File name: Pandora252s1_BoulderCO-NCAR_20251105_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20251106T121449.1Z 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_20251105_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: 20251105 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 20251105T140930.2Z 9440.589933 265 1 55.29 2 84.79 115.79 93.85 299.39 0.00 1 0.00 1 0 17 5.088e-01 2.057e-02 2.865e-01 7.995e-03 8.412856e-01 4.487759e-03 8.683638e-03 -6.000000e+00 2.992983e-01 223.46 -2.00 3.45 -2.00 321.97 0.00e+00 1.030886e-02 2.419435e-03 3.123061e-03 -6.000000e+00 1.324255e-02 272.99 -2.00 20.00 -2.00 321.54 0.00e+00 9.584 0.015 302.00 328.00 3 1.3027e+00 1.5975e-02 9.4648e-02 -6.0000e+00 7.4198e-01 7.8780e-01 2.1953e-02 6.0957e-02 -6.0000e+00 8.1326e-01 -1.0527e+00 2.2585e-02 2.3433e-02 -6.0000e+00 4.7768e-01 4.2353e-01 1.0580e-02 1.4137e-02 -6.0000e+00 1.9667e-01 2.5337e-05 -5.7863e-04 2.3058e-04 1.5432e-04 -6.0000e+00 1.5184e-02 -7.6062e-03 -6.0494e-05 12 8 8 10 0 0 27.27 26.75 0.92 -0.00761 -0.01195 38 4 1 5 0 1454.750 35.25 19.99 26.75 10.58 10.0 892.01 -97509 -132793 -179280 -119404 -181210 900000 -31655 900000 900000 -168039 -91655 41390 -96578 -92995 900000 1614 -78149 900000 -18556 -25225 900000 900000 -59424 -14583 -78948 132546 -16804 11651 31912 39506 66640 -8761 13524 -10365 82346 14297 238832 23154 -48258 191050 15614 3512 89049 22706 15035 42840 17876 -4415 3102 38083 30285 36315 -17178 21600 39302 31570 19470 16382 53169 9458 7944 10899 6523 13526 10438 9258 16165 6999 20668 14364 2536 8651 2601 14075 13410 -14982 -11482 6088 -1779 1769 8760 4232 -3408 3042 -12 -787 -2611 2405 3137 828 -2150 -7041 -843 -1599 -1804 2581 -303 -235 -1687 -3503 -1576 -2031 1466 2109 -1951 -1902 -3700 -1774 -28 -289 -1854 -1102 -2291 -740 408 -506 223 -851 -1397 1469 2734 1445 2285 1865 1161 2042 485 -1499 332 584 1396 611 1727 88 -1154 -361 620 606 -570 384 -485 -1496 -1151 -1311 -2820 -6092 -2029 -5003 900000 -246 900000 900000 -3925 -1038 322 -1778 -2172 900000 22 -2600 900000 -381 -554 900000 900000 -1683 -268 -2794 1032 -309 157 361 475 755 -254 354 -387 1154 390 1860 721 -3607 1488 766 205 2288 1149 831 1835 1016 -330 229 2165 2075 2602 -2287 2086 3305 2925 2032 1709 3685 1002 897 1341 965 2096 1756 1579 2618 1324 3830 3199 683 2230 685 3036 2610 -3512 -2530 1213 -452 524 2851 1644 -1563 1393 -6 -420 -1478 1317 1680 434 -1091 -3591 -407 -850 -1121 1827 -236 -211 -1647 -3452 -1412 -1638 1060 1688 -1573 -1628 -3457 -1785 -31 -373 -2722 -1568 -3344 -1041 598 -737 331 -1234 -2137 2214 3958 2207 3337 2657 1616 2747 667 -2313 534 1075 2826 1346 3719 208 -2926 -947 1640 1612 -1503 951 -1125 -3291 -2496 SS 20251105T142317.2Z 9440.599504 268 1 54.52 2 82.44 118.15 96.00 301.64 0.00 1 0.00 1 0 17 4.071e-01 8.632e-03 5.749e-02 1.836e-03 6.831703e-01 9.639064e-04 7.520541e-03 -6.000000e+00 2.341234e-01 223.45 -2.00 3.45 -2.00 320.71 0.00e+00 4.807804e-03 3.869514e-04 9.574473e-04 -6.000000e+00 1.013518e-02 272.99 -2.00 20.00 -2.00 320.23 0.00e+00 7.080 0.006 302.00 328.00 3 1.1476e+00 2.9125e-03 6.7454e-02 -6.0000e+00 5.7733e-01 1.5410e-01 3.7736e-03 3.4895e-02 -6.0000e+00 6.3070e-01 -1.9990e-01 3.8796e-03 1.9338e-02 -6.0000e+00 3.7498e-01 7.3608e-02 1.9304e-03 8.3599e-03 -6.0000e+00 1.5646e-01 2.6181e-04 -6.6698e-04 5.1440e-05 9.7026e-05 -6.0000e+00 1.1899e-02 -8.1602e-03 -5.5664e-05 11 8 0 10 0 0 37.18 26.75 0.43 -0.00816 -0.01317 141 14 1 5 0 386.630 35.50 20.00 26.75 12.17 10.1 904.39 -172151 -110984 -177315 -106523 -148287 -105299 -138120 -149591 -75572 -157534 -92222 -71830 -67969 -60190 -26369 -44290 -41665 -10152 -32139 -33989 -5551 -29887 -27518 -15213 -38255 -17682 -31022 -25456 -22801 -17519 -8103 -8946 -6300 -3255 -11729 -7053 189 1542 -5932 8447 -523 3273 5962 2722 4029 2781 2232 1254 -241 3683 3876 5511 3982 7340 3418 2755 4102 1300 958 -862 852 4096 3741 2747 3309 1242 1191 620 2374 1614 1757 429 638 -3 -935 -2075 -2238 -2746 -1860 -802 -1415 -1504 -1647 -717 -1239 -704 457 477 218 96 60 -130 -685 -420 -645 155 505 290 31 -375 -463 -685 154 -454 -1338 -1262 -789 -269 562 507 386 249 62 -143 -164 575 495 244 -230 -386 51 624 608 401 510 -31 643 922 -101 -37 -160 -202 -118 -23 -200 -234 339 112 -219 59 -126 -125 -291 -2269 -921 -3030 -953 -1885 -867 -1706 -2330 -622 -3158 -1040 -784 -925 -991 -392 -943 -985 -194 -828 -937 -117 -813 -768 -406 -1376 -541 -1094 -838 -751 -615 -313 -420 -329 -173 -663 -388 11 104 -525 761 -58 373 696 338 505 363 303 180 -37 598 703 1100 807 1556 797 672 1006 324 234 -215 220 1143 1195 986 1231 467 450 249 1051 750 885 225 326 -1 -414 -921 -955 -1237 -874 -442 -917 -1021 -1221 -561 -1041 -579 390 415 188 79 50 -103 -536 -349 -567 157 553 337 38 -461 -530 -757 159 -479 -1520 -1517 -942 -346 749 759 598 405 101 -225 -246 881 731 378 -378 -649 84 983 924 626 766 -45 927 1424 -169 -65 -294 -397 -232 -48 -429 -522 770 258 -499 128 -269 -253 -585 SS 20251105T143414.6Z 9440.607114 271 1 54.62 2 80.61 120.06 97.66 303.48 0.00 1 0.00 1 0 17 2.185e-01 7.678e-03 1.654e-02 9.451e-04 5.866963e-01 4.846823e-04 6.579602e-03 -6.000000e+00 1.256792e-01 223.45 -2.00 3.45 -2.00 319.81 0.00e+00 2.944805e-03 1.463981e-04 4.198380e-04 -6.000000e+00 5.440173e-03 272.99 -2.00 20.00 -2.00 319.29 0.00e+00 5.847 0.003 302.00 328.00 3 1.0060e+00 1.3661e-03 5.6039e-02 -6.0000e+00 3.0992e-01 8.1333e-02 1.6289e-03 2.9373e-02 -6.0000e+00 3.3856e-01 -1.1266e-01 1.4351e-03 1.5126e-02 -6.0000e+00 2.0129e-01 4.0019e-02 7.4970e-04 5.5677e-03 -6.0000e+00 8.3995e-02 8.7283e-04 -5.6113e-04 2.7011e-05 6.1641e-05 -6.0000e+00 6.3867e-03 -8.4593e-03 -4.3276e-05 11 8 0 10 0 0 5.28 26.75 0.39 -0.00846 -0.01268 282 28 1 5 0 193.670 35.25 19.99 26.75 13.89 10.0 914.96 -85957 -53372 -82578 -70323 -88339 -72690 -77504 -73059 -54766 -62026 -64186 -35193 -44156 -39728 -18708 -17274 -11918 -8041 -11490 -13472 -8605 -12915 -14558 -8949 -12686 -9217 -12083 -13210 -9828 -9140 -8981 -2762 -3201 -4482 -2980 -5307 -2319 1205 172 2484 1096 1235 2636 2674 2472 2795 1701 1780 1321 2899 2802 3488 2463 3058 2157 1568 1470 710 900 71 930 2226 2522 1881 1155 850 91 385 1680 692 420 181 79 -509 -895 -1561 -1723 -1757 -1301 -1141 -1393 -1569 -2369 -1204 -885 -634 -18 298 428 422 410 -158 -130 28 45 261 570 418 -216 -284 -510 -450 426 -43 -1387 -1176 -746 -485 521 372 79 86 31 -56 242 591 653 386 -129 -323 -1 456 303 393 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