File name: Pandora25s1_HoustonTX_20221010_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T043601.3Z 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 v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20221010_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: 20221010 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 20221010T130809.1Z 8318.547328 249 1 49.27 2 80.56 103.44 92.35 280.48 0.00 1 0.00 1 0 25 5.236e-01 1.466e-02 2.017e-01 3.024e-03 6.473810e-01 1.638677e-03 7.024130e-03 -6.000000e+00 3.036799e-01 227.22 -2.00 3.24 -2.00 321.19 0.00e+00 7.317808e-03 8.338418e-04 1.624886e-03 -6.000000e+00 1.444308e-02 291.70 -2.00 20.00 -2.00 320.53 0.00e+00 5.799 0.002 302.00 328.00 3 1.8340e+00 5.8510e-03 6.5459e-02 -6.0000e+00 7.5486e-01 5.2683e-02 8.0115e-03 3.1774e-02 -6.0000e+00 8.2139e-01 -1.4175e-01 7.6492e-03 1.9059e-02 -6.0000e+00 4.8788e-01 5.6784e-02 3.6473e-03 9.5580e-03 -6.0000e+00 2.0858e-01 1.4561e-04 -1.0408e-03 8.5985e-05 1.1507e-04 -6.0000e+00 1.4724e-02 -5.7929e-03 1.0986e-04 12 8 8 10 0 0 77.48 24.98 0.51 -0.00579 -0.01361 89 19 1 5 0 553.520 27.45 19.99 24.98 26.93 27.0 961.62 -290187 900000 -138211 900000 -161385 -98264 900000 -24028 900000 -117653 -95202 106724 -69636 -5728 94371 -151638 286425 900000 43944 111636 -21798 56227 -6910 98037 -30954 58424 -61958 37322 6547 -49757 88664 43164 28758 -14264 -9959 22892 27986 102508 8047 -476 5517 23901 26512 12206 22986 22152 554 4051 14992 3699 18317 11436 3505 17424 9147 9278 1498 -4376 4288 41 2597 44 505 3294 671 1889 5101 -70 4948 3256 3686 2259 1818 -59 3451 957 -7388 517 -1080 1462 -643 -1121 -2396 2159 -1790 -2390 -680 -1374 -1285 1339 809 801 -28 -1634 -1733 -384 -25 -21 -89 -1036 473 -1995 -440 -1370 -427 -1177 -1092 -875 363 -393 -203 871 534 -180 -243 932 46 -215 -719 -264 12 919 1102 365 507 722 782 849 210 335 587 327 -229 868 -375 -181 -209 115 -306 -151 -150 -619 -189 -9892 900000 -1378 900000 -1792 -579 900000 -82 900000 -1200 -820 314 -726 -42 348 -6732 844 900000 408 603 -420 497 -121 698 -786 635 -2274 499 122 -1838 1005 929 828 -663 -424 711 926 1928 442 -34 410 1589 1819 999 1736 1748 56 414 1451 434 2085 1562 569 2669 1498 1576 282 -866 760 8 494 10 126 900 196 535 1390 -21 1575 1214 1501 908 721 -24 1233 316 -2512 168 -406 640 -316 -632 -1495 1368 -1265 -1706 -502 -1051 -981 958 577 536 -19 -1132 -1278 -325 -24 -22 -102 -1202 506 -2088 -418 -1333 -444 -1234 -1212 -1043 471 -547 -312 1399 861 -283 -361 1319 67 -327 -1169 -422 20 1468 1697 548 731 1004 1113 1197 336 574 1103 627 -465 1849 -828 -420 -497 277 -742 -352 -330 -1355 -399 SS 20221010T131705.3Z 8318.553534 254 1 49.40 2 78.68 104.63 94.18 281.59 0.00 1 0.00 1 0 25 1.857e-01 5.547e-03 8.916e-02 1.477e-03 5.661905e-01 7.721367e-04 6.037765e-03 -6.000000e+00 1.063926e-01 227.22 -2.00 3.24 -2.00 320.48 0.00e+00 1.080612e-03 3.119810e-04 3.021693e-04 -6.000000e+00 4.905791e-03 291.70 -2.00 20.00 -2.00 319.73 0.00e+00 4.918 0.001 302.00 328.00 3 1.5457e+00 2.4491e-03 5.5879e-02 -6.0000e+00 2.6334e-01 -4.6428e-02 3.1606e-03 2.7614e-02 -6.0000e+00 2.8596e-01 1.4530e-02 2.8794e-03 1.3629e-02 -6.0000e+00 1.7144e-01 -1.4467e-02 1.4425e-03 4.3548e-03 -6.0000e+00 7.3792e-02 4.9343e-04 -5.6404e-04 4.1981e-05 4.7223e-05 -6.0000e+00 5.0813e-03 -6.4417e-03 1.0316e-04 10 0 0 10 0 0 37.14 24.96 0.37 -0.00644 -0.01068 184 39 1 5 0 268.410 27.35 20.01 24.96 27.47 27.2 964.87 900000 16556 -84877 12880 -93584 -61160 71840 -59153 87861 -44098 -65079 -22029 -26460 -3830 -11786 900000 6156 7660 828 3425 -12010 -8847 -12489 4098 -14345 -4362 -16332 -7659 -11089 -24140 4973 6911 -1609 -2840 -7383 996 -3764 12895 -2242 -2199 -1748 1028 2892 -43 2437 674 -1638 -1821 1092 -1429 3134 1097 509 1984 1114 1321 941 -1601 307 -810 215 -770 29 1398 61 341 772 -26 798 899 1066 1375 851 99 1011 267 -2001 -295 -1025 -263 -689 -1029 -1418 -934 -1241 -796 -171 149 381 1101 906 1136 425 488 -241 546 288 496 60 -224 86 -946 -950 -1005 -542 -1136 -674 -858 27 1590 340 330 445 217 129 399 -96 -350 -445 -507 -589 31 110 69 252 344 50 657 399 272 201 13 58 54 -194 -215 -112 97 13 -186 116 -67 -96 900000 63 -946 52 -1013 -490 179 -607 247 -480 -925 -236 -373 -54 -215 900000 123 166 21 89 -374 -271 -426 131 -577 -168 -718 -298 -444 -1202 219 351 -102 -183 -496 63 -272 954 -239 -268 -237 145 421 -7 371 107 -271 -311 189 -262 613 244 125 519 301 372 274 -476 87 -232 64 -257 11 553 25 136 301 -11 359 450 584 781 479 53 493 122 -878 -129 -508 -147 -436 -718 -1080 -730 -1045 -693 -155 139 354 974 771 899 335 396 -213 534 307 583 74 -283 101 -1047 -1005 -1088 -614 -1370 -832 -1104 36 2298 532 540 721 337 194 586 -143 -534 -707 -843 -979 49 174 106 380 498 73 953 630 458 361 24 114 109 -410 -469 -246 216 29 -401 242 -135 -193 SS 20221010T132307.0Z 8318.557720 257 1 49.56 2 77.42 105.45 95.41 282.36 0.00 1 0.00 1 0 25 9.082e-02 4.870e-03 2.579e-02 1.036e-03 5.181636e-01 5.343166e-04 5.557127e-03 -6.000000e+00 5.183163e-02 227.22 -2.00 3.24 -2.00 320.05 0.00e+00 1.085499e-03 1.856150e-04 2.539347e-04 -6.000000e+00 2.397756e-03 291.70 -2.00 20.00 -2.00 319.25 0.00e+00 4.461 0.001 302.00 328.00 3 1.3996e+00 1.6074e-03 5.0778e-02 -6.0000e+00 1.2820e-01 -3.9702e-02 1.9915e-03 2.5159e-02 -6.0000e+00 1.3910e-01 5.8478e-03 1.6916e-03 1.2329e-02 -6.0000e+00 8.3369e-02 -9.5916e-03 8.6937e-04 3.8888e-03 -6.0000e+00 3.5996e-02 9.2132e-04 -3.8563e-04 2.9512e-05 4.0834e-05 -6.0000e+00 2.4839e-03 -6.5139e-03 1.0853e-04 11 1 0 11 8 0 25.18 24.97 0.28 -0.00651 -0.00941 267 57 1 5 0 185.600 27.35 20.01 24.97 27.85 27.1 966.60 900000 -13009 -45828 -6345 -55972 -16302 3000 -30477 -12403 -21574 -46718 -17595 -27917 -4003 -7865 2105 -2294 504 -1609 -1406 -2579 -9301 -2404 -6760 -2732 -4500 -8511 -6598 -837 -10709 1831 1131 4 -387 -4176 -618 -2373 4184 -2822 -807 -2005 844 -304 701 1227 1183 -635 -861 794 -674 1631 220 874 460 958 679 711 -1016 575 -411 260 485 1071 1566 771 1016 -182 -177 234 780 650 846 619 539 643 -56 -1323 -834 -584 -674 -900 -1049 -1538 -1131 -712 -738 -4 410 631 927 855 766 470 426 193 496 94 445 67 -288 -216 -865 -575 -862 -666 -1032 -698 -733 40 835 268 329 498 132 84 203 17 -72 -276 -416 -651 -164 49 132 322 466 166 752 448 370 273 34 -13 54 -60 -83 -95 44 -81 -201 76 -257 -88 900000 -130 -651 -59 -777 -159 27 -432 -167 -338 -964 -314 -669 -94 -231 65 -81 19 -65 -60 -113 -440 -114 -362 -152 -267 -527 -388 -46 -692 121 87 0 -35 -375 -55 -239 471 -409 -134 -369 161 -61 142 251 246 -136 -188 177 -161 416 62 265 150 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