File name: Pandora252s1_BoulderCO-NCAR_20250904_L2Fit_fout2c3d20230118p1-8.txt File generation date: 20250905T070339.9Z 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_20250904_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: 20250904 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 20250904T153648.1Z 9378.650557 4 1 54.61 2 56.07 112.06 160.24 322.91 0.00 1 0.00 1 0 25 8.064e-03 6.280e-03 2.380e-04 1.540e-04 2.274555e-01 8.045771e-05 2.689123e-03 -6.000000e+00 4.737676e-03 229.09 -2.00 3.45 -2.00 315.33 0.00e+00 3.411869e-04 7.309195e-06 2.728479e-05 -6.000000e+00 2.072507e-04 280.75 -2.00 20.00 -2.00 314.72 0.00e+00 1.786 0.000 302.00 328.00 3 1.1336e+00 2.0730e-04 1.8764e-02 -6.0000e+00 1.1805e-02 -6.4810e-03 2.3104e-04 1.1428e-02 -6.0000e+00 1.2826e-02 -8.4711e-03 1.3169e-04 5.5889e-03 -6.0000e+00 7.6274e-03 2.6317e-04 5.7175e-05 1.5591e-03 -6.0000e+00 3.1678e-03 3.0053e-02 9.4554e-05 4.6281e-06 2.1513e-05 -6.0000e+00 2.3609e-04 -6.6564e-03 2.3695e-05 10 0 0 10 0 0 99.91 25.95 0.34 -0.00666 -0.00595 1559 154 1 5 0 35.020 34.50 20.00 25.95 34.63 11.9 1058.96 -250 -712 -1362 -2750 -2090 -1346 -485 455 -65 -1478 -1524 -313 -384 163 448 97 441 949 1159 1195 883 1268 1448 799 792 250 -534 -295 395 958 1083 1224 365 -1926 -1818 -1139 -1355 -322 -326 -858 -851 -567 -634 -641 -204 -525 -640 -517 -403 514 757 755 1078 833 687 999 486 286 704 974 1332 1428 1266 482 -399 -119 -29 314 1110 242 -161 -47 -201 -125 -258 -243 -274 -102 -99 -890 -1258 -1712 -1969 -1107 -951 -706 -249 -60 -137 27 447 364 659 1135 667 483 629 157 -476 -414 -511 -376 523 132 -1062 -856 -545 -472 273 249 50 -75 13 93 442 858 654 527 118 -467 -342 90 91 357 630 409 1085 1170 292 96 -135 -231 77 250 -163 -245 152 -86 -355 -188 -246 -455 -294 -75 -228 -437 -828 -603 -374 -142 139 -20 -486 -498 -105 -135 65 189 42 197 437 523 555 416 593 693 404 401 130 -274 -149 186 444 528 611 195 -1050 -941 -588 -738 -195 -216 -606 -627 -434 -479 -487 -154 -407 -485 -380 -301 384 573 588 882 690 566 837 413 241 603 836 1148 1280 1185 460 -374 -109 -26 274 1004 232 -163 -47 -203 -124 -251 -219 -240 -86 -86 -820 -1259 -1775 -2115 -1212 -1085 -837 -301 -74 -168 32 503 393 693 1175 718 543 743 194 -611 -518 -627 -439 605 157 -1305 -1082 -702 -621 368 347 71 -106 18 123 564 1064 820 679 156 -641 -478 123 124 473 810 513 1336 1466 374 128 -184 -320 108 354 -240 -368 229 -132 -548 -287 -371 -667 -428 SS 20250904T154213.7Z 9378.654325 7 1 54.61 2 55.11 113.21 160.80 326.04 0.00 1 0.00 1 0 17 8.032e-03 6.240e-03 2.261e-04 1.487e-04 2.221445e-01 7.763307e-05 2.628097e-03 -6.000000e+00 4.716965e-03 229.09 -2.00 3.45 -2.00 315.25 0.00e+00 3.352075e-04 6.938326e-06 2.466127e-05 -6.000000e+00 2.064669e-04 280.75 -2.00 20.00 -2.00 314.64 0.00e+00 1.743 0.000 302.00 328.00 3 1.1143e+00 1.9974e-04 1.8317e-02 -6.0000e+00 1.1753e-02 -7.0068e-03 2.2256e-04 1.1155e-02 -6.0000e+00 1.2772e-02 -7.6886e-03 1.2711e-04 5.4576e-03 -6.0000e+00 7.5949e-03 -2.8563e-04 5.5129e-05 1.5205e-03 -6.0000e+00 3.1527e-03 3.2030e-02 -2.1027e-04 4.4743e-06 2.1006e-05 -6.0000e+00 2.3521e-04 -4.7257e-03 -4.0405e-05 10 0 0 10 0 0 37.26 26.17 0.33 -0.00473 -0.00631 1599 158 1 5 0 34.150 35.00 20.01 26.17 35.78 11.6 1065.90 -139 -773 -1429 -2958 -2075 -1330 -405 423 16 -1425 -1387 -313 -235 303 521 124 478 940 1059 1109 783 1227 1368 821 892 317 -539 -433 400 853 1058 1333 398 -1922 -1816 -1144 -1295 -272 -287 -896 -846 -595 -714 -658 -248 -515 -667 -504 -346 526 761 737 1025 863 681 981 526 301 684 982 1311 1460 1256 516 -383 -110 -42 310 1093 253 -116 -62 -174 -98 -247 -242 -251 -105 -105 -863 -1253 -1723 -1933 -1094 -941 -688 -197 -54 -126 21 407 345 633 1104 631 489 620 160 -470 -405 -507 -387 490 67 -1048 -824 -538 -460 240 256 72 -44 23 109 433 815 637 496 114 -462 -310 88 110 365 629 448 1101 1153 272 94 -139 -258 71 229 -186 -246 147 -61 -344 -197 -255 -435 -295 -44 -246 -456 -941 -591 -366 -117 136 5 -493 -476 -111 -87 120 218 56 212 429 499 537 384 598 682 412 468 164 -287 -216 195 410 534 686 209 -1033 -968 -608 -727 -163 -189 -652 -641 -452 -555 -513 -192 -396 -501 -379 -255 389 570 587 830 707 573 838 456 259 578 832 1119 1295 1165 487 -365 -99 -36 274 975 246 -115 -63 -178 -98 -236 -221 -216 -90 -93 -805 -1234 -1807 -2098 -1211 -1059 -804 -236 -66 -152 25 462 376 654 1154 666 555 738 198 -594 -509 -609 -454 557 79 -1296 -1048 -698 -609 325 358 102 -63 32 145 553 1014 801 641 152 -637 -425 122 149 485 811 563 1360 1415 349 125 -190 -351 99 325 -273 -370 222 -94 -530 -296 -378 -639 -430 SS 20250904T154727.7Z 9378.657960 10 1 54.62 2 54.20 114.34 161.30 329.21 0.00 1 0.00 1 0 17 7.993e-03 6.235e-03 2.154e-04 1.437e-04 2.171231e-01 7.504906e-05 2.570028e-03 -6.000000e+00 4.693994e-03 229.09 -2.00 3.45 -2.00 315.19 0.00e+00 3.372972e-04 6.643264e-06 2.384319e-05 -6.000000e+00 2.054397e-04 280.75 -2.00 20.00 -2.00 314.58 0.00e+00 1.705 0.000 302.00 328.00 3 1.0870e+00 1.9300e-04 1.7910e-02 -6.0000e+00 1.1696e-02 -7.1003e-03 2.1498e-04 1.0907e-02 -6.0000e+00 1.2710e-02 -7.1127e-03 1.2264e-04 5.3367e-03 -6.0000e+00 7.5578e-03 -3.9302e-04 5.3064e-05 1.4873e-03 -6.0000e+00 3.1376e-03 3.4268e-02 -1.9960e-04 4.3075e-06 2.0750e-05 -6.0000e+00 2.3404e-04 -5.2143e-03 -3.6706e-05 10 0 0 10 0 0 62.09 26.34 0.34 -0.00521 -0.00671 1675 166 1 5 0 32.600 35.00 20.00 26.34 36.67 11.5 1070.99 -192 -693 -1386 -2863 -1928 -1250 -417 590 71 -1395 -1479 -264 -169 346 619 108 481 912 964 1092 734 1247 1437 930 846 306 -576 -473 386 902 1043 1273 325 -1942 -1872 -1216 -1323 -274 -249 -868 -897 -591 -662 -672 -226 -529 -642 -573 -390 505 792 779 1067 825 674 956 500 261 631 959 1318 1485 1259 472 -342 -133 -58 321 1093 227 -113 -33 -139 -86 -250 -225 -283 -114 -104 -839 -1234 -1719 -1965 -1078 -923 -686 -232 -48 -125 11 420 375 644 1077 639 498 657 162 -455 -385 -479 -389 477 62 -1029 -847 -551 -466 232 245 68 -45 28 114 417 805 647 489 133 -444 -320 98 88 348 640 465 1082 1144 269 98 -150 -266 54 213 -159 -259 148 -85 -333 -161 -228 -429 -323 -60 -232 -465 -898 -575 -360 -127 186 24 -477 -531 -92 -65 142 269 48 222 431 470 522 356 600 706 481 439 163 -303 -244 194 446 516 673 176 -1069 -978 -662 -761 -168 -168 -623 -671 -459 -508 -517 -179 -415 -492 -426 -293 379 602 610 877 685 575 803 426 221 542 824 1139 1335 1182 451 -329 -121 -51 278 983 217 -113 -35 -143 -84 -241 -207 -245 -99 -92 -787 -1221 -1812 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