File name: Pandora25s1_HoustonTX_20220814_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T153131.0Z 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 v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220814_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: 20220814 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 20220814T123611.7Z 8261.525135 223 1 49.59 2 80.84 78.74 67.83 248.64 0.00 1 0.00 1 0 25 4.201e-01 2.057e-02 1.347e-01 1.871e-03 7.153456e-01 1.018641e-03 8.363415e-03 -6.000000e+00 2.450654e-01 229.50 -2.00 3.24 -2.00 321.23 0.00e+00 1.203675e-02 5.317074e-04 4.834845e-03 -6.000000e+00 1.153975e-02 294.61 -2.00 20.00 -2.00 320.54 0.00e+00 5.953 0.002 302.00 328.00 3 6.7637e-01 3.7196e-03 7.0461e-02 -6.0000e+00 6.1123e-01 2.3849e-01 5.0704e-03 3.9601e-02 -6.0000e+00 6.6331e-01 -3.4752e-01 4.6123e-03 2.4275e-02 -6.0000e+00 3.9416e-01 1.4633e-01 2.1975e-03 1.0395e-02 -6.0000e+00 1.6745e-01 3.4636e-04 -7.0936e-04 5.0351e-05 1.8176e-04 -6.0000e+00 1.1831e-02 -2.0311e-03 7.7466e-05 12 8 8 10 0 0 73.58 24.65 0.32 -0.00203 -0.00736 190 40 1 5 0 260.970 27.15 20.00 24.65 34.51 26.6 1003.48 -325017 92977 -80789 900000 -55597 -100594 900000 -79708 900000 -146900 -54538 10408 -160 40298 -36185 900000 50673 120692 47969 109240 31363 53649 -38869 49857 -4593 31693 -4117 37475 4948 10105 54216 54283 46678 37106 27500 29201 34796 55037 25977 15510 17470 24635 25126 28062 21999 25083 18108 17501 24639 17632 16939 17019 13636 16287 10486 10860 9445 1910 4451 4919 7307 6962 8911 8340 7883 7790 5199 3281 5741 3265 3444 1347 1259 264 1929 1573 -4119 -1908 -157 601 -1157 -371 -2639 -742 -2906 -2121 -1567 -1150 -596 505 49 -741 -1636 -2716 -2181 -1386 -661 -409 -266 -715 -596 -1515 -1443 -1721 -1389 -1223 -1541 -1075 -403 -668 -37 288 191 247 -47 126 338 213 259 285 287 1111 1311 1063 1275 1268 1015 1039 924 675 617 470 86 370 -45 -264 -455 -131 -232 -299 -319 -589 -897 -19130 170 -589 900000 -270 -749 900000 -545 900000 -2187 -340 41 -1 214 -533 900000 431 568 503 647 405 546 -948 568 -94 462 -86 512 98 221 955 1163 1248 1133 810 923 1069 1773 1246 964 1176 1655 1779 1999 1718 1977 1592 1516 2111 1766 1921 2156 1957 2458 1755 1864 1667 358 791 872 1344 1452 1967 2091 2076 2020 1387 937 1795 1201 1378 567 517 102 664 490 -1297 -617 -58 265 -572 -208 -1651 -483 -1946 -1499 -1155 -866 -444 357 35 -495 -1078 -1912 -1644 -1218 -638 -453 -302 -812 -664 -1528 -1414 -1620 -1401 -1303 -1750 -1246 -516 -920 -56 464 309 387 -70 183 495 329 423 481 478 1761 1999 1570 1903 1828 1430 1548 1491 1181 1192 928 180 789 -103 -610 -1076 -313 -552 -683 -714 -1239 -1916 SS 20220814T132849.7Z 8261.561687 250 1 4.64 2 69.53 84.87 78.30 256.25 0.00 1 0.00 1 0 17 5.835e-02 7.624e-03 2.946e-02 4.897e-03 3.724074e-01 2.488131e-03 4.133311e-03 -6.000000e+00 3.345878e-02 229.50 -2.00 3.24 -2.00 318.25 0.00e+00 8.877568e-05 4.828974e-04 2.048923e-04 -6.000000e+00 1.548821e-03 294.61 -2.00 20.00 -2.00 317.29 0.00e+00 2.830 0.000 302.00 328.00 3 3.6131e+00 6.7544e-03 3.3486e-02 -6.0000e+00 8.3120e-02 8.7629e-03 7.7350e-03 1.8155e-02 -6.0000e+00 9.0086e-02 5.2833e-03 4.9897e-03 8.7554e-03 -6.0000e+00 5.3977e-02 -7.4228e-03 2.5874e-03 2.4529e-03 -6.0000e+00 2.3027e-02 5.4120e-04 -3.0927e-03 1.3994e-04 2.7292e-05 -6.0000e+00 1.5918e-03 7.7240e-03 -3.8449e-04 12 9 1 12 1 1 -10844.62 24.62 0.41 0.00772 -0.01552 3 9 1 5 0 1116.040 27.15 20.00 24.62 31.25 26.5 986.12 -27503 4631 -11764 6603 1647 -15396 30535 -5941 33500 -28673 -6809 -4073 -1494 -7559 -3443 -9886 2258 4893 1702 6597 5021 1722 -559 874 -1294 -2259 -5851 -325 -1859 -2491 5361 2138 2814 -3554 -137 517 418 -65 335 -1865 -410 -370 1250 1399 828 213 -792 -1925 -1008 -1127 301 -1048 -475 1630 1954 2298 1835 -211 887 1443 83 -178 2558 1323 -166 543 -961 -395 1301 925 171 -182 717 -387 816 1021 -1419 -1945 417 -1108 -917 -1226 -1650 -1324 -1212 -899 -628 -167 450 -20 457 358 -135 693 576 54 595 602 506 -401 -487 -448 -603 -1355 -850 -333 -200 -509 696 499 553 684 -473 -245 277 368 -56 127 319 -125 -71 -502 652 -106 1098 191 345 371 714 -221 142 285 -226 -244 -48 -90 -277 321 261 -314 -185 -243 -412 -1749 237 -711 312 75 -833 1188 -368 1591 -2520 -496 -316 -132 -823 -416 -1385 301 674 252 974 761 270 -94 155 -247 -451 -1192 -60 -335 -468 1032 466 661 -888 -32 121 108 -20 119 -756 -176 -165 564 634 378 98 -366 -894 -467 -538 151 -567 -269 950 1167 1401 1137 -132 543 880 53 -121 1824 997 -126 390 -675 -278 971 756 148 -162 630 -332 655 760 -1015 -1386 310 -914 -823 -1181 -1664 -1379 -1321 -1020 -733 -198 530 -23 498 370 -134 687 603 62 721 778 676 -533 -621 -541 -707 -1633 -1071 -433 -267 -703 994 747 859 1073 -734 -366 394 509 -77 182 474 -192 -110 -770 977 -157 1560 266 468 508 1025 -335 224 457 -369 -409 -83 -162 -502 587 479 -569 -327 -420 -704 SS 20220814T133311.8Z 8261.564720 253 1 49.46 2 68.59 85.38 79.18 256.84 0.00 1 0.00 1 0 17 1.282e-02 4.816e-03 1.609e-03 3.350e-04 3.537716e-01 1.700352e-04 3.879289e-03 -6.000000e+00 7.375812e-03 229.50 -2.00 3.24 -2.00 317.99 0.00e+00 2.650501e-04 3.081546e-05 9.004292e-05 -6.000000e+00 3.407463e-04 294.61 -2.00 20.00 -2.00 317.03 0.00e+00 2.713 0.000 302.00 328.00 3 1.1158e+00 4.5858e-04 3.1948e-02 -6.0000e+00 1.8323e-02 -2.0048e-03 5.2207e-04 1.7042e-02 -6.0000e+00 1.9839e-02 1.5298e-04 3.2728e-04 8.2405e-03 -6.0000e+00 1.1888e-02 -3.2046e-03 1.6798e-04 2.2601e-03 -6.0000e+00 5.0855e-03 7.6058e-03 -2.1256e-04 9.6017e-06 2.5271e-05 -6.0000e+00 3.4952e-04 -1.9673e-03 1.8959e-05 10 0 0 10 0 0 99.98 24.62 0.27 -0.00197 -0.00356 908 193 1 5 0 54.400 27.15 20.01 24.62 31.51 26.6 988.67 5934 -2063 -4121 -2654 -5528 -4686 -2828 -1823 -1269 -3070 -3695 -3070 -2603 -1583 -997 -911 75 314 382 401 254 -185 -92 -172 -159 138 -182 -456 -785 -43 658 1099 937 -549 -2386 -1842 -2244 -727 -724 -502 -739 -582 -248 -471 -42 -224 -235 -493 -304 16 550 770 928 933 654 929 779 693 575 710 749 1074 1381 1513 573 -17 -262 -331 450 410 261 168 163 290 298 -69 -366 -813 -336 -710 -851 -1011 -1645 -1424 -969 -594 -281 0 266 423 441 528 182 500 433 341 448 536 86 -263 -432 -804 -505 -292 -565 -828 -482 -531 -91 341 282 198 162 98 -47 153 116 88 14 -77 -362 -130 142 268 503 451 362 852 609 430 281 -60 4 108 125 2 -137 119 -106 -256 -216 -368 -439 348 -143 -295 -173 -337 -284 -185 -135 -104 -266 -325 -291 -288 -189 -137 -139 12 53 68 74 47 -35 -18 -37 -33 30 -39 -99 -164 -9 143 264 247 -148 -617 -481 -661 -235 -283 -212 -341 -281 -123 -236 -21 -113 -117 -244 -150 8 284 429 551 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