File name: Pandora25s1_HoustonTX_20241210_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20241211T062009.1Z 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_20241210_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: 20241210 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 20241210T162646.8Z 9110.685264 212 1 10.16 2 58.72 150.81 129.45 49.92 0.00 1 0.00 1 0 17 1.873e-02 8.410e-03 9.059e-03 4.004e-03 2.429970e-01 2.017253e-03 2.737253e-03 -6.000000e+00 1.065050e-02 224.38 -2.00 3.24 -2.00 316.42 0.00e+00 -7.075404e-04 2.407947e-04 8.617039e-05 -6.000000e+00 4.813325e-04 286.60 -2.00 20.00 -2.00 315.67 0.00e+00 1.919 0.000 302.00 328.00 3 5.1357e+00 5.2200e-03 2.2226e-02 -6.0000e+00 2.6228e-02 1.9168e-02 5.8552e-03 1.1431e-02 -6.0000e+00 2.8455e-02 5.1525e-03 3.4160e-03 5.6420e-03 -6.0000e+00 1.7038e-02 -3.7381e-03 1.6370e-03 1.6660e-03 -6.0000e+00 7.3806e-03 3.4571e-04 1.9798e-03 1.1452e-04 1.9768e-05 -6.0000e+00 5.0791e-04 -4.9768e-02 5.8688e-04 12 9 1 12 41 1 98.07 26.53 0.63 -0.04977 -0.03489 3 4 1 5 0 2540.040 28.29 19.99 26.53 22.42 32.3 1040.87 4256 2865 -2960 34 -6799 -5001 1197 1508 8419 6616 -3812 -285 -4970 -71 -632 -6892 2944 3628 -296 119 460 -1707 1984 75 -3210 -284 -1166 261 2580 -669 1419 3445 -454 -1737 -3057 -788 413 3699 -1689 -2052 -1044 991 -996 17 796 227 -1637 -1214 815 -728 1965 -470 847 489 1077 1303 2171 -1208 2161 -1461 504 1434 1127 889 20 299 -404 751 719 537 240 195 640 174 885 539 -1888 -864 -1228 -324 -1313 -1425 -1217 -1016 -1222 -520 -781 2 -44 288 -389 540 260 -373 222 906 519 279 126 -536 -134 -412 -140 -1453 895 -584 -948 -162 672 402 89 936 656 114 -220 -225 222 -149 -1140 -719 -470 301 477 179 318 839 -205 1006 193 614 773 189 -217 660 -247 28 138 389 177 -564 -44 -1493 -116 670 496 -552 6 -1119 -772 184 257 1497 1260 -790 -58 -1148 -18 -175 -2175 890 1121 -97 40 158 -592 679 27 -1257 -113 -466 98 897 -233 504 1277 -185 -733 -1245 -307 169 1666 -911 -1248 -676 655 -682 12 540 154 -1113 -807 525 -474 1296 -332 617 370 831 1019 1710 -975 1683 -1159 401 1185 986 814 19 263 -338 608 601 488 233 196 642 172 835 476 -1582 -689 -998 -281 -1242 -1440 -1285 -1105 -1385 -614 -955 2 -55 354 -460 599 273 -382 232 999 612 351 165 -705 -171 -499 -163 -1720 1096 -750 -1256 -220 930 579 132 1405 971 162 -300 -294 286 -196 -1569 -1030 -687 438 683 251 433 1106 -263 1273 253 837 1088 272 -316 975 -378 44 221 634 290 -923 -70 -2360 -178 SS 20241210T163614.1Z 9110.691830 219 1 11.02 2 57.76 153.10 127.89 51.99 0.00 1 0.00 1 0 17 2.877e-02 7.419e-03 6.356e-03 2.911e-03 2.380014e-01 1.468056e-03 2.713736e-03 -6.000000e+00 1.632742e-02 224.38 -2.00 3.24 -2.00 316.32 0.00e+00 -7.450566e-05 1.707926e-04 3.500209e-05 -6.000000e+00 7.390751e-04 286.60 -2.00 20.00 -2.00 315.57 0.00e+00 1.868 0.000 302.00 328.00 3 4.1326e+00 3.7914e-03 2.1703e-02 -6.0000e+00 4.0204e-02 1.9180e-02 4.2494e-03 1.1239e-02 -6.0000e+00 4.3649e-02 5.9823e-03 2.4745e-03 5.5631e-03 -6.0000e+00 2.6134e-02 -7.9938e-03 1.1797e-03 1.5835e-03 -6.0000e+00 1.1297e-02 9.9781e-04 6.0854e-05 8.3149e-05 1.9717e-05 -6.0000e+00 7.8058e-04 -4.5997e-02 1.8207e-04 12 9 1 12 1 1 99.94 26.52 0.08 -0.04600 -0.04554 6 7 2 5 0 1572.580 28.29 19.99 26.52 22.77 32.5 1043.89 28808 -738 -7241 -2071 -5464 -4402 2951 -2425 7778 217 -300 -990 -4366 -1449 210 -1774 462 2471 -291 -339 1639 -1224 1261 -197 169 1251 -1153 1266 896 -649 1748 2197 1927 -367 -2123 -2473 -241 -1507 -775 -1640 -1200 -286 -1277 -430 333 573 -1258 -928 -384 178 572 272 1182 1309 571 210 1062 -426 1322 -480 697 1444 1011 574 -110 180 -761 -176 283 642 192 410 1030 35 953 509 -654 -645 -585 236 -743 -978 -1848 -1266 -1009 -691 -46 -338 272 437 667 431 219 -149 603 920 -45 794 214 -539 -189 -800 -182 -990 114 -791 -745 -810 90 163 377 485 672 -71 -30 -3 35 -82 -68 -493 -422 7 -92 -129 201 441 467 771 866 710 553 -170 73 139 282 -67 -127 418 -66 -615 31 -384 -625 3910 -141 -1487 -385 -942 -720 476 -455 1471 46 -63 -213 -1056 -382 61 -562 149 806 -100 -120 580 -440 452 -75 67 504 -474 487 326 -235 643 854 797 -158 -885 -1010 -103 -730 -427 -1017 -793 -194 -890 -299 231 395 -868 -627 -254 117 388 194 872 998 448 167 851 -345 1045 -382 560 1207 894 530 -103 159 -643 -145 240 587 187 412 1034 35 902 452 -547 -517 -478 206 -704 -989 -1963 -1380 -1143 -816 -56 -421 340 535 782 479 230 -153 629 1014 -53 992 280 -707 -239 -968 -211 -1168 140 -1014 -982 -1097 125 234 557 725 988 -101 -40 -3 45 -107 -92 -702 -612 11 -131 -181 273 581 597 975 1127 964 776 -244 105 205 428 -105 -203 677 -108 -1002 50 -600 -963 SS 20241210T164046.8Z 9110.694986 222 1 49.42 2 57.32 154.23 127.13 52.95 0.00 1 0.00 1 0 17 1.552e-02 5.683e-03 3.906e-03 1.450e-03 2.298219e-01 7.266206e-04 2.614743e-03 -6.000000e+00 8.810209e-03 224.38 -2.00 3.24 -2.00 317.00 0.00e+00 -5.016092e-05 9.879998e-05 5.808304e-05 -6.000000e+00 3.987415e-04 286.60 -2.00 20.00 -2.00 316.21 0.00e+00 1.846 0.000 302.00 328.00 3 4.0675e+00 1.8970e-03 2.1325e-02 -6.0000e+00 2.1694e-02 -4.4870e-03 2.1357e-03 1.0892e-02 -6.0000e+00 2.3552e-02 1.8990e-02 1.2661e-03 5.3864e-03 -6.0000e+00 1.4101e-02 -9.8866e-03 6.2038e-04 1.5366e-03 -6.0000e+00 6.0964e-03 1.1098e-03 2.6442e-04 4.2082e-05 1.8514e-05 -6.0000e+00 4.2113e-04 -4.5968e-02 2.1235e-04 10 0 0 10 0 0 99.99 26.51 0.30 -0.04597 -0.04398 189 40 2 5 0 261.450 28.29 19.99 26.51 23.01 32.6 1045.93 11354 -2266 -2000 -2579 -3939 -5385 2839 -313 3685 3242 -3344 2451 -2587 803 -1830 1957 -555 2792 -982 -801 519 -391 492 583 -1264 447 -379 518 1820 -692 2046 794 1598 -857 -1676 -1747 -500 1807 -1440 -1301 -1907 -169 -1109 -488 -69 467 -1178 -1156 -35 -221 767 282 666 544 242 452 1251 -361 1574 -270 653 503 1103 435 406 51 -219 -36 200 847 137 432 29 135 725 1051 -1024 -52 -614 303 -455 -680 -1584 -1113 -843 -897 160 -226 481 229 505 640 448 -155 417 625 257 575 9 -187 -97 -703 -874 -763 -22 -593 -620 -598 233 -6 179 264 47 196 -170 -11 350 -173 -158 -360 -490 -32 -37 39 266 509 76 1025 694 671 370 86 223 634 1 -50 -259 207 73 -317 -83 -967 -104 1380 -338 -303 -371 -515 -683 352 -44 559 518 -561 396 -481 163 -427 478 -144 726 -273 -229 149 -113 144 178 -413 149 -127 164 532 -202 608 254 544 -306 -571 -581 -177 714 -684 -705 -1122 -102 -690 -305 -43 288 -727 -697 -21 -130 463 181 446 380 174 330 920 -269 1139 -198 483 393 916 382 357 43 -171 -27 157 730 128 418 29 129 655 874 -797 -38 -463 247 -409 -662 -1635 -1187 -942 -1057 194 -284 604 283 590 699 458 -153 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