File name: Pandora25s1_HoustonTX_20220721_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T152532.3Z 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_20220721_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: 20220721 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 20220721T121350.4Z 8237.509611 216 1 48.98 2 82.92 70.50 18.70 148.29 0.00 1 0.00 1 0 25 8.029e-01 3.932e-02 2.888e-01 8.503e-03 8.735914e-01 5.125210e-03 9.656912e-03 -6.000000e+00 4.816414e-01 229.94 -2.00 3.24 -2.00 322.05 0.00e+00 1.865435e-03 3.111113e-03 7.799526e-03 -6.000000e+00 2.642159e-02 294.30 -2.00 20.00 -2.00 321.50 0.00e+00 7.445 0.005 302.00 328.00 3 1.5328e+00 2.1558e-02 9.4916e-02 -6.0000e+00 1.2113e+00 9.6197e-01 2.9251e-02 6.8107e-02 -6.0000e+00 1.3286e+00 -1.3681e+00 2.2589e-02 2.7770e-02 -6.0000e+00 7.8360e-01 5.6902e-01 1.0361e-02 6.2235e-03 -6.0000e+00 3.3102e-01 2.8177e-05 -3.3056e-03 2.4154e-04 1.5211e-04 -6.0000e+00 2.4088e-02 -2.2251e-03 1.0694e-04 12 9 8 11 8 0 25.87 24.56 0.55 -0.00223 -0.02707 33 7 1 5 0 1483.850 27.05 19.99 24.56 33.60 26.1 1001.47 -137495 900000 -13345 900000 -95833 -129447 900000 81543 900000 154857 -125130 900000 -86505 255205 463298 900000 900000 900000 900000 900000 900000 14136 -9955 900000 -18400 900000 -37427 900000 36629 -96035 900000 900000 105228 31520 -2449 153242 900000 900000 253947 31659 36528 900000 900000 125176 253729 287596 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-251 -3151 1126 -99 -2834 -168 -1640 549 -2352 -4087 -4888 -1934 -4774 -3544 -2714 -5375 511 -4610 -2596 -6093 821 -106 -2183 -6299 580 20154 -3437 -2942 721 685 -160 1397 167 -1706 -1558 -70 1762 6302 2208 2821 -462 3539 2024 2346 -3463 218 940 -2033 -138 7091 -2366 -1438 2186 2086 -418 -2359 4484 -6325 -3648 SS 20220721T122453.2Z 8237.517283 219 1 49.47 2 80.65 71.76 17.56 155.96 0.00 1 0.00 1 0 25 4.634e-01 8.616e-03 1.575e-01 2.353e-03 7.171843e-01 1.295757e-03 7.518016e-03 -6.000000e+00 2.700668e-01 229.94 -2.00 3.24 -2.00 321.23 0.00e+00 2.103435e-03 6.734733e-04 1.240001e-03 -6.000000e+00 1.339848e-02 294.30 -2.00 20.00 -2.00 320.54 0.00e+00 5.850 0.002 302.00 328.00 3 1.2466e+00 4.7148e-03 6.7824e-02 -6.0000e+00 6.7413e-01 3.7966e-02 6.7137e-03 3.5530e-02 -6.0000e+00 7.3163e-01 -5.2452e-02 6.5953e-03 1.8852e-02 -6.0000e+00 4.3364e-01 1.2701e-02 3.1080e-03 6.2472e-03 -6.0000e+00 1.8797e-01 2.2664e-04 -6.7516e-04 6.4420e-05 7.5158e-05 -6.0000e+00 1.3110e-02 -1.8614e-03 8.7693e-05 11 8 0 10 0 0 28.57 24.55 0.30 -0.00186 -0.00693 123 26 1 5 0 402.100 27.05 20.01 24.55 34.44 26.1 1005.42 900000 900000 -125352 900000 -126406 -254634 900000 -216867 900000 -141426 -179158 900000 -137570 -5257 -42275 58742 -27911 122670 -49787 131493 -29165 -46818 -77670 8305 -43708 47871 -56696 13661 -26017 -46447 37035 8707 7347 -10755 -9820 -11239 27194 24196 981 -1523 -5686 9307 14549 8164 7228 6442 -3452 -2558 10613 2109 3578 5414 -1716 7126 2932 4496 3680 -3604 2053 -2682 2463 -1533 2747 -790 1423 -824 1726 -1193 1140 1790 2412 2235 1294 -34 3678 3351 -5784 -370 -2326 1198 -1778 -1110 -2222 1579 -694 -833 -542 -114 404 543 608 796 591 -891 -158 -682 36 64 171 -556 134 -1084 -850 -1231 -586 -490 -1033 -974 -444 2905 -135 -36 296 156 132 397 107 -315 -80 -462 14 38 701 9 39 328 100 333 -47 136 181 29 -291 370 -249 -189 -147 278 -46 -9 22 -140 -161 900000 900000 -553 900000 -513 -3585 900000 -2769 900000 -1147 -2141 900000 -1734 -25 -373 228 -295 324 -750 371 -392 -766 -1882 102 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-6.0000e+00 3.2058e-01 -7.6162e-03 2.4042e-03 1.5200e-02 -6.0000e+00 1.9202e-01 -6.0359e-03 1.1990e-03 5.2544e-03 -6.0000e+00 8.2568e-02 7.4839e-04 -3.2987e-04 3.2690e-05 5.3839e-05 -6.0000e+00 5.6563e-03 -2.3992e-03 8.0922e-05 10 0 0 10 0 0 51.31 24.57 0.29 -0.00240 -0.00488 251 53 1 5 0 197.190 27.05 19.99 24.57 35.01 26.3 1008.78 900000 -51275 -105322 -5179 -107339 -93664 -34183 -24162 -45423 5639 -90143 -11631 -58827 -28528 -36403 55342 -8820 -16220 -2334 -9584 -5469 -26493 -12639 -18228 -6689 -11362 -12004 -15396 -9683 -15271 1991 148 -3352 617 -10778 -1967 848 6596 -2295 -347 -3040 2021 1316 -248 1321 176 -1044 -1682 2926 -1431 2782 530 1055 2098 2170 1202 1620 -1131 915 -490 1235 797 439 2094 778 907 35 101 0 1210 606 623 611 169 930 125 -1950 -1216 -619 -823 -607 -1057 -1590 -722 -872 -750 -13 210 502 756 568 1009 134 97 -16 132 477 606 -110 -11 -169 -651 -619 -549 -760 -910 -623 -713 23 912 273 162 455 144 -4 145 122 -127 -330 -217 -464 60 8 241 231 290 122 753 236 377 128 -245 -250 -32 -114 -151 31 271 69 -110 81 -178 -217 900000 -291 -1086 -20 -1011 -793 -191 -142 -354 30 -1268 -88 -916 -421 -726 521 -178 -369 -50 -235 -132 -803 -359 -606 -216 -407 -437 -562 -336 -624 82 7 -189 35 -656 -113 54 480 -215 -38 -380 258 178 -35 186 26 -159 -267 466 -246 514 112 243 521 570 318 439 -313 254 -137 341 246 155 809 314 355 14 41 0 605 320 340 328 90 445 55 -819 -521 -299 -452 -387 -739 -1215 -559 -725 -664 -12 191 453 676 474 815 106 77 -14 131 522 726 -138 -13 -202 -730 -644 -585 -873 -1069 -771 -915 31 1362 424 263 734 230 -6 217 185 -196 -524 -358 -762 97 12 365 347 419 177 1097 376 651 235 -465 -485 -65 -244 -331 69 599 153 -240 172 -366 -435 SS 20220721T124009.9Z 8237.527893 227 1 49.44 2 77.49 73.47 16.49 167.93 0.00 1 0.00 1 0 17 2.255e-01 1.919e-02 2.569e-02 8.584e-04 5.590844e-01 4.451753e-04 6.225623e-03 -6.000000e+00 1.299435e-01 229.94 -2.00 3.24 -2.00 320.14 0.00e+00 6.995310e-03 1.592191e-04 2.021886e-03 -6.000000e+00 5.983127e-03 294.30 -2.00 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