File name: Pandora25s1_HoustonTX_20230910_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T222343.5Z 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_20230910_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: 20230910 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 20230910T130407.3Z 8653.544529 185 1 4.78 2 77.66 91.38 28.54 90.78 0.00 1 0.00 1 0 25 4.596e-01 2.746e-02 3.103e-01 1.957e-02 5.792153e-01 1.073647e-02 6.276164e-03 -6.000000e+00 2.737013e-01 228.67 -2.00 3.24 -2.00 320.45 0.00e+00 2.988049e-03 4.152578e-03 1.152408e-03 -6.000000e+00 1.408229e-02 293.74 -2.00 20.00 -2.00 319.67 0.00e+00 4.542 0.001 302.00 328.00 3 3.7454e+00 3.3758e-02 5.3684e-02 -6.0000e+00 6.8156e-01 1.6112e-01 4.3204e-02 3.0599e-02 -6.0000e+00 7.4103e-01 -1.8309e-01 3.6640e-02 1.3998e-02 -6.0000e+00 4.3864e-01 7.8769e-02 1.8311e-02 6.5888e-03 -6.0000e+00 1.8748e-01 6.8948e-05 -1.4083e-03 5.6932e-04 5.4067e-05 -6.0000e+00 1.3246e-02 -3.3037e-02 2.0349e-04 12 9 9 12 1 1 999.00 24.67 0.37 -0.03304 -0.04362 1 4 1 5 0 2388.470 27.15 19.99 24.67 32.38 30.2 1100.00 -189759 900000 -177515 900000 900000 900000 900000 -63640 900000 -132350 -46914 43064 900000 -36442 111934 900000 51314 900000 900000 -1844 -37715 288124 900000 69053 -12554 128966 -62067 900000 38499 -29171 -17383 35949 112932 6955 35752 15305 10461 99199 60053 -26554 15749 4621 5157 9411 74474 12118 -17256 6159 22433 18295 20607 19831 7309 21682 9497 20827 30 -5274 4857 5064 -6841 859 1859 10583 -2326 -1180 5313 -3688 3387 2445 -3610 -1094 697 -3859 63 5870 -9775 1983 -955 -1803 -559 -799 -7280 8132 740 -6238 670 1659 -4164 68 1976 -454 5981 -2794 -1757 1425 -414 -167 1377 -2994 1774 -2672 194 -3306 997 2471 -2239 129 -386 1573 -2628 1290 1431 529 170 817 209 -1233 -1148 -3305 1217 -467 2548 -288 1269 1063 1375 2579 -815 2489 -1673 -766 764 2674 -1353 85 1646 342 -527 -1088 -291 -1265 -615 -8217 900000 -8345 900000 900000 900000 900000 -1212 900000 -4986 -893 820 900000 -968 2131 900000 977 900000 900000 -68 -1983 5486 900000 1495 -617 2456 -5130 900000 1184 -1772 -1089 1599 2798 489 1851 942 732 3562 3728 -4345 1939 673 781 1400 6120 1808 -3435 1007 3254 2903 3494 3744 1679 4692 2420 4952 9 -1632 1338 1372 -2121 269 645 3752 -969 -474 1961 -1499 1397 1149 -1961 -606 379 -2092 31 2467 -4396 798 -428 -936 -329 -527 -5492 5667 580 -5482 581 1468 -3874 60 1612 -356 4248 -2149 -1448 1280 -423 -189 1655 -3757 2055 -2972 196 -3430 1056 2718 -2664 158 -505 2195 -4070 2026 2255 818 253 1160 297 -1823 -1772 -5387 1930 -735 3822 -430 1816 1478 1852 3477 -1212 3929 -2909 -1383 1410 5046 -2746 177 3468 737 -1146 -2331 -597 -2513 -1182 SS 20230910T130818.9Z 8653.547441 188 1 8.09 2 76.75 91.91 27.65 91.33 0.00 1 0.00 1 0 25 2.379e-01 8.361e-03 1.747e-01 4.896e-03 5.299354e-01 2.552706e-03 5.695001e-03 -6.000000e+00 1.369960e-01 228.67 -2.00 3.24 -2.00 319.99 0.00e+00 1.843853e-03 8.660688e-04 2.197265e-04 -6.000000e+00 6.336419e-03 293.74 -2.00 20.00 -2.00 319.16 0.00e+00 4.252 0.001 302.00 328.00 3 2.7070e+00 7.6314e-03 4.9393e-02 -6.0000e+00 3.3979e-01 6.0859e-03 9.4648e-03 2.5868e-02 -6.0000e+00 3.6771e-01 -2.1191e-02 7.9711e-03 1.2798e-02 -6.0000e+00 2.2037e-01 2.4637e-03 4.1058e-03 4.4861e-03 -6.0000e+00 9.5433e-02 2.8867e-04 -5.8142e-04 1.3837e-04 4.3940e-05 -6.0000e+00 6.5112e-03 -3.1491e-02 1.0811e-04 12 9 1 12 1 1 92.66 24.67 0.47 -0.03149 -0.03586 9 13 1 5 0 809.000 27.15 20.00 24.67 32.50 30.1 1100.00 900000 50888 -70740 52522 -3647 -55399 24973 -79853 181650 -70374 -87220 2691 -44731 10866 -27477 63806 193 18271 -572 4649 24502 3627 20258 -16186 -15879 -17276 -12789 1375 -7548 -4358 12426 9990 -4629 -1424 -10522 -531 7632 17115 -8667 -1631 -1214 1524 -2606 82 2279 105 -4560 -4352 7521 2010 2735 -3951 -743 3315 3621 2008 928 -1481 164 454 3 2342 509 298 -230 866 286 264 2765 2130 248 1475 1650 -1087 997 982 -1456 -294 585 -204 -1764 -2078 -2163 -783 -417 -996 -118 856 374 1592 1274 1136 608 -778 232 135 -215 253 98 -1198 -130 -551 -886 -1059 77 -1075 -969 -1047 171 -57 -408 435 405 198 288 475 240 277 -662 -127 -515 -60 183 627 464 423 -96 805 879 690 504 -108 -399 293 379 -147 -16 268 -205 -513 -366 -390 7 900000 272 -1296 285 -31 -778 177 -1761 867 -1725 -2602 38 -1214 216 -954 1091 7 580 -23 190 854 155 777 -946 -996 -1159 -835 76 -446 -264 739 703 -422 -133 -1032 -47 695 1685 -1306 -271 -223 291 -541 17 469 22 -1030 -999 1597 471 694 -1169 -231 1065 1217 709 339 -554 59 162 1 921 225 144 -115 417 135 127 1401 1215 156 953 1061 -689 582 526 -747 -149 316 -126 -1241 -1616 -1800 -674 -377 -953 -117 861 379 1558 1189 1004 518 -674 214 137 -242 308 127 -1571 -163 -647 -987 -1186 90 -1323 -1237 -1395 238 -85 -647 707 658 313 438 698 352 418 -1045 -207 -846 -97 289 966 695 618 -137 1156 1342 1133 875 -196 -741 560 753 -304 -34 569 -438 -1082 -747 -771 14 SS 20230910T131319.4Z 8653.550919 191 1 14.62 2 75.66 92.54 26.58 92.01 0.00 1 0.00 1 0 25 1.294e-01 6.211e-03 7.481e-02 3.384e-03 4.977531e-01 1.751330e-03 5.354243e-03 -6.000000e+00 7.455303e-02 228.67 -2.00 3.24 -2.00 319.88 0.00e+00 9.238787e-04 5.696618e-04 5.320479e-04 -6.000000e+00 3.427658e-03 293.74 -2.00 20.00 -2.00 319.03 0.00e+00 3.951 0.001 302.00 328.00 3 2.8412e+00 5.1931e-03 4.6010e-02 -6.0000e+00 1.8493e-01 -4.5748e-04 6.3453e-03 2.4115e-02 -6.0000e+00 2.0000e-01 -3.3976e-03 5.1547e-03 1.1949e-02 -6.0000e+00 1.1988e-01 -5.1420e-03 2.6784e-03 3.4858e-03 -6.0000e+00 5.1635e-02 3.4750e-04 1.4500e-04 9.6712e-05 3.9066e-05 -6.0000e+00 3.5174e-03 -3.2220e-02 2.9948e-04 12 1 1 12 1 1 99.99 24.68 0.16 -0.03222 -0.03113 33 24 1 5 0 429.790 27.15 20.01 24.68 32.63 30.2 1100.00 -40698 -45240 -48473 15864 -64372 -13558 57382 -37361 22265 -32371 -33612 32672 -19650 -15042 -16235 44347 -10494 7393 871 1612 -1256 705 2387 231 -8285 3799 -9277 1361 -1545 -12906 6205 633 1701 -1425 -3319 470 4802 12096 -2878 -3435 -1838 2418 -2165 -187 2945 654 -2319 -1410 -1058 114 459 522 -836 1777 524 2116 2532 -2563 -130 -46 20 618 927 1348 814 181 950 -376 1822 1136 675 1049 613 855 1163 -104 -3589 -1613 -80 -490 -1069 -1567 -1296 -731 -579 -695 1 96 317 513 648 751 126 -46 277 150 691 616 84 -291 -498 -785 -715 -1416 -135 -586 -172 -698 15 -392 680 625 683 174 -129 -61 246 -31 -242 -431 -392 146 350 117 447 691 -300 365 298 324 174 -171 -10 -4 -383 -234 65 562 71 -482 248 -423 -69 -640 -839 -977 175 -1340 -178 434 -747 295 -746 -810 478 -544 -483 -630 1148 -485 315 42 81 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