File name: Pandora25s1_HoustonTX_20230316_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T061315.7Z 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_20230316_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: 20230316 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 20230316T132931.0Z 8475.562164 170 1 2.99 2 78.00 99.00 58.27 173.75 0.00 1 0.00 1 0 17 2.423e-01 9.174e-03 2.118e-01 7.148e-03 5.253671e-01 3.719579e-03 5.612270e-03 -6.000000e+00 1.386198e-01 227.15 -2.00 3.24 -2.00 320.11 0.00e+00 1.547970e-03 1.291771e-03 4.924957e-04 -6.000000e+00 6.470534e-03 286.00 -2.00 20.00 -2.00 319.41 0.00e+00 4.664 0.001 302.00 328.00 3 1.9987e+00 1.1106e-02 5.2897e-02 -6.0000e+00 3.4357e-01 -2.5381e-02 1.3774e-02 2.6040e-02 -6.0000e+00 3.7269e-01 -4.7487e-03 1.2231e-02 1.2756e-02 -6.0000e+00 2.2270e-01 -8.6597e-04 6.2510e-03 4.4743e-03 -6.0000e+00 9.6081e-02 4.0714e-04 -5.0905e-04 2.0449e-04 4.3379e-05 -6.0000e+00 6.5869e-03 -2.9017e-02 1.5296e-04 12 9 1 12 9 1 76.56 24.75 0.31 -0.02902 -0.03284 5 22 1 5 0 469.650 27.26 20.00 24.75 26.23 28.1 1100.00 -131174 900000 -43215 39529 -36120 -92879 -56693 -16957 86633 21407 -61226 900000 -38781 146009 14719 -54313 32569 34397 -17016 -6234 25648 14660 -2434 -481 19414 -12117 -18221 -10488 -7818 -4353 28876 17328 333 12872 5983 12075 975 19653 -10517 2418 -9301 6716 2292 3922 8378 701 -3122 -3479 1995 367 3093 -1859 2466 3072 3338 -742 -247 -1420 307 -5261 1485 -607 1743 1162 -718 -666 621 2112 1106 1070 -751 2047 323 1425 1396 -998 -2025 -945 -466 525 -1683 -3280 -1567 -1845 118 -1262 -163 875 894 1100 1505 363 205 787 -151 628 -369 707 -170 -116 -388 49 -1084 142 -312 -330 -838 -1144 651 -386 402 259 657 -609 1154 -658 -435 746 9 -199 -144 -581 90 -393 -168 1268 88 553 618 495 88 -391 -547 -41 367 207 -132 210 -202 34 268 -949 202 -3125 900000 -552 275 -386 -1686 -802 -189 604 203 -1311 900000 -914 1017 316 -2560 762 863 -737 -258 814 519 -106 -22 811 -716 -1157 -602 -429 -245 1370 1057 27 978 467 891 88 1763 -1503 361 -1718 1145 426 734 1528 140 -653 -745 419 82 738 -510 703 935 1065 -255 -87 -504 105 -1883 518 -234 729 533 -346 -311 280 956 546 593 -458 1270 203 854 785 -525 -1009 -465 -247 313 -1151 -2508 -1265 -1563 104 -1182 -157 861 882 1059 1374 316 172 662 -137 625 -408 849 -217 -149 -479 56 -1194 156 -363 -401 -1060 -1513 897 -572 629 420 1060 -964 1735 -969 -638 1118 14 -325 -235 -941 143 -610 -253 1844 126 797 950 818 154 -712 -1023 -79 734 430 -278 449 -435 71 549 -1901 393 SS 20230316T133339.7Z 8475.565043 173 1 4.27 2 77.11 99.54 58.18 174.79 0.00 1 0.00 1 0 17 2.952e-01 1.450e-02 2.425e-01 1.115e-02 5.020740e-01 5.831496e-03 5.335250e-03 -6.000000e+00 1.710033e-01 227.15 -2.00 3.24 -2.00 320.01 0.00e+00 -7.219961e-04 1.946568e-03 4.854523e-04 -6.000000e+00 7.995098e-03 286.00 -2.00 20.00 -2.00 319.31 0.00e+00 4.365 0.001 302.00 328.00 3 2.5945e+00 1.7258e-02 4.9640e-02 -6.0000e+00 4.2530e-01 -2.7737e-03 2.1206e-02 2.4432e-02 -6.0000e+00 4.6219e-01 -2.6929e-02 1.8376e-02 1.2101e-02 -6.0000e+00 2.7319e-01 8.3567e-03 9.4351e-03 3.4578e-03 -6.0000e+00 1.1739e-01 3.0383e-04 -6.4411e-05 3.2610e-04 3.8468e-05 -6.0000e+00 8.2232e-03 -3.1519e-02 2.5799e-04 12 9 9 12 1 1 999.00 24.75 0.42 -0.03152 -0.03200 2 8 2 5 0 1365.760 27.26 20.00 24.75 26.50 28.2 1100.00 900000 256755 -42900 5075 -10733 -41086 900000 -82542 900000 -5930 -29671 900000 87594 33020 27034 -91189 20070 48795 11952 30273 1790 27680 -27343 29110 5682 55031 -43451 23592 11223 -12279 31464 8243 10954 6645 26558 11662 54743 45545 10574 -8299 2753 -84 -3310 3446 8915 1255 -7411 3163 3598 -972 -4563 5690 -2818 5743 -347 6341 4242 -2549 985 -6046 1186 -2400 1950 52 -1009 -2023 3740 -2241 4126 -1431 2802 1854 1524 -509 1161 2620 -6846 -87 -813 1545 -2718 -1987 -3323 253 -1886 -699 -1301 -449 1050 749 2849 133 1314 -765 1177 -576 383 1673 -33 -457 -62 -76 -1543 -394 1035 -290 -1265 -254 1286 139 -454 -579 739 -77 116 -726 1095 -844 515 -292 -817 -54 1371 -422 54 472 -112 495 -61 775 -371 -674 734 538 -1020 -222 484 477 245 -45 142 -1024 -38 900000 2791 -703 55 -117 -583 900000 -2190 900000 -94 -612 900000 952 601 625 -7271 624 1254 463 1040 82 1010 -1754 1208 318 2062 -4124 1156 596 -844 1625 605 883 588 1881 944 3275 3508 1367 -1506 503 -17 -708 705 1751 267 -1724 677 786 -232 -1221 1525 -880 1782 -120 2138 1498 -959 352 -2275 431 -970 839 25 -500 -978 1671 -1067 2008 -820 1687 1172 965 -316 666 1359 -3595 -43 -431 911 -1871 -1504 -2725 212 -1691 -656 -1278 -450 1044 728 2587 116 1092 -648 1049 -574 419 1984 -42 -586 -77 -87 -1693 -431 1184 -351 -1601 -333 1759 205 -713 -941 1187 -121 173 -1058 1569 -1262 796 -472 -1334 -87 2132 -649 81 682 -158 703 -92 1256 -641 -1210 1340 1017 -2030 -456 1008 1008 520 -94 288 -2029 -74 SS 20230316T135621.2Z 8475.580801 182 1 2.26 2 72.27 102.61 57.96 180.53 0.00 1 0.00 1 0 17 4.088e-02 6.576e-03 3.184e-02 4.626e-03 3.783889e-01 2.339630e-03 4.163861e-03 -6.000000e+00 2.338245e-02 227.15 -2.00 3.24 -2.00 318.52 0.00e+00 -3.628762e-04 4.834683e-04 1.156262e-04 -6.000000e+00 1.047002e-03 286.00 -2.00 20.00 -2.00 317.74 0.00e+00 3.239 0.000 302.00 328.00 3 2.4947e+00 6.3616e-03 3.6950e-02 -6.0000e+00 5.7953e-02 -1.4074e-02 7.2858e-03 1.8177e-02 -6.0000e+00 6.2864e-02 4.7534e-04 4.9490e-03 8.8999e-03 -6.0000e+00 3.7540e-02 -1.3607e-03 2.5945e-03 2.5102e-03 -6.0000e+00 1.6074e-02 1.1326e-03 -6.5644e-04 1.3286e-04 2.7709e-05 -6.0000e+00 1.1113e-03 -2.8709e-02 9.3057e-05 12 9 1 12 1 1 99.95 24.75 0.24 -0.02871 -0.03364 6 35 1 5 0 298.080 27.26 20.00 24.75 27.07 28.0 1100.00 -22423 7955 -10049 9870 -16548 12955 -16713 -5887 6119 -6453 -11614 -8645 4164 -7002 7800 -9728 2394 -4619 5859 1220 1793 -1010 960 -2207 -535 -2952 -1908 4325 61 377 -2197 7710 -2101 1762 -1471 2066 -1284 852 936 436 -567 -1876 -263 -616 1870 -346 -967 -1693 -121 -499 551 -121 874 742 -411 1505 109 824 -129 448 505 518 828 1208 921 -17 582 28 627 -192 1277 -383 1806 -97 795 -165 -1195 -537 -1158 -783 -1134 -2114 -1770 -629 -1361 -493 -586 477 411 640 371 1229 131 1129 171 683 721 381 546 -336 -233 -1295 -394 -297 -288 -924 -772 -584 -146 292 164 657 -9 -121 -688 313 -81 585 -507 174 -158 10 2 436 143 207 152 335 557 148 1126 154 311 -228 -212 -226 112 340 -532 237 -368 -228 -389 -1110 330 -509 396 -771 454 -831 -301 313 -394 -752 -579 286 -624 705 -1145 270 -587 713 161 241 -139 135 -344 -87 -516 -331 679 9 59 -386 1371 -446 374 -307 415 -290 219 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