File name: Pandora25s1_HoustonTX_20220717_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T152534.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220717_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20220717 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20220717T122220.7Z 8233.515517 212 1 48.80 2 80.78 70.85 53.01 227.11 0.00 1 0.00 1 0 17 5.514e-01 2.286e-02 2.109e-01 5.424e-03 7.221613e-01 3.035980e-03 8.068727e-03 -6.000000e+00 3.226830e-01 230.02 -2.00 3.24 -2.00 321.43 0.00e+00 7.542002e-03 1.617023e-03 3.912574e-03 -6.000000e+00 1.602350e-02 294.25 -2.00 20.00 -2.00 320.76 0.00e+00 5.919 0.002 302.00 328.00 3 2.5552e+00 1.1323e-02 6.9955e-02 -6.0000e+00 8.0603e-01 2.8786e-01 1.5816e-02 3.9550e-02 -6.0000e+00 8.7538e-01 -4.2977e-01 1.4395e-02 2.3109e-02 -6.0000e+00 5.1959e-01 1.8294e-01 6.7230e-03 8.7556e-03 -6.0000e+00 2.2612e-01 5.3916e-05 -1.5338e-03 1.5142e-04 1.3805e-04 -6.0000e+00 1.6318e-02 -1.6133e-03 7.3193e-05 12 8 8 10 0 0 91.98 24.65 0.36 -0.00161 -0.01314 31 7 1 5 0 1573.740 27.15 20.00 24.65 33.60 26.4 1001.03 900000 900000 -164213 900000 -248161 -164337 900000 -138744 900000 -67291 -183716 900000 -168082 -487 -34657 900000 -6355 15821 92356 208593 182155 -23871 -112537 96594 -55307 4838 -96549 -321 -33618 -87326 900000 87700 45556 9886 -26945 94955 900000 900000 46766 -643 5654 70391 76947 34563 49728 27476 369 -11979 87357 -3503 40548 18715 3946 30045 19795 19874 24820 -11482 11193 -6427 20979 6647 7949 4101 3746 -1397 3037 3468 8911 9208 12279 9337 7032 -1395 12968 13247 -11998 -634 -2612 3915 -1447 -2580 -3585 10762 -4062 -2858 -1492 905 -3308 1729 -2125 -94 -764 -3665 -3110 -363 -2319 -1155 -35 -2310 279 -2837 -1310 -3850 1938 68 -1724 -2517 1096 624 -588 375 958 333 -470 116 -1132 3 -345 -240 679 1494 1938 1849 -363 1843 -339 2378 -381 403 647 -624 -84 1733 -749 -252 2 1064 -182 -559 589 -1552 -1174 900000 900000 -2887 900000 -8201 -2437 900000 -1874 900000 -520 -4467 900000 -5354 -4 -511 900000 -95 211 632 1101 962 -506 -5641 720 -1810 93 -4778 -6 -923 -4447 900000 1267 1117 350 -1280 1454 900000 900000 1753 -43 395 2879 3103 2109 2692 1877 33 -1270 3903 -391 3356 2106 555 3572 2713 2812 3410 -2182 1675 -1125 2984 1200 1617 967 926 -356 745 886 2410 2825 3977 3204 2413 -486 3620 3344 -3650 -181 -866 1444 -651 -1326 -2016 5624 -2575 -1897 -1020 621 -2347 1133 -1357 -56 -448 -2312 -2195 -288 -2140 -1189 -38 -2574 287 -2743 -1164 -3530 1798 67 -1826 -2863 1319 835 -868 577 1478 504 -690 165 -1641 5 -543 -389 1080 2290 2874 2672 -519 2515 -461 3301 -599 696 1206 -1239 -173 3697 -1712 -595 4 2560 -441 -1319 1315 -3359 -2469 SS 20220717T123219.9Z 8233.522452 217 1 49.51 2 78.72 71.96 54.56 229.40 0.00 1 0.00 1 0 25 3.383e-01 1.148e-02 1.245e-01 2.278e-03 6.177935e-01 1.220544e-03 6.937150e-03 -6.000000e+00 1.977113e-01 230.02 -2.00 3.24 -2.00 320.74 0.00e+00 9.447851e-03 5.365087e-04 2.527133e-03 -6.000000e+00 9.276470e-03 294.25 -2.00 20.00 -2.00 319.98 0.00e+00 4.934 0.001 302.00 328.00 3 2.2051e+00 4.0335e-03 5.7776e-02 -6.0000e+00 4.9380e-01 5.2704e-02 5.2958e-03 3.0723e-02 -6.0000e+00 5.3567e-01 -8.4966e-02 4.8084e-03 2.0220e-02 -6.0000e+00 3.1812e-01 2.9302e-02 2.3756e-03 1.0406e-02 -6.0000e+00 1.3496e-01 2.2134e-04 -7.3894e-04 6.3414e-05 1.2211e-04 -6.0000e+00 9.5271e-03 -2.4163e-03 8.6968e-05 12 8 8 10 0 0 -10.37 24.65 0.35 -0.00242 -0.00797 77 16 1 5 0 642.830 27.15 19.99 24.65 34.08 26.6 1003.91 -249621 25207 -36040 900000 -140252 -108007 900000 -105895 900000 -79110 -86407 102030 -72223 -26767 -37689 900000 7057 19223 13701 30991 12568 -18132 -57617 1551 -32768 300 -34394 -12376 -16655 -37940 29313 4183 13222 -2461 -7882 -1123 25653 27494 1497 -1102 -764 10499 9318 5811 6223 6830 -1511 -2306 10612 1923 7764 3204 1107 4075 4765 4254 3886 -3740 1026 -369 3384 -480 1288 3225 2019 443 2074 -560 2293 1067 3025 947 841 676 1976 2149 -4191 -1260 -1494 355 -1813 -1658 -2345 784 -1342 -1163 -448 -86 -207 691 364 668 -166 -1043 -618 -350 -391 15 -9 -519 135 -1347 -781 -1271 -331 -782 -1212 -1083 -130 2688 -26 48 647 55 37 -63 75 -55 -72 -264 -53 390 775 479 185 666 135 665 153 85 221 -232 -126 501 -235 -166 33 351 -110 -199 -37 -536 -284 -8727 75 -207 900000 -1938 -1097 900000 -1252 900000 -835 -1028 234 -1159 -364 -715 900000 118 317 257 521 255 -490 -2337 39 -1174 8 -1318 -383 -552 -1726 864 184 611 -137 -441 -60 1193 1483 123 -107 -82 1082 1026 683 751 848 -209 -334 1433 302 1280 609 233 894 1085 1003 935 -958 247 -91 848 -138 412 1121 732 159 728 -208 918 487 1465 481 421 322 859 853 -1676 -505 -674 183 -1083 -1100 -1676 573 -1056 -964 -383 -75 -180 580 290 502 -122 -799 -519 -331 -414 17 -11 -639 157 -1466 -800 -1327 -363 -898 -1459 -1372 -175 3844 -40 78 1036 86 56 -93 110 -83 -114 -435 -88 623 1205 727 273 957 191 966 242 146 402 -442 -247 1018 -502 -365 73 791 -249 -439 -78 -1106 -574 SS 20220717T123820.8Z 8233.526629 220 1 49.32 2 77.48 72.63 55.52 230.72 0.00 1 0.00 1 0 25 2.751e-01 6.728e-03 1.031e-01 1.666e-03 5.669806e-01 8.746224e-04 6.132961e-03 -6.000000e+00 1.595378e-01 230.02 -2.00 3.24 -2.00 320.35 0.00e+00 8.959692e-03 3.384985e-04 8.735142e-04 -6.000000e+00 7.417576e-03 294.25 -2.00 20.00 -2.00 319.54 0.00e+00 4.480 0.001 302.00 328.00 3 2.1423e+00 2.7338e-03 5.2427e-02 -6.0000e+00 3.9817e-01 1.0742e-02 3.4662e-03 2.7989e-02 -6.0000e+00 4.3171e-01 -1.9749e-02 3.0554e-03 1.7517e-02 -6.0000e+00 2.5745e-01 -1.7392e-04 1.5501e-03 1.1250e-02 -6.0000e+00 1.0947e-01 3.8307e-04 -4.5739e-04 4.6500e-05 1.0036e-04 -6.0000e+00 7.5165e-03 -2.1244e-03 7.1327e-05 11 9 0 11 8 0 81.71 24.63 0.28 -0.00212 -0.00556 105 22 1 5 0 469.610 27.15 20.00 24.63 34.26 26.4 1004.39 -143155 -43927 -36638 42399 -72048 -70016 209323 -96878 900000 -55245 -43718 9395 -48980 -9543 -30919 900000 -11141 -3475 -3518 13433 -9358 -1679 -36375 2351 -12636 9852 -22621 -6111 -15145 -20726 18287 3466 5038 -7524 -6537 -4894 13353 3937 2900 -3033 -799 929 2081 1414 2657 1826 -3223 -1232 1435 91 1903 2596 -585 3204 1440 1885 1659 -2068 359 -917 1218 -257 1794 1042 1527 -731 1170 -683 1313 679 1213 735 190 549 1267 931 -2722 -275 -1661 -72 -1119 -1051 -2008 -235 -1178 -644 109 166 398 760 829 909 455 -32 98 -3 261 41 376 -233 -99 -828 -815 -407 -433 -933 -1011 -968 -110 1790 9 280 297 181 -65 -11 -114 -438 -32 -345 -316 -36 365 193 347 556 158 785 19 341 195 -166 -37 387 -144 -96 -201 357 -6 -113 -10 -388 -236 -2712 -382 -314 169 -777 -739 340 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