File name: Pandora252s1_BoulderCO-NCAR_20250729_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250731T082730.1Z 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_20250729_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: 20250729 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 20250729T165920.2Z 9341.707873 208 1 53.86 2 34.91 118.52 91.34 94.45 0.00 1 0.00 1 0 17 8.795e-03 6.838e-03 1.838e-03 1.315e-03 1.641629e-01 7.045856e-04 1.946827e-03 -6.000000e+00 5.263401e-03 231.19 -2.00 3.45 -2.00 314.77 0.00e+00 3.248554e-04 5.667527e-05 2.796176e-05 -6.000000e+00 2.288988e-04 282.23 -2.00 20.00 -2.00 314.18 0.00e+00 1.219 0.000 302.00 328.00 3 5.8337e+00 1.8137e-03 1.3201e-02 -6.0000e+00 1.3179e-02 4.0091e-03 2.0031e-03 8.3404e-03 -6.0000e+00 1.4245e-02 -6.9482e-03 1.1467e-03 4.0634e-03 -6.0000e+00 8.4589e-03 -1.0071e-03 4.9769e-04 1.1486e-03 -6.0000e+00 3.5699e-03 4.8547e-04 3.5767e-04 3.9773e-05 1.6619e-05 -6.0000e+00 2.5882e-04 5.1713e-02 -2.4571e-05 11 8 0 10 0 0 99.76 26.81 0.30 0.05171 0.05440 17 2 1 5 0 3167.760 35.50 20.00 26.81 30.59 10.8 1030.04 -749 -1384 -1921 -2072 -1569 -165 900 1282 1190 -1738 -1417 238 257 11 1356 -698 640 917 998 1404 1450 1801 618 865 379 83 -1089 55 1017 1067 1092 882 -1575 -2827 -1106 -1592 -973 -18 -1200 -1122 -1028 -714 -637 -635 -241 -994 -463 -951 -105 839 696 1030 1193 768 938 1313 179 385 975 900 1583 1100 1221 264 -655 -121 -62 822 1193 21 -241 63 32 78 -84 -559 -264 326 -525 -1251 -1580 -1955 -1613 -782 -977 -298 -145 -20 -172 266 309 164 1044 785 187 733 500 -71 -279 -351 -504 217 912 -397 -1017 -580 -830 -55 384 -84 -99 39 44 73 832 584 430 201 -422 -319 133 129 54 525 468 433 1337 658 153 -92 -272 -100 373 -61 -21 112 120 -275 -316 -166 -513 -435 900000 -289 -508 -734 -711 -492 -51 302 474 466 -699 -561 98 108 5 679 -344 317 465 518 740 761 943 337 491 224 49 -621 29 537 564 561 480 -903 -1578 -580 -875 -603 -12 -897 -871 -839 -597 -537 -534 -201 -814 -364 -768 -82 665 581 849 1024 681 844 1192 164 348 870 819 1426 1066 1181 259 -641 -114 -55 738 1110 21 -251 66 33 80 -79 -501 -232 284 -469 -1181 -1644 -2072 -1791 -868 -1165 -357 -180 -25 -211 320 339 172 1072 819 200 813 609 -88 -348 -418 -586 250 1057 -473 -1241 -739 -1105 -72 526 -116 -137 54 57 91 1013 695 527 251 -569 -428 178 169 72 660 586 515 1627 793 195 -118 -357 -133 508 -84 -30 160 175 -408 -463 -236 -744 -617 900000 SS 20250729T170402.2Z 9341.711137 211 1 54.82 2 34.13 119.91 90.48 95.20 0.00 1 0.00 1 0 17 8.271e-03 6.470e-03 1.752e-03 1.262e-03 1.638202e-01 6.776213e-04 1.950885e-03 -6.000000e+00 4.948913e-03 231.19 -2.00 3.45 -2.00 314.73 0.00e+00 2.753866e-04 5.400783e-05 2.303155e-05 -6.000000e+00 2.152498e-04 282.23 -2.00 20.00 -2.00 314.14 0.00e+00 1.207 0.000 302.00 328.00 3 5.7844e+00 1.7440e-03 1.3129e-02 -6.0000e+00 1.2392e-02 7.5377e-03 1.9269e-03 8.3368e-03 -6.0000e+00 1.3394e-02 -8.2857e-03 1.1019e-03 4.0643e-03 -6.0000e+00 7.9537e-03 -9.6335e-04 4.7680e-04 1.1391e-03 -6.0000e+00 3.3563e-03 5.1481e-04 1.5234e-04 3.8247e-05 1.6671e-05 -6.0000e+00 2.4338e-04 5.2307e-02 -2.9964e-05 11 8 0 10 0 0 99.64 26.82 0.38 0.05231 0.05345 21 2 1 5 0 2609.910 35.50 19.99 26.82 30.81 10.8 1031.30 -868 -874 -1311 -1785 -1786 -320 796 964 913 -2403 -1154 454 -237 493 -189 -185 114 1014 961 1391 1137 1954 945 376 900 204 -956 482 1253 899 1262 1402 -1278 -2595 -1009 -1195 -694 -146 -906 -1005 -1217 -877 -832 -251 -472 -807 -755 -591 -4 685 408 430 1050 1056 844 1055 216 592 920 846 1317 1233 985 46 -589 -104 212 734 1194 -259 -75 146 -50 -70 23 -322 -248 406 -783 -1151 -1385 -1950 -1688 -822 -746 -381 -118 -68 -85 292 190 78 1235 690 349 490 579 -150 -260 -407 -446 -143 972 -388 -944 -573 -624 29 490 132 -85 -64 23 210 794 618 434 317 -376 -399 79 -19 -31 415 308 484 1100 677 209 13 -264 -147 237 66 -66 53 119 -216 -423 -64 -343 -442 900000 -340 -324 -506 -620 -570 -101 271 362 363 -987 -462 188 -101 232 -90 -92 57 519 504 741 606 1033 520 217 534 122 -551 254 667 481 654 765 -737 -1458 -534 -660 -433 -100 -680 -786 -1004 -740 -709 -212 -396 -665 -599 -479 -3 547 324 359 908 939 764 966 188 537 826 775 1195 1200 959 45 -580 -93 189 662 1115 -256 -78 154 -52 -69 22 -289 -218 354 -703 -1089 -1442 -2072 -1880 -915 -890 -457 -146 -85 -105 351 209 82 1268 721 373 546 705 -187 -325 -486 -519 -166 1126 -463 -1152 -731 -792 38 671 181 -118 -90 30 265 968 736 533 395 -506 -536 106 -25 -42 523 387 576 1275 815 267 16 -346 -195 322 90 -95 76 174 -320 -621 -91 -497 -627 900000 SS 20250729T170938.3Z 9341.715027 214 1 54.19 2 33.21 121.64 89.46 96.10 0.00 1 0.00 1 0 17 8.815e-03 6.789e-03 1.997e-03 1.433e-03 1.625716e-01 7.680650e-04 1.925996e-03 -6.000000e+00 5.275259e-03 231.19 -2.00 3.45 -2.00 314.74 0.00e+00 2.324587e-04 6.199220e-05 1.933839e-05 -6.000000e+00 2.294263e-04 282.23 -2.00 20.00 -2.00 314.18 0.00e+00 1.194 0.000 302.00 328.00 3 6.0102e+00 1.9754e-03 1.2993e-02 -6.0000e+00 1.3209e-02 7.5037e-03 2.1825e-03 8.2442e-03 -6.0000e+00 1.4277e-02 -8.6068e-03 1.2478e-03 4.0158e-03 -6.0000e+00 8.4780e-03 -1.9305e-04 5.4116e-04 1.1192e-03 -6.0000e+00 3.5778e-03 4.1620e-04 2.1282e-04 4.3345e-05 1.6146e-05 -6.0000e+00 2.5941e-04 5.1763e-02 -3.2183e-05 11 9 0 11 8 0 99.70 26.82 0.29 0.05176 0.05336 16 2 1 5 0 3386.680 35.50 20.00 26.82 31.17 10.8 1034.07 -1105 -988 -2108 -1017 -1548 220 590 1887 1422 -1858 -1919 389 -263 192 -132 59 204 997 880 1266 1292 2192 541 686 218 575 -1389 -883 1799 1284 748 1642 -1359 -2913 -584 -1370 -855 -302 -758 -680 -746 -656 -566 -695 -927 -670 -715 -813 -419 800 665 720 1041 986 1143 1304 26 97 1120 1180 1427 1040 1136 148 -621 -348 -61 922 1190 -164 86 214 -110 5 -250 -596 -483 386 -794 -1081 -1513 -1681 -1743 -884 -527 -267 -191 -99 66 318 396 100 1074 899 393 625 597 -158 -192 -371 -361 -91 703 -559 -1223 -485 -679 9 352 148 -233 185 8 216 745 552 204 85 -485 -310 188 49 52 578 443 721 1209 694 61 75 -485 -191 -34 96 -83 117 287 -166 -238 4 -677 -449 900000 -418 -382 -787 -337 -516 72 193 675 541 -729 -743 155 -116 87 -65 30 106 526 476 696 707 1190 307 377 124 327 -768 -485 909 652 400 918 -805 -1685 -316 -778 -508 -197 -578 -536 -620 -559 -486 -597 -790 -558 -573 -628 -337 648 531 605 908 886 980 1132 23 84 1013 1023 1301 1020 1108 146 -614 -313 -55 836 1117 -162 89 227 -114 5 -237 -541 -405 319 -718 -1025 -1582 -1782 -1943 -982 -625 -319 -237 -124 80 382 433 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