File name: Pandora252s1_BoulderCO-NCAR_20250822_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250823T070848.4Z 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_20250822_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: 20250822 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 20250822T152145.2Z 9365.640107 146 1 16.07 2 56.39 104.16 49.33 104.64 0.00 1 0.00 1 0 17 9.310e-03 6.313e-03 3.116e-03 1.819e-03 2.274124e-01 9.656958e-04 2.697026e-03 -6.000000e+00 5.548886e-03 230.09 -2.00 3.45 -2.00 315.69 0.00e+00 3.574921e-04 9.369170e-05 3.021409e-05 -6.000000e+00 2.419349e-04 281.88 -2.00 20.00 -2.00 315.04 0.00e+00 1.801 0.000 302.00 328.00 3 4.6648e+00 2.4997e-03 1.8951e-02 -6.0000e+00 1.3858e-02 -7.4137e-04 2.7739e-03 1.1534e-02 -6.0000e+00 1.4992e-02 -7.3891e-03 1.5912e-03 5.6302e-03 -6.0000e+00 8.9091e-03 -3.0775e-04 7.1458e-04 1.5829e-03 -6.0000e+00 3.7671e-03 8.6401e-04 1.9159e-04 5.5091e-05 2.1306e-05 -6.0000e+00 2.7388e-04 5.2922e-02 9.6172e-06 12 1 1 12 9 1 99.75 27.53 0.29 0.05292 0.05436 11 4 1 5 0 1338.890 36.00 20.00 27.53 31.72 10.6 1035.45 -1968 -473 -2025 -2986 -2610 -1487 1170 34 1033 -1470 -2582 106 535 873 812 462 442 1632 475 308 1216 1686 1142 1678 1589 -100 -1326 -16 601 837 1020 1531 -1021 -2484 -1658 -1600 -1123 -547 -1165 -1095 -1024 -814 -599 -278 -344 -601 -664 -750 -47 557 790 1098 849 540 640 491 429 53 1232 1148 1356 1570 1033 -60 -183 -240 166 931 1170 -404 -150 45 57 30 -168 -354 -948 293 -582 -943 -1123 -1720 -1546 -878 -728 -166 -163 204 -30 258 156 -96 1116 832 552 787 612 -431 -276 -287 -381 74 779 -423 -1365 -497 -582 -109 432 167 -27 -193 209 165 725 569 312 114 -280 -536 -156 -48 369 639 435 229 1187 521 -105 -183 -400 -20 187 191 -2 -49 188 -24 -428 -177 -225 -368 900000 -514 -126 -530 -714 -575 -328 276 9 290 -426 -759 32 171 314 300 181 179 674 205 136 533 740 523 750 739 -47 -613 -7 261 369 479 716 -510 -1218 -775 -782 -584 -316 -748 -782 -734 -600 -447 -207 -255 -439 -473 -549 -34 411 585 859 664 439 531 414 363 45 1011 961 1198 1422 954 -57 -172 -208 143 822 1087 -401 -151 45 57 29 -157 -314 -787 242 -530 -919 -1157 -1836 -1664 -998 -849 -196 -200 252 -37 304 176 -103 1171 857 618 894 738 -540 -348 -359 -459 87 920 -517 -1730 -631 -773 -146 606 239 -40 -276 288 218 921 707 401 150 -382 -761 -221 -66 508 835 562 294 1485 657 -136 -251 -548 -28 268 278 -2 -75 296 -38 -675 -271 -344 -549 900000 SS 20250822T152531.8Z 9365.642729 149 1 23.73 2 55.70 104.89 48.66 105.41 0.00 1 0.00 1 0 17 8.008e-03 6.224e-03 6.286e-04 4.066e-04 2.236081e-01 2.160891e-04 2.660176e-03 -6.000000e+00 4.771069e-03 230.09 -2.00 3.45 -2.00 315.32 0.00e+00 2.689551e-04 1.947520e-05 2.471742e-05 -6.000000e+00 2.080962e-04 281.88 -2.00 20.00 -2.00 314.70 0.00e+00 1.769 0.000 302.00 328.00 3 2.2483e+00 5.5729e-04 1.8618e-02 -6.0000e+00 1.1916e-02 -1.1496e-02 6.1797e-04 1.1332e-02 -6.0000e+00 1.2892e-02 -9.0819e-03 3.5364e-04 5.5335e-03 -6.0000e+00 7.6609e-03 8.9929e-04 1.5631e-04 1.5414e-03 -6.0000e+00 3.2384e-03 1.0065e-02 1.1374e-04 1.2283e-05 2.1628e-05 -6.0000e+00 2.3557e-04 5.4452e-02 -9.0191e-06 12 1 1 12 1 1 99.93 27.53 0.35 0.05445 0.05531 240 55 1 5 0 98.430 36.00 20.00 27.53 32.02 10.7 1038.36 -542 -702 -2135 -2689 -1485 -1105 407 181 -384 -1662 -635 25 -185 425 61 188 756 991 1128 1010 811 1573 1057 930 649 -65 -633 -240 732 1196 969 1195 -678 -2331 -1391 -1388 -870 -183 -648 -1020 -728 -608 -758 -600 -354 -757 -640 -549 -39 657 820 780 1011 665 851 862 380 257 808 1122 1477 1337 1024 26 -320 123 64 906 922 -86 -33 -155 -101 -188 -258 -123 -268 32 -451 -1140 -1412 -1930 -1615 -806 -846 -417 -101 -73 -135 145 433 387 966 959 464 606 489 -188 -517 -379 -582 55 630 -464 -1165 -583 -567 -214 422 68 30 -15 97 217 669 781 516 397 -143 -530 -136 76 128 534 535 524 1267 694 62 9 -293 -97 193 93 -280 -94 127 -266 -289 -210 -331 -339 900000 -170 -214 -677 -775 -419 -294 117 58 -124 -547 -207 9 -68 167 26 82 336 454 533 465 374 762 508 471 326 -33 -326 -115 350 579 476 627 -359 -1213 -724 -720 -489 -116 -444 -750 -544 -468 -572 -468 -274 -580 -476 -412 -29 498 633 616 836 551 719 741 329 219 681 961 1288 1219 964 25 -302 110 56 789 861 -84 -33 -158 -103 -181 -242 -107 -226 27 -405 -1081 -1439 -2065 -1764 -902 -988 -501 -122 -90 -161 170 479 413 1001 1017 505 689 597 -235 -652 -467 -702 64 735 -553 -1456 -742 -735 -289 585 95 43 -21 132 286 838 980 652 521 -192 -742 -190 103 172 699 683 654 1545 889 81 12 -406 -134 274 135 -413 -143 193 -411 -441 -317 -494 -495 900000 SS 20250822T153042.8Z 9365.646329 152 1 16.49 2 54.74 105.91 47.74 106.48 0.00 1 0.00 1 0 17 1.224e-02 7.533e-03 5.408e-03 3.027e-03 2.197342e-01 1.602531e-03 2.578603e-03 -6.000000e+00 7.297235e-03 230.09 -2.00 3.45 -2.00 315.80 0.00e+00 2.561685e-04 1.600558e-04 3.423806e-05 -6.000000e+00 3.181770e-04 281.88 -2.00 20.00 -2.00 315.15 0.00e+00 1.727 0.000 302.00 328.00 3 5.5568e+00 4.1607e-03 1.8196e-02 -6.0000e+00 1.8225e-02 1.3765e-02 4.6200e-03 1.1079e-02 -6.0000e+00 1.9716e-02 -9.6860e-03 2.6491e-03 5.4103e-03 -6.0000e+00 1.1716e-02 3.1143e-04 1.1975e-03 1.5101e-03 -6.0000e+00 4.9537e-03 3.7930e-04 3.6991e-04 9.2207e-05 1.9875e-05 -6.0000e+00 3.6020e-04 5.3803e-02 2.8681e-05 12 9 1 12 9 1 93.88 27.53 0.25 0.05380 0.05658 4 2 1 5 0 3297.280 36.00 20.00 27.53 32.71 10.7 1044.06 -1529 -426 -1115 2355 -6249 -1392 -1395 3143 2304 -117 -2531 -50 2425 -109 972 -1204 684 2493 -516 225 3348 1966 311 1066 -1163 2361 -2028 -278 539 1020 620 285 -1961 -3143 -590 -2706 -734 -111 -1354 -1388 -1356 -749 -770 -794 -381 -920 -441 -333 -596 664 441 849 930 1279 846 1490 59 -181 894 2060 1642 1077 1190 380 -915 -279 714 897 1566 -93 264 183 -519 203 -127 -629 -770 625 -486 -1628 -1880 -1915 -1715 -614 -194 -180 54 172 160 45 235 -191 1657 992 105 1100 372 -138 135 -429 -791 124 736 -386 -1622 -650 -275 -374 33 -120 -73 -69 -258 113 849 579 343 380 -98 -677 563 97 185 407 389 1046 761 168 -207 -350 -447 178 254 -51 468 -117 281 -382 -511 -46 -511 50 900000 -378 -108 -273 504 -1346 -289 -318 761 600 -31 -696 -14 701 -36 354 -472 271 1003 -221 90 1407 842 130 464 -538 1059 -909 -124 227 435 283 129 -940 -1473 -259 -1269 -385 -64 -859 -978 -1010 -536 -558 -575 -292 -696 -322 -236 -420 475 335 638 732 1038 704 1252 50 -153 739 1715 1452 971 1138 371 -854 -238 610 787 1422 -89 267 188 -523 203 -116 -553 -631 508 -437 -1557 -1879 -2060 -1838 -691 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