File name: Pandora257s1_AustinTX_20240829_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240830T063927.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240829_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240829 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20240829T135335.2Z 9007.578879 230 1 2.53 2 67.84 92.34 16.87 94.26 0.00 1 0.00 1 0 17 1.447e-02 6.103e-03 3.898e-03 1.414e-03 3.337579e-01 7.799185e-04 3.656021e-03 -6.000000e+00 9.226327e-03 229.04 -2.00 3.25 -2.00 317.03 0.00e+00 4.257206e-04 1.124979e-04 1.631027e-04 -6.000000e+00 4.342433e-04 292.98 -2.00 20.00 -2.00 316.12 0.00e+00 2.628 0.000 302.00 328.00 3 1.4102e+00 2.0518e-03 3.0150e-02 -6.0000e+00 2.2865e-02 1.2132e-02 2.3024e-03 1.5901e-02 -6.0000e+00 2.4679e-02 -8.4616e-03 1.3343e-03 7.7080e-03 -6.0000e+00 1.4789e-02 8.0047e-04 6.2460e-04 2.1194e-03 -6.0000e+00 6.1542e-03 6.6425e-03 2.8302e-05 4.9459e-05 3.2102e-05 -6.0000e+00 5.2276e-04 2.8802e-02 -6.6453e-05 12 1 1 12 1 1 91.51 28.13 0.32 0.02880 0.02901 30 65 1 5 0 81.340 36.00 20.00 28.13 32.16 0.0 981.12 -3484 -3330 -6391 -6256 -5764 -4064 -4004 -3014 -2903 -3016 -3038 -1799 -941 42 1503 72 -311 1047 908 1792 1218 217 2371 1844 767 -600 64 -742 -537 -151 703 737 182 -496 -2825 -1522 -1077 -377 -316 -164 -485 -648 71 -67 10 -159 -413 334 -179 104 1044 789 911 1491 488 707 906 523 640 873 962 1579 1330 1396 -94 -361 340 207 874 1217 119 -85 -346 -309 -192 -595 -441 -876 -392 -887 -1297 -1436 -1727 -1873 -1056 -543 -218 -205 320 273 168 396 73 344 698 454 206 425 36 -705 -580 -535 -522 50 -39 -1185 -856 -525 -116 414 434 293 163 156 -55 231 448 279 426 442 25 43 402 417 371 586 283 664 1084 203 138 -184 -369 3 19 -69 -218 217 67 -516 -352 -413 -403 -414 -422 -842 -796 -702 -488 -512 -417 -434 -477 -508 -297 -174 9 325 17 -81 283 256 481 336 62 686 564 248 -201 21 -239 -170 -49 239 253 66 -186 -1088 -600 -438 -166 -153 -90 -276 -371 42 -40 6 -95 -246 197 -107 64 671 517 635 1038 356 505 654 379 461 635 727 1213 1096 1153 -79 -293 277 170 731 1066 109 -81 -329 -282 -170 -504 -363 -714 -336 -781 -1231 -1448 -1817 -2034 -1173 -618 -259 -241 385 317 188 426 78 361 745 517 244 533 46 -902 -727 -650 -631 61 -49 -1535 -1132 -710 -162 592 634 435 243 227 -78 318 614 385 601 636 37 63 586 584 511 793 373 884 1516 289 203 -282 -573 5 31 -113 -372 366 113 -881 -581 -676 -649 SS 20240829T140139.3Z 9007.584482 233 1 23.55 2 66.10 93.40 15.17 95.79 0.00 1 0.00 1 0 17 5.289e-02 1.184e-02 1.757e-02 3.727e-03 3.029745e-01 2.044027e-03 3.323118e-03 -6.000000e+00 3.370507e-02 229.04 -2.00 3.25 -2.00 317.97 0.00e+00 -2.401384e-04 3.829100e-04 1.296966e-04 -6.000000e+00 1.587693e-03 292.98 -2.00 20.00 -2.00 317.04 0.00e+00 2.450 0.000 302.00 328.00 3 5.2057e+00 5.4980e-03 2.7977e-02 -6.0000e+00 8.3527e-02 1.6413e-02 6.2464e-03 1.4648e-02 -6.0000e+00 9.0175e-02 3.1111e-02 3.8406e-03 7.0794e-03 -6.0000e+00 5.4037e-02 -1.8313e-02 1.8975e-03 1.9371e-03 -6.0000e+00 2.2468e-02 1.8272e-04 -2.6069e-04 1.3339e-04 2.9347e-05 -6.0000e+00 1.9110e-03 3.0841e-02 -2.0604e-04 12 9 9 12 9 1 99.64 28.14 0.27 0.03084 0.02888 6 2 1 5 0 3363.250 36.00 20.00 28.14 33.00 0.0 988.73 -10541 -7113 -7697 34191 -18852 -6922 -7507 -14366 -6469 -8101 -2185 -11895 2480 7180 8608 -4266 2289 13482 6002 7110 17246 -2633 8447 1354 3963 -9836 -5202 3862 -3822 1722 1680 723 -8013 -891 -8126 10198 -7349 -3983 -3749 398 1848 881 2623 -272 766 -3013 -4560 1357 370 502 2055 5628 -123 2216 -1149 1221 -241 -1047 2280 1119 55 669 4204 655 -3303 -734 1390 574 865 1989 636 928 -1345 128 93 522 1020 -3205 83 -1871 -2921 -1671 -2780 -1632 -17 -366 222 679 339 185 128 -811 1482 626 1131 2029 864 733 -1045 -157 -303 -1241 -319 -637 -147 -655 -941 -487 37 1131 1058 -221 122 467 -197 -252 156 280 -39 -535 -347 -654 629 1386 -137 67 399 432 771 18 -962 -397 214 562 -362 -58 -621 489 1043 75 -543 -456 -383 -739 -512 -560 1578 -1425 -468 -546 -1227 -553 -742 -199 -1293 262 825 1092 -671 359 1990 995 1204 2702 -515 1535 278 830 -2410 -1203 790 -827 358 369 172 -2193 -231 -2268 2461 -2343 -1423 -1415 163 813 413 1243 -134 375 -1525 -2319 645 178 248 1056 2974 -73 1349 -750 797 -161 -707 1483 745 39 496 2938 493 -2568 -535 1044 438 643 1594 554 835 -1233 111 75 386 763 -2459 65 -1507 -2643 -1637 -2734 -1689 -18 -423 267 830 413 217 141 -836 1528 645 1221 2191 1042 960 -1349 -198 -394 -1537 -378 -772 -188 -886 -1247 -677 55 1729 1576 -336 194 696 -278 -338 207 386 -56 -820 -540 -1016 940 1977 -190 95 549 600 1041 26 -1480 -632 349 888 -607 -102 -1126 893 1896 135 -952 -774 -641 SS 20240829T141300.8Z 9007.592370 239 1 56.15 2 63.66 94.92 12.79 98.42 0.00 1 0.00 1 0 17 1.088e-01 2.068e-02 2.135e-02 4.118e-03 2.647194e-01 2.254471e-03 2.892399e-03 -6.000000e+00 6.926581e-02 229.04 -2.00 3.25 -2.00 318.04 0.00e+00 -8.737319e-04 4.252530e-04 2.547143e-04 -6.000000e+00 3.265080e-03 292.98 -2.00 20.00 -2.00 317.10 0.00e+00 2.240 0.000 302.00 328.00 3 6.2822e+00 6.0655e-03 2.5230e-02 -6.0000e+00 1.7165e-01 -1.0064e-02 6.9116e-03 1.2747e-02 -6.0000e+00 1.8537e-01 6.2783e-02 4.2537e-03 6.2133e-03 -6.0000e+00 1.1108e-01 -2.9565e-02 2.0916e-03 1.7650e-03 -6.0000e+00 4.6142e-02 8.1126e-05 -6.4514e-04 1.4910e-04 2.4827e-05 -6.0000e+00 3.9308e-03 3.1910e-02 -4.0095e-04 12 9 8 11 8 0 99.99 28.14 0.95 0.03191 0.02706 17 2 1 5 0 3302.490 36.00 20.00 28.14 34.18 0.0 996.95 -858 -131 12439 86950 -21046 4116 -28420 -30936 -2741 2269 -8751 -7960 4164 21644 24299 -7118 5168 24790 15606 3121 32654 -3952 25724 4838 9087 -16772 -1868 4576 -4785 2475 4126 3367 -9354 -2804 -14089 25501 -10735 -2906 -8666 902 5508 1920 5023 -2848 -2327 -7456 -5287 5688 -85 1613 4325 8570 -867 4279 -2816 204 -612 -1647 3232 1349 -2512 -103 6968 -1200 -6221 -662 3670 718 -603 329 1338 2363 -343 1573 520 1529 2486 -5787 -485 -3232 -2559 -197 -6626 -416 1051 -161 193 1244 1151 581 -2183 -1063 2000 113 553 3009 2442 558 -1541 -370 822 -1963 1260 -55 426 -1180 -397 727 641 1779 799 -467 -402 1571 -292 -637 -348 -628 -671 -1333 3 -1493 1184 1762 -1548 -145 1188 -780 669 -473 -1434 -1262 1145 376 -568 84 -125 442 1539 1277 -1102 -1200 233 -55 -9 736 2584 -1775 273 -2796 -3429 -248 205 -924 -898 463 2277 2761 -1198 813 3355 2406 563 4484 -802 4029 983 1850 -4499 -425 943 -1053 511 878 768 -2535 -721 -4056 5141 -3453 -1002 -3682 393 2490 946 2463 -1387 -1127 -3773 -2836 2698 -43 815 2235 4508 -481 2601 -1728 124 -380 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