File name: Pandora253s1_TucsonAZ_20241114_L2Fit_fout2c1d20230118p1-8.txt File generation date: 20241115T071733.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Armin Sorooshian Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 253 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora253_OF_v3d20221208.txt Instrument calibration file used: Pandora253s1_CF_v1d20230118.txt Level 1 file used: Pandora253s1_TucsonAZ_20241114_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: 20241114 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 20241114T142406.0Z 9084.600069 233 1 54.55 2 84.75 115.70 111.87 305.27 0.00 1 0.00 1 0 25 5.309e-01 2.189e-02 4.435e-01 1.644e-02 8.566674e-01 9.905816e-03 9.229479e-03 -6.000000e+00 3.107332e-01 224.37 -2.00 3.29 -2.00 322.35 0.00e+00 1.306359e-03 6.097761e-03 8.258308e-03 -6.000000e+00 1.469141e-02 282.47 -2.00 20.00 -2.00 321.91 0.00e+00 9.483 0.011 302.00 328.00 3 1.0137e-01 4.1479e-02 1.0840e-01 -6.0000e+00 7.7008e-01 1.0494e+00 5.8131e-02 8.0865e-02 -6.0000e+00 8.3943e-01 -1.3778e+00 5.1434e-02 3.6411e-02 -6.0000e+00 4.9650e-01 5.4557e-01 2.3113e-02 8.0431e-03 -6.0000e+00 2.1303e-01 3.8637e-05 -2.0718e-03 4.9940e-04 1.5766e-04 -6.0000e+00 1.5251e-02 -3.4625e-02 0.0000e+00 12 8 8 10 0 0 22.19 25.17 1.17 -0.03462 -0.05019 63 6 1 5 0 865.770 32.75 20.01 25.17 17.80 4.1 907.40 90779 900000 20779 -21969 -72223 900000 -148297 -62541 900000 -170183 -124239 900000 -108784 900000 -52926 -26049 42946 900000 172850 -876 71383 134161 29399 -31847 116199 -20685 82601 -281 -26255 900000 -66637 156389 114862 900000 204250 22816 67184 900000 57055 94726 37535 129882 54610 50658 33579 46957 19125 40827 56610 85753 33679 100689 91785 43677 34560 19626 63252 35554 -5164 13670 37380 47181 9338 892 25602 22069 8996 11897 54767 23104 2301 15706 -8626 18211 18473 10302 -3059 1260 6099 -9695 -12482 -6808 -3083 -2948 -747 3014 2159 -5629 2865 7324 3152 2591 5373 1605 -1301 489 -1374 1453 1743 -2424 -3293 -2442 -2620 -2593 -3512 -1844 -6827 -1269 -376 -1805 1105 -1119 -1376 419 3384 -724 698 -3057 747 -391 -703 481 1258 2212 1732 855 892 2300 1774 -1375 986 767 778 97 -90 -15 -58 40 116 -633 434 -254 -1417 1453 900000 333 -352 -1348 900000 -4944 -1001 900000 -7943 -3976 900000 -3640 900000 -1540 -682 687 900000 2766 -22 1142 2147 470 -973 1860 -602 1322 -6 -688 900000 -3005 2503 1838 900000 3269 564 1075 900000 1328 1792 1420 2079 1907 1842 1417 1708 918 1604 1977 2370 1715 2930 3205 2669 2464 1685 3589 2638 -548 1134 2393 2883 937 112 2756 2504 1152 1523 4940 3260 449 2833 -1983 3322 3045 1632 -504 198 1005 -2234 -3556 -2146 -1061 -1094 -288 1191 905 -2639 1242 2965 1256 974 1900 606 -566 247 -838 1012 1375 -2098 -2788 -1872 -1795 -1680 -2400 -1328 -5474 -1038 -338 -1883 1289 -1488 -1934 581 4435 -955 901 -4256 1059 -588 -1064 693 1718 2902 2218 1074 1091 2830 2470 -2309 1845 1588 1732 233 -233 -41 -165 117 338 -1811 1151 -628 -3344 SS 20241114T143557.1Z 9084.608300 236 1 54.89 2 82.51 117.41 113.76 307.41 0.00 1 0.00 1 0 25 3.821e-01 5.649e-03 2.675e-01 2.756e-03 7.068069e-01 1.536965e-03 7.358249e-03 -6.000000e+00 2.188896e-01 224.37 -2.00 3.29 -2.00 321.63 0.00e+00 3.510698e-03 8.329978e-04 7.546588e-04 -6.000000e+00 9.946738e-03 282.47 -2.00 20.00 -2.00 321.13 0.00e+00 7.114 0.005 302.00 328.00 3 9.7188e-02 5.5682e-03 7.3791e-02 -6.0000e+00 5.4083e-01 1.5077e-01 8.4035e-03 3.7940e-02 -6.0000e+00 5.8733e-01 -1.6661e-01 9.1465e-03 2.0879e-02 -6.0000e+00 3.4975e-01 5.4321e-02 4.2223e-03 8.5632e-03 -6.0000e+00 1.5041e-01 3.8541e-04 -9.0758e-04 8.0656e-05 9.0978e-05 -6.0000e+00 1.0518e-02 -3.5790e-02 0.0000e+00 10 0 0 10 0 0 46.92 25.17 0.50 -0.03579 -0.04261 237 22 1 5 0 231.590 32.75 19.99 25.17 18.48 4.1 912.26 -220610 -73716 -61814 10005 -88475 -57488 32332 -109777 -188010 900000 -55044 -109378 -76588 -72002 -122815 -92367 -86057 -43162 -13105 -46746 -35991 -10130 -57826 -34494 -14791 -18312 -49264 -44079 -39626 -37142 -52931 -9757 -22846 -5621 -758 -20324 5683 -8139 -6708 -8403 3912 -5391 -253 3134 317 1208 2724 7549 -290 -3656 -241 4305 1898 5622 1647 2707 -678 1698 -573 163 1997 2923 3742 4504 3429 1052 3262 2582 1639 1735 1089 3053 1701 717 1030 -384 188 -3821 -756 78 -1910 -2048 -577 -755 -15 -100 301 -473 39 355 377 1250 -548 -164 -205 -622 -636 447 613 -83 -336 -855 -545 357 -1118 -1262 -838 -880 -408 209 -7 92 521 542 8 196 312 643 -11 -347 -543 150 380 155 8 3 64 900 752 113 36 -76 -65 4 -79 -373 -209 306 121 -240 -44 -29 81 -1509 -198 -166 27 -238 -154 87 -375 -1608 900000 -148 -561 -356 -422 -1560 -1083 -1114 -411 -102 -548 -396 -87 -819 -421 -163 -224 -855 -794 -671 -649 -1280 -189 -602 -140 -18 -573 131 -252 -251 -391 187 -311 -15 185 20 76 175 481 -21 -296 -21 405 204 641 211 362 -98 241 -82 22 274 429 620 851 720 229 686 561 389 472 337 991 566 231 305 -104 46 -971 -203 25 -732 -914 -285 -403 -8 -60 192 -316 26 232 233 717 -306 -92 -126 -446 -534 431 661 -93 -367 -855 -490 305 -1020 -1234 -861 -968 -488 278 -10 137 797 817 12 271 426 905 -17 -548 -866 231 559 222 12 4 90 1280 1185 186 66 -152 -138 9 -192 -965 -559 829 331 -644 -112 -69 183 SS 20241114T144630.4Z 9084.615630 239 1 54.82 2 80.54 118.98 115.40 309.38 0.00 1 0.00 1 0 25 2.404e-01 4.833e-03 6.062e-02 1.155e-03 5.987566e-01 6.122620e-04 6.379773e-03 -6.000000e+00 1.375538e-01 224.37 -2.00 3.29 -2.00 320.91 0.00e+00 3.234787e-03 2.727341e-04 7.702048e-04 -6.000000e+00 6.107171e-03 282.47 -2.00 20.00 -2.00 320.35 0.00e+00 5.798 0.003 302.00 328.00 3 4.9894e-02 1.9802e-03 6.0468e-02 -6.0000e+00 3.3914e-01 6.4901e-02 2.6801e-03 3.1175e-02 -6.0000e+00 3.6804e-01 -5.5560e-02 2.7363e-03 1.5972e-02 -6.0000e+00 2.1985e-01 1.0266e-02 1.3343e-03 6.8389e-03 -6.0000e+00 9.4615e-02 1.3989e-03 -7.4295e-04 3.3576e-05 6.4643e-05 -6.0000e+00 6.6166e-03 -3.6685e-02 0.0000e+00 10 0 0 10 0 0 28.23 25.16 0.44 -0.03668 -0.04227 478 45 1 5 0 114.670 32.75 19.99 25.16 19.32 4.0 918.25 -74061 -102915 -62597 -88336 -52605 -87510 -95669 -70921 -65808 -64661 -57486 -70277 -53754 -54613 -21134 -16743 -10938 -16214 -16640 -9417 -16624 -2269 -11559 -14861 -17547 -14596 -15482 -14449 -9558 -7539 -7046 -1001 -5416 -3394 -4206 -5531 -9023 -4920 -2689 -934 -2418 -629 -408 -1590 1525 422 -11 -47 -1613 1423 1493 382 1520 2092 924 1491 868 158 -436 825 323 1431 2552 2457 1892 1477 569 575 933 1199 1176 673 440 406 53 -469 -325 -1520 -1462 -1064 -1233 -748 -1383 -1514 -1042 -536 -303 114 399 684 755 702 279 670 628 -177 523 716 247 -184 -212 -212 -249 47 -654 -1492 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