File name: Pandora25s1_HoustonTX_20220831_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T154746.0Z 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_20220831_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: 20220831 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 20220831T124549.0Z 8278.531817 57 1 8.64 2 80.58 85.51 130.10 76.64 0.00 1 0.00 1 0 25 5.211e-01 1.605e-02 3.047e-01 8.516e-03 6.688449e-01 4.640126e-03 7.294943e-03 -6.000000e+00 3.037389e-01 228.98 -2.00 3.24 -2.00 321.11 0.00e+00 5.162072e-03 2.300095e-03 2.747901e-03 -6.000000e+00 1.465293e-02 294.09 -2.00 20.00 -2.00 320.41 0.00e+00 5.808 0.002 302.00 328.00 3 1.9956e+00 1.6402e-02 6.6788e-02 -6.0000e+00 7.5648e-01 9.4572e-02 2.2622e-02 3.5042e-02 -6.0000e+00 8.2161e-01 -1.3564e-01 2.1350e-02 1.9500e-02 -6.0000e+00 4.8844e-01 5.3597e-02 1.0193e-02 6.8645e-03 -6.0000e+00 2.1126e-01 1.1619e-04 -1.7175e-04 2.3784e-04 9.9196e-05 -6.0000e+00 1.4733e-02 -3.9245e-03 1.8318e-04 12 9 9 12 1 1 -12.25 24.71 0.49 -0.00392 -0.00522 8 11 1 5 0 940.080 27.15 20.01 24.71 32.88 27.0 993.59 900000 900000 -157552 900000 -273838 -78006 900000 -128871 900000 -222312 -173044 163593 -118747 -50464 -43573 900000 27155 9027 93797 7000 30333 -20506 -34994 -19874 21171 4772 -42278 68238 16879 -8310 67126 58304 -15831 -14833 -49084 22577 -33191 258981 126 7297 -19797 14400 26347 18381 24292 26817 5144 4169 44460 -5739 24308 -4908 4360 10594 7934 5919 13060 -7617 3131 2732 4215 -3509 1870 4308 -1001 2475 1621 4596 522 2856 3530 3446 -533 1857 5387 5409 -7325 -1690 -2619 623 1428 -3051 -2667 3447 -1547 -846 -739 1902 -121 -14 1922 -97 -2331 -1211 -1387 2643 -2581 355 -1669 45 513 -1761 130 -3457 876 -1373 -1294 -2211 634 -1005 140 277 926 -795 31 835 357 524 188 -162 233 347 742 1083 226 873 186 1210 751 589 654 -326 -304 241 118 -588 -563 1071 -273 -867 162 -709 55 900000 900000 -1735 900000 -8170 -647 900000 -1208 900000 -6072 -3147 1357 -1978 -566 -577 900000 245 108 778 97 343 -381 -793 -423 326 90 -1265 697 288 -203 971 1097 -689 -668 -2930 701 -1952 2148 8 499 -1934 1096 1889 1458 1869 2076 503 430 3326 -740 2651 -782 697 1728 1398 1105 2335 -1639 596 522 834 -828 477 1196 -303 711 470 1354 178 1081 1442 1455 -229 740 1912 1749 -2538 -576 -1019 276 723 -1803 -1695 2192 -1091 -627 -570 1469 -95 -11 1349 -66 -1575 -844 -1077 2256 -2600 389 -1977 52 564 -1813 124 -3442 893 -1493 -1474 -2689 815 -1431 213 439 1463 -1239 47 1205 522 795 299 -266 378 547 1138 1617 330 1234 260 1738 1186 1019 1210 -637 -616 508 261 -1353 -1315 2502 -642 -1996 355 -1505 114 SS 20220831T125441.0Z 8278.537974 62 1 49.57 2 78.66 86.58 128.32 78.07 0.00 1 0.00 1 0 25 1.886e-01 4.931e-03 4.043e-02 1.071e-03 5.811075e-01 5.583798e-04 6.175889e-03 -6.000000e+00 1.082980e-01 228.98 -2.00 3.24 -2.00 320.40 0.00e+00 1.972794e-03 2.194483e-04 2.631442e-04 -6.000000e+00 4.999442e-03 294.09 -2.00 20.00 -2.00 319.60 0.00e+00 4.909 0.001 302.00 328.00 3 8.9632e-01 1.7598e-03 5.6230e-02 -6.0000e+00 2.6876e-01 2.3517e-03 2.2428e-03 2.8296e-02 -6.0000e+00 2.9111e-01 -9.7254e-03 1.9852e-03 1.4114e-02 -6.0000e+00 1.7445e-01 -5.0053e-03 1.0037e-03 4.9453e-03 -6.0000e+00 7.4690e-02 9.0877e-04 -4.3142e-04 2.9793e-05 5.0988e-05 -6.0000e+00 5.1387e-03 -2.7663e-03 7.0107e-05 10 0 0 10 0 0 64.39 24.70 0.28 -0.00277 -0.00601 300 64 1 5 0 165.150 27.15 20.01 24.70 33.43 27.3 997.72 -116247 -26018 -76884 -45155 -72615 -67051 17935 -64633 11466 -74435 -50936 -20939 -22905 -23626 -24493 -18739 -6887 1199 -10340 -5840 -5874 -13126 -8288 -3343 -11856 -4626 -12449 -9800 -9980 -7518 2926 2644 1987 -3413 -7302 -1580 -3544 3933 -1538 -2290 -3133 74 1465 678 1828 1461 -368 -598 1438 -377 1551 756 420 1593 1098 1418 1169 -852 770 -242 83 843 985 2018 810 559 467 -371 1035 812 580 831 382 331 773 110 -1357 -1241 -649 -833 -846 -941 -1637 -777 -824 -435 -185 178 692 998 1157 793 667 231 12 37 192 397 -64 -316 -119 -840 -600 -543 -587 -1157 -826 -812 -77 830 297 185 215 226 56 121 -40 -95 -38 -194 -420 -39 219 207 274 350 47 628 342 372 220 -44 -69 165 -97 -86 -145 139 -10 -160 -61 -130 -178 -1545 -161 -832 -339 -669 -598 84 -730 75 -1131 -648 -231 -326 -431 -558 -473 -173 31 -320 -183 -189 -460 -297 -115 -481 -184 -541 -401 -409 -332 138 148 128 -241 -513 -107 -279 348 -164 -291 -447 11 224 107 291 239 -62 -105 259 -74 335 183 104 422 309 415 352 -260 226 -72 26 288 381 855 357 238 197 -164 470 425 333 493 224 183 389 50 -634 -592 -324 -492 -543 -684 -1301 -611 -696 -391 -174 172 660 909 980 669 542 195 10 38 214 474 -83 -402 -140 -957 -635 -588 -686 -1363 -1024 -1078 -104 1249 468 305 352 353 87 179 -60 -149 -61 -323 -698 -63 339 324 411 506 66 913 530 644 397 -85 -132 335 -201 -187 -311 303 -22 -353 -127 -269 -357 SS 20220831T130043.2Z 8278.542167 65 1 49.42 2 77.35 87.32 127.10 79.01 0.00 1 0.00 1 0 25 8.626e-02 4.531e-03 1.951e-02 7.470e-04 5.298529e-01 3.849882e-04 5.653810e-03 -6.000000e+00 4.953284e-02 228.98 -2.00 3.24 -2.00 319.93 0.00e+00 1.339979e-03 1.289742e-04 2.024365e-04 -6.000000e+00 2.286637e-03 294.09 -2.00 20.00 -2.00 319.07 0.00e+00 4.439 0.001 302.00 328.00 3 7.5922e-01 1.1518e-03 5.0948e-02 -6.0000e+00 1.2292e-01 1.0321e-03 1.4164e-03 2.5751e-02 -6.0000e+00 1.3315e-01 -1.0037e-02 1.1690e-03 1.2593e-02 -6.0000e+00 7.9791e-02 -3.4619e-03 6.0546e-04 4.0437e-03 -6.0000e+00 3.4162e-02 1.7152e-03 -3.1198e-04 2.0944e-05 4.0960e-05 -6.0000e+00 2.3503e-03 -2.9804e-03 6.2608e-05 10 0 0 10 0 0 76.61 24.71 0.27 -0.00298 -0.00532 416 88 1 5 0 118.780 27.15 20.00 24.71 33.90 27.1 999.91 27843 -37557 -20277 -26553 -38522 -31488 -7584 -25745 -5258 -31166 -34715 -11185 -23453 -7497 -11818 -10635 -8259 2336 -5420 60 -4482 -4538 -3785 -5830 -2445 -5847 -5018 -6942 -3064 -5593 2137 254 1228 -2029 -3788 -2793 -3361 1200 -1558 -1094 -2007 -220 -467 537 -255 566 -593 -293 327 -139 1339 447 942 602 869 297 1125 -206 630 -78 497 939 1392 1763 1094 610 11 17 400 768 274 789 251 526 522 138 -888 -968 -595 -597 -868 -1039 -1408 -1307 -637 -553 119 301 730 833 964 718 248 358 205 202 161 447 41 -252 -389 -723 -622 -532 -841 -1043 -634 -649 -86 553 251 230 239 85 9 154 194 -105 -71 -257 -460 -175 93 196 382 507 192 807 328 351 194 20 -16 123 18 -43 -118 118 -59 -176 -68 -260 -227 185 -492 -234 -308 -467 -363 -85 -361 -68 -557 -674 -197 -581 -198 -397 -408 -342 95 -235 3 -207 -212 -188 -323 -142 -369 -315 -426 -179 -364 150 21 115 -202 -366 -273 -375 155 -234 -193 -396 -45 -101 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