File name: Pandora253s1_TucsonAZ_20240426_L2Fit_fout2c1d20230118p1-8.txt File generation date: 20240429T095958.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Manish Naja Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 253 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora253_OF_v2d20221208.txt Instrument calibration file used: Pandora253s1_CF_v1d20230118.txt Level 1 file used: Pandora253s1_TucsonAZ_20240426_L1_smca1c1d20230118p1-8.txt Full location name: University of Arizona Department of Chemical and Environmental Engineering Short location name: TucsonAZ Country of location: United States Location latitude [deg]: 32.2330 Location longitude [deg]: -110.9530 Location altitude [m]: 779 Local noon date: 20240426 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Full lab calibration+OOB session, absolute calibration done with an uncalibrated lamp, certificate of FEL1441 (GSFC) used First and last pixel inside fitting window: 192 334 Nominal wavelengths inside fitting window [nm]: 305.0464 305.1873 305.3281 305.4689 305.6097 305.7505 305.8913 306.0321 306.1728 306.3136 306.4543 306.5950 306.7358 306.8765 307.0171 307.1578 307.2985 307.4391 307.5798 307.7204 307.8610 308.0016 308.1422 308.2828 308.4234 308.5639 308.7045 308.8450 308.9856 309.1261 309.2666 309.4071 309.5475 309.6880 309.8285 309.9689 310.1093 310.2498 310.3902 310.5306 310.6709 310.8113 310.9517 311.0920 311.2323 311.3727 311.5130 311.6533 311.7936 311.9339 312.0741 312.2144 312.3546 312.4948 312.6351 312.7753 312.9155 313.0556 313.1958 313.3360 313.4761 313.6162 313.7564 313.8965 314.0366 314.1767 314.3167 314.4568 314.5969 314.7369 314.8769 315.0169 315.1569 315.2969 315.4369 315.5769 315.7168 315.8568 315.9967 316.1366 316.2765 316.4164 316.5563 316.6962 316.8360 316.9759 317.1157 317.2556 317.3954 317.5352 317.6750 317.8147 317.9545 318.0942 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0722 319.2118 319.3515 319.4911 319.6307 319.7703 319.9099 320.0495 320.1891 320.3286 320.4682 320.6077 320.7472 320.8868 321.0263 321.1657 321.3052 321.4447 321.5841 321.7236 321.8630 322.0024 322.1418 322.2812 322.4206 322.5600 322.6993 322.8386 322.9780 323.1173 323.2566 323.3959 323.5352 323.6744 323.8137 323.9529 324.0922 324.2314 324.3706 324.5098 324.6490 324.7882 324.9273 --------------------------------------------------------------------------------------- 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 20240426T131237.5Z 8882.550435 216 1 54.29 2 84.55 77.13 81.25 231.63 0.00 1 0.00 1 0 25 6.188e-01 2.753e-02 5.169e-01 2.689e-02 1.202580e+00 1.761710e-02 1.224521e-02 -6.000000e+00 3.719097e-01 229.54 -2.00 3.29 -2.00 322.71 0.00e+00 -1.845130e-03 1.087725e-02 6.210180e-03 -6.000000e+00 2.200271e-02 283.07 -2.00 20.00 -2.00 322.34 0.00e+00 9.215 0.010 302.00 328.00 3 2.2473e-01 7.6450e-02 1.1481e-01 -6.0000e+00 9.3170e-01 2.0692e+00 9.4226e-02 8.8229e-02 -6.0000e+00 1.0153e+00 -2.4389e+00 6.9751e-02 3.5004e-02 -6.0000e+00 5.9537e-01 9.0700e-01 3.5019e-02 1.3618e-02 -6.0000e+00 2.5652e-01 2.2045e-05 -8.7691e-04 7.2356e-04 1.6302e-04 -6.0000e+00 1.8746e-02 -3.0554e-02 0.0000e+00 12 8 8 10 0 0 53.62 25.42 1.10 -0.03055 -0.03714 46 4 1 5 0 1180.130 33.00 19.99 25.42 20.91 4.4 943.89 58515 32906 28438 900000 900000 -126231 133865 900000 64214 900000 900000 900000 -63407 1042 2959 -25990 211869 123384 63943 208471 900000 900000 19460 900000 34658 900000 900000 -70280 28577 -5270 -104107 152672 -41556 900000 -55672 900000 900000 900000 215822 80449 32801 14211 93487 114606 302819 34273 76746 900000 -21924 -35124 900000 3659 134239 119421 78091 80946 -7386 5709 9967 -225 -2407 12730 83059 40010 8859 53682 72923 -5790 37788 63188 58078 20981 14299 10362 15132 48993 -1725 8939 -27264 10853 15075 13068 17211 8993 -434 6777 1990 -9990 6748 2543 -12030 5445 -5833 11494 -13347 -873 462 4758 147 2136 -1832 -5918 -1537 6457 -1838 -945 -4556 -4377 -1236 341 -2947 -1179 -2045 -1485 -2042 840 -872 512 -2061 1130 2924 746 4064 -593 1455 2116 1113 3188 -550 1166 -10 -284 67 -903 -6 1478 374 525 -1302 444 -456 218 -1577 1529 860 743 900000 900000 -7971 3498 900000 1678 900000 900000 900000 -2347 27 84 -1132 5536 3224 1671 5447 900000 900000 508 900000 906 900000 900000 -3506 747 -138 -7914 3989 -2369 900000 -3571 900000 900000 900000 5639 2102 1247 675 2443 2995 7913 1140 2005 900000 -1354 -2670 900000 235 3508 3121 2968 3077 -684 448 687 -15 -160 756 2762 2376 800 3188 3638 -674 3142 4653 4967 2691 1902 1305 1582 3142 -168 807 -4080 1366 2220 2561 3688 2256 -126 1913 608 -3498 1975 744 -3804 1366 -1631 2913 -5092 -358 227 2673 99 1485 -1274 -3835 -827 2970 -946 -511 -2703 -2825 -878 283 -3011 -1355 -2559 -1901 -2609 1023 -1084 654 -2839 1547 3820 930 4588 -678 1585 2239 1169 3448 -728 1837 -19 -603 155 -2314 -16 4271 1119 1578 -3954 1263 -1199 515 -3506 SS 20240426T132437.0Z 8882.558762 219 1 54.88 2 82.07 78.67 83.21 233.38 0.00 1 0.00 1 0 25 8.777e-01 7.500e-03 3.424e-01 3.437e-03 9.835101e-01 2.023669e-03 9.974019e-03 -6.000000e+00 5.167499e-01 229.54 -2.00 3.29 -2.00 322.16 0.00e+00 6.318272e-03 1.268174e-03 1.879033e-03 -6.000000e+00 2.420767e-02 283.07 -2.00 20.00 -2.00 321.73 0.00e+00 6.772 0.004 302.00 328.00 3 3.2114e-01 8.4032e-03 8.2966e-02 -6.0000e+00 1.2867e+00 3.9145e-01 1.4768e-02 6.2974e-02 -6.0000e+00 1.3924e+00 -4.2971e-01 1.6973e-02 3.2580e-02 -6.0000e+00 8.2663e-01 1.5148e-01 7.4041e-03 1.4122e-02 -6.0000e+00 3.5103e-01 2.7637e-04 -9.4556e-04 9.1890e-05 1.6382e-04 -6.0000e+00 2.4407e-02 -3.2016e-02 0.0000e+00 11 8 0 10 0 0 -0.72 25.42 0.50 -0.03202 -0.03912 201 19 1 5 0 273.020 33.00 19.99 25.42 21.48 4.4 948.55 -312836 -310328 -282198 -316843 -342528 -253038 900000 -212383 -319316 -174747 -258047 900000 -102717 -45438 -187968 -130574 -167220 -129390 -63429 -121914 -121974 -114759 -126242 -71641 -16748 900000 11785 -71510 3077 -132952 -87603 -52368 -50857 19424 71417 25739 -1304 -36311 -9678 -21289 3551 20378 859 -12314 6548 19329 12358 -6836 4323 23228 5123 13215 12922 10769 4089 6067 9152 4424 5164 -396 185 5618 12592 2752 9155 5695 4743 -1854 3034 4700 4954 4430 847 3642 4427 -4242 -2991 -6045 -4328 60 -235 1744 158 -1294 469 -187 1128 -3 1851 505 -505 507 415 -1052 96 -1934 -925 636 487 -291 -465 -242 -1255 -598 -581 -1902 -1344 -1113 -1105 -16 -169 104 -106 127 140 458 418 432 446 -259 -162 396 385 211 -43 20 1 1130 859 -8 2 141 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1.170576e-02 283.08 -2.00 20.00 -2.00 320.65 0.00e+00 4.952 0.002 302.00 328.00 3 1.8142e-01 1.7144e-03 5.9633e-02 -6.0000e+00 6.6853e-01 1.2115e-01 2.4645e-03 4.0011e-02 -6.0000e+00 7.2288e-01 -1.1403e-01 2.6469e-03 2.1025e-02 -6.0000e+00 4.3019e-01 3.2693e-02 1.2532e-03 8.8717e-03 -6.0000e+00 1.8314e-01 1.9967e-03 -6.5362e-04 2.4774e-05 8.7850e-05 -6.0000e+00 1.2669e-02 -3.2973e-02 0.0000e+00 10 0 0 10 0 0 9.49 25.39 0.39 -0.03297 -0.03788 596 56 1 5 0 91.950 32.75 19.99 25.39 22.62 4.4 956.57 -102545 -160867 -167744 -150622 -165039 -141947 -168491 -147975 -132234 -133110 -108451 -112370 -107939 -85985 -83228 -57460 -46670 -29415 -25365 -14724 -25766 -23199 -30108 -35042 -34662 -24631 -21939 -34879 -30454 -22824 -19163 -14897 -6992 -9138 -9564 -9667 -12186 -10404 -5387 -4246 629 -726 -1729 886 1795 -728 299 589 -848 -280 2321 1338 2098 2575 3163 1767 949 343 -291 374 223 568 2708 2950 2188 1657 1649 553 1514 1703 1554 839 482 583 10 -789 -1369 -1562 -1403 -686 -499 -592 -1443 -1485 -919 -485 14 215 505 352 947 1003 174 144 446 -12 115 678 75 -205 -371 -214 -60 80 -773 -1332 -854 -780 -332 88 -104 -157 -37 165 30 420 691 495 300 -229 -563 -85 259 194 116 232 298 1107 696 50 -23 -142 -99 15 13 -369 -165 174 -63 -176 -5 -2 94 -209 -736 -932 -726 -863 -568 -936 -762 -737 -837 -575 -697 -815 -695 -860 -578 -499 -301 -278 -156 -320 -284 -409 -548 -595 -412 -373 -671 -553 -410 -398 -368 -192 -289 -305 -301 -415 -408 -247 -237 39 -50 -129 67 137 -59 25 51 -78 -28 250 166 289 389 514 307 173 64 -53 66 40 109 581 725 596 460 454 158 467 603 621 360 209 241 4 -272 -436 -495 -486 -280 -242 -334 -839 -928 -607 -341 10 164 386 263 660 653 109 91 312 -10 110 744 85 -242 -457 -239 -60 76 -780 -1441 -967 -942 -399 118 -158 -260 -63 277 49 640 1035 767 491 -394 -972 -140 409 295 169 327 405 1508 1057 87 -41 -279 -206 34 30 -862 -397 422 -154 -419 -12 -5 200 SS 20240426T134611.9Z 8882.573749 227 1 54.80 2 77.57 81.40 86.85 236.39 0.00 1 0.00 1 0 25 3.149e-01 4.879e-03 3.935e-02 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