File name: Pandora25s1_HoustonTX_20230915_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T222255.4Z 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 v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20230915_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: 20230915 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 20230915T130018.1Z 8658.541876 54 1 8.81 2 79.05 92.82 84.86 89.82 0.00 1 0.00 1 0 25 3.455e-01 1.615e-02 2.310e-01 9.099e-03 5.990010e-01 4.935855e-03 6.503645e-03 -6.000000e+00 2.039633e-01 228.51 -2.00 3.24 -2.00 320.67 0.00e+00 -6.497613e-04 2.057138e-03 7.717660e-04 -6.000000e+00 9.557098e-03 293.56 -2.00 20.00 -2.00 319.91 0.00e+00 5.068 0.002 302.00 328.00 3 2.9208e+00 1.5945e-02 5.8097e-02 -6.0000e+00 5.0934e-01 7.9530e-02 2.0915e-02 2.9610e-02 -6.0000e+00 5.5428e-01 -1.3017e-01 1.8544e-02 1.4597e-02 -6.0000e+00 3.2933e-01 5.2895e-02 9.1413e-03 4.1090e-03 -6.0000e+00 1.4018e-01 1.0020e-04 -2.8704e-03 2.6092e-04 4.9814e-05 -6.0000e+00 9.7761e-03 -2.7674e-02 -3.3447e-05 12 9 9 12 1 1 -36.40 24.78 0.41 -0.02767 -0.04924 5 7 1 5 0 1466.910 27.26 20.00 24.78 31.38 30.2 1096.80 900000 -42091 37739 900000 -120885 -35041 900000 -144831 900000 -157681 -121931 46409 -131995 -78735 -24810 900000 900000 900000 -42372 -3869 -19082 61854 -26687 93359 -48658 22125 -48062 19318 -22098 -50099 59298 -7428 22168 -2750 557 -3471 52847 119701 25414 2942 19521 17015 1985 3046 12928 11213 -3990 -3494 8982 798 3939 3571 6881 7387 5949 12222 10285 -7137 717 3042 274 -6882 4659 45 -855 -24 2460 -2473 7444 2332 298 3109 1221 673 3576 2399 -11511 2683 -3789 4186 -2123 -548 -3662 3510 -2426 -1619 -1399 -775 22 1716 1983 1520 1995 -2371 -1100 852 -45 -195 -274 -1603 -247 -1893 -1351 -3481 1037 -211 -668 -23 -196 -1081 171 769 451 137 631 1104 833 -437 -378 -906 -200 61 1051 536 1007 -130 770 586 -2 954 643 447 190 553 -778 -249 -406 828 -49 -895 34 -996 219 900000 -373 334 900000 -1868 -311 900000 -3519 900000 -5345 -3098 411 -4986 -2234 -518 900000 900000 900000 -1586 -106 -622 949 -991 1235 -2654 663 -2816 584 -954 -2961 1457 -397 1026 -171 32 -209 2068 2970 1850 314 2004 1913 268 416 1624 1453 -605 -539 1281 130 686 693 1411 1631 1411 2859 2527 -2064 189 770 73 -2120 1445 16 -323 -9 865 -929 2787 1036 148 1575 628 334 1606 991 -5024 1030 -1678 1990 -1222 -349 -2599 2473 -1902 -1336 -1203 -682 20 1449 1582 1149 1445 -1800 -896 765 -46 -220 -331 -1978 -290 -2086 -1385 -3620 1100 -237 -787 -29 -258 -1547 262 1222 723 216 947 1594 1199 -655 -591 -1478 -327 97 1627 813 1478 -187 1071 827 -3 1574 1136 828 365 1099 -1634 -541 -900 1849 -112 -1995 73 -2062 438 SS 20230915T130607.9Z 8658.545925 57 1 49.49 2 77.78 93.56 83.63 90.55 0.00 1 0.00 1 0 25 2.436e-01 7.500e-03 8.358e-02 2.006e-03 5.422735e-01 1.046986e-03 5.839037e-03 -6.000000e+00 1.401613e-01 228.51 -2.00 3.24 -2.00 320.24 0.00e+00 2.421341e-03 3.843095e-04 2.123647e-04 -6.000000e+00 6.445932e-03 293.56 -2.00 20.00 -2.00 319.43 0.00e+00 4.584 0.001 302.00 328.00 3 2.4285e+00 3.2178e-03 5.2518e-02 -6.0000e+00 3.4756e-01 1.5828e-02 4.0446e-03 2.6578e-02 -6.0000e+00 3.7605e-01 -3.3883e-02 3.4645e-03 1.3268e-02 -6.0000e+00 2.2539e-01 6.7438e-03 1.7663e-03 4.9842e-03 -6.0000e+00 9.7031e-02 2.7619e-04 -8.9016e-04 5.6771e-05 4.8722e-05 -6.0000e+00 6.6246e-03 -3.1071e-02 1.3689e-04 11 8 0 10 0 0 99.64 24.78 0.32 -0.03107 -0.03776 84 18 1 5 0 589.050 27.26 20.00 24.78 31.63 30.2 1098.24 -144723 -19601 -83036 29547 -83677 -54617 106040 -77704 16797 -31707 -78859 38822 -55830 -16978 -27145 92553 5563 23667 -5333 -10928 7666 -9497 -2639 -4846 -7811 -8532 -10616 -2564 -12006 -19042 6035 10968 3341 4677 -9304 7987 1384 19737 631 -1713 -2902 1825 -2760 -392 2740 894 -1042 -4134 7987 -989 4452 -59 2240 2119 2603 1876 3031 -1667 445 -128 -193 276 364 1459 -350 1283 13 -162 1151 1601 527 934 661 531 1687 -222 -2591 -958 101 -610 -736 -1400 -1458 -1028 -685 -1163 -1 47 238 919 931 906 332 87 -304 293 -71 637 131 -316 -458 -910 -902 -1329 -36 -903 -438 -1047 355 102 156 350 479 615 62 230 -153 -40 -418 -182 -690 60 151 350 238 934 -58 992 251 288 573 -152 128 241 -107 -218 -27 69 -19 -427 124 -306 -220 -3649 -177 -1450 173 -1319 -650 294 -1417 142 -457 -1831 333 -1422 -374 -802 1047 157 617 -195 -444 270 -394 -108 -219 -389 -451 -582 -127 -637 -1141 330 665 247 362 -790 576 116 1652 76 -248 -473 304 -503 -72 494 167 -201 -840 1499 -212 992 -15 608 618 795 598 982 -564 145 -41 -65 100 147 639 -161 568 6 -72 546 852 308 567 401 310 913 -112 -1246 -453 51 -354 -485 -1029 -1152 -849 -595 -1071 -1 46 232 872 840 772 273 72 -272 288 -78 763 168 -408 -567 -1056 -987 -1463 -41 -1094 -550 -1380 491 152 247 573 783 978 94 339 -226 -61 -664 -299 -1148 97 240 545 360 1369 -83 1432 388 481 1013 -281 243 473 -218 -464 -58 150 -43 -927 261 -623 -437 SS 20230915T131144.2Z 8658.549817 60 1 49.38 2 76.57 94.27 82.46 91.24 0.00 1 0.00 1 0 25 1.025e-01 5.376e-03 2.778e-02 1.376e-03 5.020171e-01 7.142854e-04 5.431872e-03 -6.000000e+00 5.899588e-02 228.51 -2.00 3.24 -2.00 319.87 0.00e+00 1.256779e-03 2.314962e-04 1.912236e-04 -6.000000e+00 2.728200e-03 293.56 -2.00 20.00 -2.00 319.03 0.00e+00 4.199 0.001 302.00 328.00 3 2.1604e+00 2.1131e-03 4.8224e-02 -6.0000e+00 1.4628e-01 -3.0457e-03 2.5816e-03 2.4464e-02 -6.0000e+00 1.5832e-01 -9.4272e-03 2.1025e-03 1.1991e-02 -6.0000e+00 9.4886e-02 -3.9590e-03 1.0929e-03 3.7681e-03 -6.0000e+00 4.1097e-02 5.4640e-04 -7.3390e-04 3.9376e-05 4.0142e-05 -6.0000e+00 2.8055e-03 -3.1140e-02 1.2328e-04 10 0 0 10 0 0 99.02 24.78 0.19 -0.03114 -0.03666 151 32 1 5 0 326.990 27.26 20.00 24.78 31.93 30.2 1100.00 900000 -16235 -40772 -10223 -19634 -55724 23901 -52288 24477 -41270 -31750 -20166 -19917 -14956 -6627 -19286 -1061 4454 -6551 -1685 -4071 3910 -4714 2415 -10715 878 -10117 -1682 -6712 -8178 1917 4127 1139 -461 -2583 -2423 2009 6458 1290 -3344 -1056 -1198 -1176 -192 1298 39 -1125 -917 1025 -273 909 1177 -305 2658 363 1933 1263 -360 822 4 413 140 1012 1432 1412 37 772 -1070 1310 616 960 649 581 356 794 116 -1597 -568 -698 -459 -1189 -803 -1679 -1090 -1143 -478 -252 133 420 892 883 833 666 91 530 66 203 352 329 -492 -193 -939 -762 -605 -583 -846 -812 -621 -35 338 75 538 234 119 20 490 24 112 -168 -205 -499 -306 236 74 278 547 347 817 517 296 372 -8 -77 159 -77 -38 -245 191 -84 -176 -106 -168 -240 900000 -221 -752 -134 -259 -1042 235 -1119 294 -971 -704 -441 -530 -470 -234 -851 -43 187 -330 -85 -217 194 -267 139 -762 59 -768 -113 -460 -598 145 336 109 -47 -259 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