File name: Pandora25s1_HoustonTX_20220512_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T145809.8Z 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_20220512_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: 20220512 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 20220512T120916.4Z 8167.506440 159 1 48.88 2 82.86 73.08 125.40 296.98 0.00 1 0.00 1 0 25 6.343e-01 3.395e-02 2.621e-01 1.009e-02 9.092031e-01 6.313470e-03 9.234866e-03 -6.000000e+00 3.926209e-01 230.84 -2.00 3.24 -2.00 322.14 0.00e+00 -2.979113e-03 3.934030e-03 4.784223e-03 -6.000000e+00 2.098079e-02 289.88 -2.00 20.00 -2.00 321.62 0.00e+00 7.393 0.005 302.00 328.00 3 1.8506e+00 2.7028e-02 9.1634e-02 -6.0000e+00 9.9572e-01 8.4437e-01 4.0291e-02 6.3869e-02 -6.0000e+00 1.0964e+00 -1.1425e+00 3.6538e-02 2.9225e-02 -6.0000e+00 6.3731e-01 4.5842e-01 1.5957e-02 7.4104e-03 -6.0000e+00 2.7257e-01 2.0821e-05 -2.1447e-03 2.9332e-04 9.9024e-05 -6.0000e+00 1.9995e-02 6.3907e-03 5.6860e-05 12 8 8 10 0 0 37.83 24.41 0.57 0.00639 -0.00973 27 6 1 5 0 1810.000 26.94 20.00 24.41 29.37 24.9 986.96 900000 900000 -10031 900000 -205198 900000 900000 900000 900000 -165777 -164250 900000 -120804 -37626 -5985 900000 900000 900000 900000 900000 900000 900000 93265 358191 23228 261347 -95385 -17450 -52345 -96807 900000 900000 900000 25507 -82470 900000 900000 900000 900000 -22024 2084 900000 900000 103306 900000 900000 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3662 4828 2834 -1115 -1621 -2564 -1536 -5627 2038 -77 -1976 1021 -217 563 2692 -4034 -2420 1695 -1257 -1672 -2738 -2672 2838 -5462 -1607 -5193 6068 812 -3532 -3212 4150 -3696 -1200 530 -1362 -204 -588 1353 -1696 -1394 -1569 -97 -1070 4028 6279 3674 -1403 5030 -734 2275 -2862 1094 1716 -636 -2361 9127 -2076 -2378 2839 1262 -719 121 2646 -6161 -3460 SS 20220512T122023.9Z 8167.514165 162 1 49.32 2 80.54 74.36 127.48 299.06 0.00 1 0.00 1 0 25 7.320e-01 3.427e-02 2.025e-01 2.749e-03 7.039465e-01 1.503824e-03 1.059054e-02 -6.000000e+00 4.308542e-01 230.84 -2.00 3.24 -2.00 321.31 0.00e+00 2.518674e-02 7.843876e-04 1.073316e-02 -6.000000e+00 2.039424e-02 289.88 -2.00 20.00 -2.00 320.68 0.00e+00 5.788 0.002 302.00 328.00 3 1.4369e+00 5.4295e-03 7.7367e-02 -6.0000e+00 1.0826e+00 6.0888e-01 6.8066e-03 4.9203e-02 -6.0000e+00 1.1771e+00 -9.1670e-01 5.3695e-03 2.6450e-02 -6.0000e+00 6.9555e-01 4.0098e-01 2.6091e-03 1.2208e-02 -6.0000e+00 2.9182e-01 1.7204e-04 -1.6269e-03 7.4670e-05 3.7345e-04 -6.0000e+00 2.0655e-02 6.0723e-03 3.9299e-05 12 9 8 11 8 0 49.42 24.41 0.43 0.00607 -0.00615 101 21 1 5 0 488.190 26.94 20.00 24.41 30.31 25.0 992.46 -196676 261836 237923 900000 126113 104807 900000 56548 900000 63860 63306 900000 37150 188420 130975 900000 230450 900000 170471 216127 184428 128613 87902 82183 54180 64478 65975 67646 85603 56776 289379 115206 136103 95313 60989 97592 109478 126050 67801 53177 35107 71827 67331 64796 68765 67184 43852 39666 58949 50592 54307 42250 37562 39609 29765 22972 21439 8419 15386 10047 19469 13811 18713 19894 17732 16641 12772 10126 11690 9798 6690 6026 2339 2262 1618 2392 -7115 -2315 290 781 171 -2334 -3051 -898 -3925 -5355 -3029 -3190 -2920 -1191 -1810 -3111 -4350 -6993 -6640 -3897 -3132 -1792 -1619 -1013 -471 -2028 -2419 -3526 -2758 -3065 -2850 -2429 -1112 3524 -639 -196 -69 -769 -450 -102 428 -112 722 1116 1810 3074 2979 2565 2138 2840 1803 2453 1318 1331 1564 1104 580 884 -76 -507 -431 -374 -556 -674 -440 -1715 -2209 -23102 701 637 900000 591 538 900000 416 900000 399 396 900000 498 757 1199 900000 1122 900000 1560 1254 1400 1579 1530 1431 1185 1238 1222 1223 1376 1445 986 2468 2673 2829 2341 2527 2688 2954 3254 3035 2560 3818 3953 4058 4293 4443 3804 3751 4809 4795 5460 5240 5224 5671 4419 3630 3388 1466 2428 1693 3207 2732 4067 4799 4535 4196 3318 2795 3522 3413 2587 2387 927 830 538 710 -2221 -727 103 312 81 -1281 -1826 -554 -2659 -3658 -2118 -2291 -2083 -855 -1219 -1989 -2741 -4782 -4869 -3288 -3089 -1896 -1855 -1148 -494 -2054 -2259 -3375 -2815 -3130 -3094 -2851 -1434 4643 -977 -298 -111 -1207 -670 -147 626 -174 1184 1789 2839 4827 4513 3768 3034 3865 2563 3467 2147 2333 3013 2169 1208 1859 -172 -1209 -1047 -879 -1362 -1581 -963 -3741 -4674 SS 20220512T122908.1Z 8167.520232 167 1 49.37 2 78.71 75.35 129.08 300.78 0.00 1 0.00 1 0 25 3.590e-01 5.148e-03 1.104e-01 1.425e-03 6.333702e-01 7.562875e-04 6.580211e-03 -6.000000e+00 2.072921e-01 230.84 -2.00 3.24 -2.00 320.68 0.00e+00 1.154213e-03 3.242336e-04 3.269861e-04 -6.000000e+00 9.414241e-03 289.88 -2.00 20.00 -2.00 319.98 0.00e+00 4.929 0.001 302.00 328.00 3 1.3246e+00 2.4420e-03 5.8067e-02 -6.0000e+00 5.1749e-01 -4.8902e-04 3.2129e-03 3.1226e-02 -6.0000e+00 5.6050e-01 -7.8889e-03 3.0492e-03 1.5608e-02 -6.0000e+00 3.3455e-01 -7.2160e-03 1.4996e-03 5.0635e-03 -6.0000e+00 1.4275e-01 5.4083e-04 -3.4494e-04 3.9218e-05 5.2401e-05 -6.0000e+00 9.8272e-03 5.6589e-03 5.4239e-05 10 0 0 10 0 0 51.83 24.42 0.31 0.00566 0.00307 200 42 1 5 0 246.780 26.94 19.99 24.42 31.14 25.1 996.55 900000 -32200 -93123 -25581 -126191 -75073 328914 -104365 14171 -78736 -83579 -42536 -43895 -31362 -14449 -43395 1218 2638 1568 -1974 -9220 -10401 -26624 -9195 -19094 -3580 -19673 -10829 -12605 -16483 10746 2942 1796 -5140 -11157 -2821 4501 6873 1137 -4853 -2694 778 1213 -1095 2826 41 -1873 -2705 1006 906 2739 -65 -271 1666 825 1231 1336 -625 791 783 1162 333 1848 2133 828 687 -324 -1006 1447 956 900 976 773 578 1444 -188 -2546 -1341 -431 -312 -1041 -1174 -1684 -423 -980 -676 -40 424 630 965 858 753 451 -191 -414 73 444 390 86 -154 -64 -814 -640 -660 -372 -906 -598 -740 -367 1505 -30 247 101 175 -42 357 69 -29 -211 -230 -331 -70 107 95 323 311 166 468 284 246 218 -209 -168 -55 34 -147 22 212 -112 -106 166 -180 -175 900000 -134 -690 -100 -1169 -474 457 -1075 55 -775 -929 -374 -503 -407 -197 -934 19 45 29 -40 -208 -243 -795 -257 -641 -109 -708 -346 -414 -634 379 123 87 -277 -615 -148 253 460 100 -499 -302 90 147 -139 352 5 -257 -390 148 145 484 -13 -61 398 197 306 341 -161 196 194 302 98 608 777 314 253 -121 -396 628 449 461 516 401 282 636 -81 -1068 -576 -196 -168 -658 -793 -1242 -328 -819 -567 -35 378 555 810 711 585 341 -153 -354 71 476 475 106 -188 -77 -885 -683 -687 -416 -1074 -748 -944 -513 2196 -47 400 162 271 -64 524 103 -46 -336 -381 -542 -110 171 145 474 462 240 677 463 431 398 -406 -328 -115 72 -329 51 474 -250 -235 347 -372 -353 SS 20220512T123507.1Z 8167.524388 170 1 49.42 2 77.45 76.03 130.16 302.00 0.00 1 0.00 1 0 17 2.267e-01 9.701e-03 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