0000e+00 9.3806e-02 5.8258e-04 -1.0035e-03 3.3764e-05 5.8584e-05 -6.0000e+00 6.8419e-03 5.6524e-02 -1.6034e-04 11 8 0 10 0 0 39.78 26.90 0.43 0.05652 0.04898 164 16 1 5 0 333.490 35.50 20.00 26.90 22.76 10.5 977.74 -96490 -57191 -87446 -83019 -97464 -75602 -77943 -76931 -40031 -69419 -68067 -33949 -45325 -36732 -16977 -18538 -16067 -8861 -16237 -11670 -3205 -14235 -14420 -10079 -14258 -8729 -20482 -12659 -6452 -4976 -4648 -934 -3338 -5256 -2894 -4361 -1119 603 -484 2573 1096 1510 2615 2199 3076 1553 963 1664 1702 2401 3052 3371 2977 2623 2505 1795 1093 -444 1459 579 1102 2790 2446 989 1122 805 235 1177 2097 948 333 16 -278 -660 -767 -1612 -1773 -969 -1552 -1455 -1203 -1920 -1861 -879 -640 -279 110 383 228 540 422 0 -90 216 -110 439 406 -331 -407 -340 -735 -103 333 -726 -1542 -1072 -612 -24 598 123 -15 186 142 202 546 721 512 274 -212 -308 162 419 269 384 355 535 1316 592 -69 75 -297 -233 201 -71 -338 -98 128 -187 -328 -48 -147 -192 900000 -1817 -799 -1667 -1419 -1847 -1205 -1432 -1591 -629 -1556 -1651 -706 -1335 -1243 -569 -722 -676 -378 -792 -565 -144 -738 -806 -587 -922 -550 -1429 -800 -398 -344 -379 -85 -341 -546 -289 -471 -136 88 -78 461 217 315 558 478 676 353 226 402 435 665 936 1041 1003 947 948 707 437 -177 561 229 467 1204 1184 518 586 412 123 655 1218 622 217 11 -189 -418 -440 -925 -1002 -585 -1014 -1036 -977 -1629 -1692 -794 -615 -282 109 380 233 519 379 0 -82 201 -111 505 504 -431 -543 -433 -906 -116 387 -851 -1940 -1347 -815 -32 857 187 -25 304 226 303 815 1063 783 425 -345 -507 259 645 418 574 510 777 1928 911 -114 131 -533 -421 383 -138 -676 -201 266 -393 -671 -96 -291 -365 900000 SS 20250826T133347.9Z 9369.565137 68 1 54.71 2 77.55 87.07 115.61 77.29 0.00 1 0.00 1 0 17 1.447e-01 7.238e-03 1.284e-02 9.303e-04 5.532092e-01 4.916789e-04 6.340734e-03 -6.000000e+00 8.600488e-02 229.79 -2.00 3.45 -2.00 319.39 0.00e+00 2.336937e-03 1.322743e-04 4.830266e-04 -6.000000e+00 3.753812e-03 281.53 -2.00 20.00 -2.00 318.72 0.00e+00 4.510 0.002 302.00 328.00 3 1.9987e+00 1.3845e-03 4.7088e-02 -6.0000e+00 2.1466e-01 3.4936e-02 1.6187e-03 2.8548e-02 -6.0000e+00 2.3238e-01 -8.4252e-02 1.2827e-03 1.4304e-02 -6.0000e+00 1.3810e-01 2.9036e-02 6.7147e-04 4.5760e-03 -6.0000e+00 5.8345e-02 9.1438e-04 -1.1118e-03 2.6999e-05 5.3587e-05 -6.0000e+00 4.2564e-03 5.7320e-02 -1.6287e-04 11 8 0 10 0 0 5.14 26.91 0.31 0.05732 0.04896 211 21 1 5 0 259.260 35.50 20.00 26.91 23.73 10.4 982.79 -53898 -46590 -37790 -52094 -64492 -56379 -57413 -42765 -27707 -40341 -43343 -21307 -22730 -21806 -8414 -8550 -5836 -5247 -4655 -8938 -1915 -7970 -4771 -5825 -7393 -5924 -7605 -10677 -2920 -831 -3307 -39 -2082 -4207 -2333 -4233 -761 -71 155 646 834 459 2045 1151 1251 1364 877 664 764 1541 2305 2296 2460 2344 1473 1269 210 342 604 519 1922 2245 2323 762 1076 712 379 823 1381 318 452 -28 -103 -661 -1122 -1255 -1161 -1003 -1320 -1367 -1602 -1962 -1550 -996 -741 -361 48 295 214 366 469 101 343 263 -43 470 451 -130 -496 -524 -818 -42 614 -951 -1470 -889 -638 17 618 235 52 133 106 243 685 958 548 363 -352 -467 24 299 261 539 281 458 1331 636 -80 -50 -240 -191 105 -40 -350 -147 219 -252 -285 1 -255 -105 900000 -1134 -997 -744 -1106 -1480 -1243 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