File name: Pandora252s1_BoulderCO-NCAR_20250422_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250731T080224.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Tom Hanisco 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_v2d20221123.txt Instrument calibration file used: Pandora252s1_CF_v3d20230118.txt Level 1 file used: Pandora252s1_BoulderCO-NCAR_20250422_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: 20250422 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 20250422T141835.5Z 9243.596244 168 1 55.78 2 66.96 93.00 58.20 174.77 0.00 1 0.00 1 0 17 4.318e-02 7.294e-03 1.088e-02 2.073e-03 3.885699e-01 1.087307e-03 4.524486e-03 -6.000000e+00 2.567791e-02 228.25 -2.00 3.45 -2.00 318.08 0.00e+00 9.419736e-04 1.883224e-04 1.736605e-04 -6.000000e+00 1.081275e-03 272.77 -2.00 20.00 -2.00 317.55 0.00e+00 2.536 0.000 302.00 328.00 3 5.2314e+00 2.9058e-03 2.8898e-02 -6.0000e+00 6.4060e-02 4.3966e-02 3.2671e-03 1.9594e-02 -6.0000e+00 6.9377e-02 -4.4278e-02 2.1392e-03 9.7496e-03 -6.0000e+00 4.1062e-02 1.4027e-02 1.1052e-03 2.9156e-03 -6.0000e+00 1.7401e-02 2.0541e-04 -1.3357e-04 6.2246e-05 3.3340e-05 -6.0000e+00 1.2675e-03 1.1710e-02 -6.1951e-05 11 9 0 11 8 0 98.61 26.96 0.34 0.01171 0.01071 20 2 1 5 0 2788.660 35.50 20.00 26.96 18.32 10.3 950.43 -11746 -2321 -16173 -16984 -17926 -2479 -18997 -1057 13436 -10838 -21517 -6228 -8210 -3414 759 -2043 -2941 7247 -2411 2559 5306 1914 -818 3140 -3993 1071 -2343 -3743 -477 -119 1150 108 -807 -2719 -1027 -2137 -2172 -156 247 1506 -1407 -801 22 -249 -272 1150 295 -721 -234 1833 1779 1808 780 2588 1290 2161 598 -570 891 1422 1912 1480 1337 378 -232 -341 444 808 1547 -198 -453 415 -188 403 -95 -1853 -1352 85 -1290 -1429 -1956 -1753 -1967 -1044 -592 -826 86 106 15 112 366 -372 525 130 54 430 500 152 77 -784 -354 -982 738 104 -946 -678 -783 262 541 296 -69 279 -22 -20 770 716 784 145 -427 -264 227 392 185 396 258 742 618 786 -81 138 -178 -269 60 -56 -219 -195 217 141 -412 16 -495 -348 900000 -703 -137 -1108 -1092 -1073 -127 -1248 -65 788 -843 -1914 -522 -825 -388 96 -294 -456 1075 -413 431 879 330 -151 595 -782 205 -455 -770 -92 -24 253 24 -198 -683 -243 -524 -598 -50 94 596 -622 -369 10 -118 -130 540 139 -341 -111 892 933 1025 440 1511 790 1345 382 -363 550 878 1233 1045 959 288 -175 -244 326 606 1180 -172 -395 367 -164 352 -76 -1367 -999 62 -979 -1240 -1794 -1763 -1980 -1103 -665 -929 100 126 17 132 396 -398 530 135 57 512 627 197 104 -1030 -454 -1168 891 124 -1222 -869 -1056 369 772 456 -107 430 -34 -30 1102 991 1102 215 -642 -411 351 590 270 581 361 988 855 1072 -121 210 -286 -425 98 -96 -379 -350 397 260 -758 29 -881 -594 900000 SS 20250422T143435.6Z 9243.607357 173 1 54.06 2 63.90 95.68 57.98 179.16 0.00 1 0.00 1 0 17 2.730e-02 7.187e-03 7.161e-03 1.879e-03 3.449500e-01 9.841555e-04 4.039632e-03 -6.000000e+00 1.623661e-02 228.25 -2.00 3.45 -2.00 317.60 0.00e+00 8.401821e-04 1.485600e-04 9.156820e-05 -6.000000e+00 6.835595e-04 272.77 -2.00 20.00 -2.00 317.07 0.00e+00 2.260 0.000 302.00 328.00 3 5.3173e+00 2.6030e-03 2.5699e-02 -6.0000e+00 4.0506e-02 3.0482e-02 2.9132e-03 1.7378e-02 -6.0000e+00 4.3865e-02 -3.0938e-02 1.8196e-03 8.6208e-03 -6.0000e+00 2.5963e-02 1.0046e-02 9.1902e-04 2.5780e-03 -6.0000e+00 1.1004e-02 2.5139e-04 2.3239e-04 5.6438e-05 2.9565e-05 -6.0000e+00 8.0120e-04 1.1652e-02 -5.9321e-07 11 8 0 10 0 0 99.88 26.96 0.41 0.01165 0.01340 20 2 1 5 0 2702.730 35.50 20.00 26.96 18.78 10.3 954.09 -5595 -3904 -5296 -5730 -17371 -5508 -10223 1643 4470 -9044 -12186 -962 -4582 -1162 2343 891 -648 4683 2433 1520 5377 2205 1043 1352 -1667 577 -1837 -1813 -1336 1676 1687 -351 -97 -4451 -1386 -2237 -1893 366 -854 757 -1398 -696 83 -999 -345 738 -115 -17 -799 522 1704 1318 1110 1387 776 1952 415 153 1897 401 2046 1268 1285 747 97 -328 -231 329 1278 133 -572 366 -29 684 -144 -1277 -1457 -82 -996 -639 -1324 -1876 -2135 -1093 -806 -811 -451 422 136 84 226 -152 777 875 224 732 682 -63 -263 -486 -349 -630 998 -17 -888 -821 -953 -213 447 402 22 -53 -128 134 792 790 402 264 -171 -232 74 146 229 541 575 127 1224 886 -74 31 -613 -316 262 130 -99 -179 164 57 -336 11 -459 -493 900000 -480 -356 -490 -493 -1544 -432 -912 146 423 -1014 -1436 -110 -630 -181 405 156 -122 878 487 317 1090 464 230 316 -423 147 -469 -438 -310 389 428 -100 -30 -1422 -412 -684 -646 133 -374 372 -701 -362 44 -538 -185 390 -61 -9 -421 281 972 812 729 885 514 1309 285 104 1247 269 1417 962 1059 605 77 -264 -178 256 1013 119 -518 336 -27 620 -120 -1044 -1110 -62 -825 -559 -1227 -1913 -2321 -1172 -921 -930 -538 507 161 100 248 -164 784 897 252 860 844 -81 -351 -627 -441 -780 1187 -21 -1140 -1108 -1282 -299 634 609 34 -84 -195 199 1092 1050 545 378 -248 -350 112 215 343 770 780 174 1622 1227 -106 48 -941 -498 425 210 -170 -305 286 101 -588 18 -778 -806 900000 SS 20250422T143935.3Z 9243.610825 176 1 54.54 2 62.95 96.53 57.96 180.53 0.00 1 0.00 1 0 25 1.663e-02 6.194e-03 4.012e-03 1.274e-03 3.353601e-01 6.684894e-04 3.947914e-03 -6.000000e+00 9.889989e-03 228.25 -2.00 3.45 -2.00 317.17 0.00e+00 4.492676e-04 9.016864e-05 7.630734e-05 -6.000000e+00 4.164327e-04 272.77 -2.00 20.00 -2.00 316.64 0.00e+00 2.188 0.000 302.00 328.00 3 4.7077e+00 1.7567e-03 2.4914e-02 -6.0000e+00 2.4673e-02 2.9519e-02 1.9614e-03 1.6859e-02 -6.0000e+00 2.6720e-02 -2.4162e-02 1.1878e-03 8.3437e-03 -6.0000e+00 1.5815e-02 5.9283e-03 5.8662e-04 2.3993e-03 -6.0000e+00 6.7019e-03 4.9749e-04 -4.5594e-05 3.8259e-05 2.8683e-05 -6.0000e+00 4.8812e-04 1.3011e-02 3.0419e-06 10 0 0 10 0 0 99.85 26.96 0.29 0.01301 0.01267 51 5 1 5 0 1069.330 35.50 20.00 26.96 18.97 10.3 955.74 -4885 -2042 -3655 -1236 -8935 -1295 -7399 -300 1508 -6869 -5679 -3035 -3186 -15 2695 73 580 1979 727 1364 2133 2286 379 451 -58 166 -1783 -1217 -472 758 1753 449 -447 -2476 -1835 -2374 -234 113 -325 -230 -834 -614 181 -312 247 -291 -584 -532 -544 1011 884 814 1262 1373 640 1326 481 427 892 705 1114 1539 1361 566 -370 -286 -208 89 1569 279 -73 -88 -281 -37 -180 -379 -413 -387 -575 -986 -1223 -1781 -1876 -1083 -970 -507 -77 158 -128 114 455 290 830 585 464 701 560 91 -480 -515 -292 -377 804 -139 -1211 -768 -595 -304 401 291 -33 23 -7 118 565 788 551 390 -183 -336 -114 297 145 282 498 177 1136 946 100 -53 -378 -144 115 208 -157 -260 178 -101 -390 -77 -328 -320 900000 -528 -232 -422 -129 -925 -123 -814 -35 187 -960 -797 -449 -495 -3 527 16 134 474 184 354 555 597 105 122 -16 49 -520 -364 -135 219 502 143 -154 -872 -615 -816 -88 47 -160 -120 -473 -363 108 -189 149 -176 -349 -314 -322 609 533 528 865 988 448 945 349 306 626 498 822 1227 1109 487 -315 -227 -167 73 1305 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