File name: Pandora253s1_TucsonAZ_20240705_L2Fit_fout2c1d20230118p1-8.txt File generation date: 20240706T073556.8Z 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_20240705_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: 20240705 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 20240705T134530.1Z 8952.573265 72 1 56.73 2 74.73 72.50 69.40 69.50 0.00 1 0.00 1 0 17 3.161e-01 1.220e-02 2.697e-01 1.037e-02 4.653570e-01 5.622001e-03 5.109957e-03 -6.000000e+00 1.855568e-01 230.80 -2.00 3.29 -2.00 320.59 0.00e+00 2.895004e-03 2.214305e-03 2.725101e-04 -6.000000e+00 8.448915e-03 288.85 -2.00 20.00 -2.00 319.88 0.00e+00 3.726 0.001 302.00 328.00 3 4.8190e+00 1.7710e-02 4.1429e-02 -6.0000e+00 4.6442e-01 -3.8151e-02 2.2479e-02 2.4039e-02 -6.0000e+00 5.0145e-01 -2.7567e-04 1.9635e-02 1.2069e-02 -6.0000e+00 2.9823e-01 -6.5490e-03 9.7528e-03 5.1345e-03 -6.0000e+00 1.2737e-01 8.3106e-05 -6.6663e-04 3.2185e-04 5.1170e-05 -6.0000e+00 8.7171e-03 -3.6745e-02 0.0000e+00 12 8 8 10 0 0 49.48 25.78 0.22 -0.03674 -0.04175 15 1 1 5 0 3781.930 33.00 20.00 25.78 38.08 4.0 1057.71 -27621 140447 218958 -106171 -82941 44574 -20991 -56911 -55939 900000 -112150 -12555 -46411 -67275 -37767 4235 33329 -61610 90011 16394 38236 1103 -16163 4193 -16659 12424 -20054 -3625 -7677 28965 1257 -2283 2956 18371 -3158 -17062 -7857 10335 9756 -2903 -3779 851 6096 9592 6654 4086 3620 18095 4271 4550 6058 -4638 194 498 125 -3159 -3724 7246 -173 664 -1297 6596 5768 4345 1420 2125 -2983 728 809 1769 2074 -1275 855 -155 2212 79 -4900 -3613 -2370 -4561 -1531 -3264 454 -1925 125 -118 143 -364 2916 12 1262 -351 1227 1500 504 -2001 -76 1601 -1456 -824 -92 421 -889 -473 -82 -1496 -962 39 323 258 -754 396 -417 627 614 359 -241 282 677 461 168 -616 -1429 -369 967 182 -877 2300 457 129 599 1226 979 -1315 -224 625 -860 717 -634 -767 376 41 -26 -279 1420 2215 -2538 -1449 451 -212 -837 -926 900000 -3712 -162 -981 -2165 -1111 97 644 -3342 1159 467 914 39 -684 154 -812 480 -1106 -167 -353 932 59 -128 179 1047 -221 -1318 -585 741 852 -347 -521 121 869 1367 991 635 572 2496 687 753 1058 -994 43 119 32 -863 -1055 1859 -47 177 -358 1801 1766 1498 535 857 -1204 279 326 798 1049 -712 475 -84 1100 36 -2156 -1498 -1011 -2265 -855 -2106 311 -1439 98 -99 127 -339 2664 11 1084 -284 907 1073 384 -1751 -74 1744 -1802 -1042 -111 464 -909 -471 -86 -1715 -1153 49 432 376 -1208 663 -709 1015 931 514 -339 407 1029 748 281 -1026 -2326 -576 1424 259 -1206 3036 658 206 1034 2231 1855 -2660 -475 1398 -2024 1699 -1540 -1838 854 88 -54 SS 20240705T140201.9Z 8952.584745 75 1 54.67 2 71.38 74.40 66.22 71.15 0.00 1 0.00 1 0 17 8.131e-02 7.132e-03 7.998e-02 4.826e-03 4.015580e-01 2.524206e-03 4.453695e-03 -6.000000e+00 4.766093e-02 230.80 -2.00 3.29 -2.00 319.88 0.00e+00 1.681025e-03 7.754812e-04 1.724759e-04 -6.000000e+00 2.122101e-03 288.85 -2.00 20.00 -2.00 319.10 0.00e+00 3.093 0.000 302.00 328.00 3 4.6900e+00 7.4164e-03 3.4727e-02 -6.0000e+00 1.1903e-01 -1.4812e-02 8.8921e-03 2.0265e-02 -6.0000e+00 1.2843e-01 -2.0163e-02 6.9485e-03 9.9611e-03 -6.0000e+00 7.6625e-02 2.1670e-03 3.5900e-03 3.4597e-03 -6.0000e+00 3.2742e-02 1.7706e-04 -2.4815e-04 1.4725e-04 3.6990e-05 -6.0000e+00 2.2419e-03 -3.6385e-02 0.0000e+00 11 8 0 10 0 0 69.72 25.78 0.34 -0.03638 -0.03825 21 2 1 5 0 2603.040 33.00 20.00 25.78 39.09 4.0 1064.85 18106 -50207 -38225 670 9133 -24167 -36487 -3278 23813 -2758 -21579 -7113 -3330 15047 -9466 -2930 11332 -8629 3060 -2885 -5907 -2928 -4079 -9737 -11169 -3678 -2774 -9730 -6034 8217 -10743 -9518 -2960 -2496 8838 3172 -2392 70 5806 -1352 -4172 -3488 4187 1665 3055 -853 1170 2677 -1481 -1058 2857 2424 1787 1879 1195 2989 -212 1236 1328 -873 530 -617 2619 965 2109 362 787 1688 1674 -1623 184 397 -387 564 -795 547 -115 -1346 -1125 -1152 -1286 -2582 -2021 -2119 -180 -425 320 -61 200 106 691 995 777 -115 2446 -817 1068 22 90 -594 62 -538 -348 820 53 -1117 -1425 -737 -481 948 31 2 -122 435 -294 -149 899 463 416 -109 -760 -576 116 -24 294 764 401 710 863 287 99 -199 202 -8 343 -284 282 -185 -158 -331 -183 -152 33 225 -1439 -1047 12 141 -486 -859 -62 387 -64 -619 -183 -94 425 -409 -138 509 -506 170 -179 -392 -208 -298 -797 -994 -320 -245 -898 -508 596 -1016 -1003 -327 -297 919 334 -281 9 874 -262 -945 -842 979 411 749 -220 296 665 -385 -279 768 714 573 644 435 1103 -83 481 508 -336 205 -257 1165 479 1086 184 374 776 803 -906 113 259 -259 363 -486 300 -57 -643 -553 -638 -819 -1880 -1604 -1784 -158 -402 318 -63 210 109 667 883 640 -91 1989 -763 1105 25 116 -788 79 -628 -373 857 59 -1361 -1827 -990 -683 1435 51 3 -211 714 -453 -215 1252 667 636 -179 -1292 -971 189 -38 441 1091 549 957 1234 452 169 -358 374 -16 696 -615 572 -387 -334 -690 -402 -319 67 SS 20240705T141634.3Z 8952.594841 78 1 55.20 2 68.41 76.06 63.40 72.58 0.00 1 0.00 1 0 17 3.673e-02 5.534e-03 2.917e-02 3.113e-03 3.525740e-01 1.625578e-03 3.901332e-03 -6.000000e+00 2.153211e-02 230.80 -2.00 3.29 -2.00 319.22 0.00e+00 7.459169e-04 4.020687e-04 1.161752e-04 -6.000000e+00 9.587206e-04 288.85 -2.00 20.00 -2.00 318.39 0.00e+00 2.693 0.000 302.00 328.00 3 4.6069e+00 4.5725e-03 3.0219e-02 -6.0000e+00 5.3775e-02 -2.4267e-02 5.3140e-03 1.7456e-02 -6.0000e+00 5.8022e-02 2.5398e-04 3.8008e-03 8.5657e-03 -6.0000e+00 3.4618e-02 -7.6596e-03 1.9795e-03 2.5337e-03 -6.0000e+00 1.4792e-02 2.9291e-04 -2.0730e-04 9.4422e-05 2.7520e-05 -6.0000e+00 1.0128e-03 -3.6379e-02 0.0000e+00 10 0 0 10 0 0 47.21 25.78 0.40 -0.03638 -0.03794 27 3 1 5 0 2044.420 33.00 19.99 25.78 40.05 3.9 1071.23 -11045 -13741 -13556 -7060 -11670 -10343 -9809 2163 -16343 4542 -14696 -9839 -3241 -7011 5541 1366 -462 -2149 609 2003 -2368 9379 -2680 -1929 -2751 -210 1606 -886 1407 -2222 -2312 3601 984 -1198 -3799 -4266 1648 432 -1420 -1987 -1282 -2989 -262 671 57 448 -451 -1208 -516 -59 1306 832 1678 1897 496 1044 -281 353 801 540 1474 1634 1567 947 14 545 1227 538 372 1296 481 380 313 86 -466 409 65 -208 -184 -796 -956 -1242 -1836 -1850 -1293 -199 -589 -515 364 160 564 272 41 301 1273 648 -217 490 -1 -219 -18 -795 -548 599 -100 -882 -84 -642 -465 236 534 -8 225 170 51 486 197 157 650 -158 -874 -526 -211 254 272 743 45 465 784 15 293 -226 94 -38 182 -294 -130 352 23 -309 188 -340 -272 -314 -463 -486 -234 -404 -330 -322 70 -724 178 -714 -466 -161 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