File name: Pandora257s1_AustinTX_20240804_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240805T064458.4Z 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_20240804_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: 20240804 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 20240804T125040.2Z 8982.535187 64 1 54.77 2 78.69 76.77 79.53 72.47 0.00 1 0.00 1 0 17 2.859e-01 7.667e-03 4.143e-02 1.175e-03 6.195845e-01 6.633995e-04 6.607158e-03 -6.000000e+00 1.828977e-01 229.75 -2.00 3.25 -2.00 320.29 0.00e+00 7.642183e-04 2.631511e-04 1.621641e-03 -6.000000e+00 8.598261e-03 293.39 -2.00 20.00 -2.00 319.49 0.00e+00 4.922 0.001 302.00 328.00 3 1.4783e+00 2.0823e-03 5.6964e-02 -6.0000e+00 4.5400e-01 2.4962e-02 2.6326e-03 3.1489e-02 -6.0000e+00 4.8967e-01 -7.1684e-02 2.2021e-03 1.5346e-02 -6.0000e+00 2.9334e-01 2.1782e-02 1.0929e-03 4.1266e-03 -6.0000e+00 1.2199e-01 5.2975e-04 2.7444e-05 3.7822e-05 7.1195e-05 -6.0000e+00 1.0336e-02 2.7786e-02 -3.8176e-05 11 8 0 10 0 0 62.90 28.66 0.37 0.02779 0.02799 267 26 1 5 0 205.120 36.50 19.99 28.66 34.61 0.0 1000.97 -66337 -32633 -62808 -90864 -118630 -142352 -80989 -123893 -94894 -115029 8378 -77843 -54287 -26594 -17318 -20232 8237 18893 11133 5780 11708 -22180 22291 -7962 -3731 -32160 -20588 -13361 -18452 -8773 -5714 -3375 -4446 -2286 -11207 15291 -7096 654 -4381 4404 -770 1300 4269 -2962 -677 -1675 -1035 3762 -264 2095 2982 4684 1739 6391 -5 286 1229 1622 550 -697 655 1284 3751 931 -931 -363 2631 1245 116 1837 933 1259 -47 488 463 -529 244 -2764 -1138 -866 -1642 -900 -2150 -1412 -25 -43 280 596 1186 841 -527 258 -314 98 246 451 130 262 -233 -745 -465 -1020 -718 -567 -203 -1543 -881 -336 -75 653 279 205 38 275 -74 93 337 320 321 142 51 -245 506 581 251 280 133 349 852 11 -197 -279 -379 -195 31 -8 -135 262 466 -213 -122 -255 -380 -415 -163 -445 -937 -1605 -2529 -854 -2258 -1447 -2373 57 -1472 -996 -457 -328 -459 159 359 246 142 283 -786 539 -282 -136 -1626 -942 -573 -863 -408 -295 -196 -289 -153 -844 934 -612 62 -519 556 -114 204 682 -524 -120 -305 -193 693 -49 408 634 1084 454 1722 -2 91 395 521 178 -230 224 476 1499 380 -403 -157 1121 566 58 1010 517 722 -27 288 254 -270 119 -1426 -639 -515 -1131 -693 -1708 -1198 -22 -38 259 560 1103 758 -489 225 -271 88 225 468 145 305 -290 -936 -555 -1212 -806 -636 -238 -1823 -1101 -449 -103 979 432 332 63 435 -113 137 499 490 514 234 85 -398 792 875 385 416 196 534 1343 18 -359 -518 -713 -388 62 -16 -294 577 1019 -454 -248 -519 -760 SS 20240804T125622.0Z 8982.539143 67 1 54.51 2 77.49 77.43 78.39 73.10 0.00 1 0.00 1 0 25 5.221e-01 2.345e-02 2.148e-01 4.872e-03 5.520756e-01 2.822677e-03 5.840981e-03 -6.000000e+00 3.373874e-01 229.75 -2.00 3.25 -2.00 320.68 0.00e+00 -1.278033e-03 1.253888e-03 1.508825e-03 -6.000000e+00 1.761735e-02 293.39 -2.00 20.00 -2.00 319.90 0.00e+00 4.486 0.001 302.00 328.00 3 4.1457e+00 9.3820e-03 5.1923e-02 -6.0000e+00 8.4123e-01 6.6929e-02 1.2223e-02 2.9564e-02 -6.0000e+00 9.1211e-01 -1.4293e-01 1.0266e-02 1.3384e-02 -6.0000e+00 5.4439e-01 6.1885e-02 4.9448e-03 4.2214e-03 -6.0000e+00 2.2669e-01 5.8671e-05 -4.3113e-04 1.7395e-04 5.3945e-05 -6.0000e+00 1.9143e-02 3.0373e-02 -1.6243e-04 12 8 8 10 0 0 99.96 28.66 0.44 0.03037 0.02713 51 5 1 5 0 1068.710 36.50 20.00 28.66 35.00 0.0 1003.79 900000 260406 900000 900000 -148645 -145908 -47314 -164930 130863 -32823 900000 -101132 231043 29322 900000 16105 140730 900000 900000 207042 3873 17482 900000 113013 94780 -66456 -25911 91382 -2375 27037 63897 14843 -5354 63478 -21911 900000 -30317 11746 -12991 34851 26132 21309 66059 -11999 7904 -9579 -5703 41535 10568 17765 26042 36168 315 29795 -4563 185 1807 -3793 7347 -7272 -7606 88 19582 -1262 -10581 -3063 15529 3546 -1745 6489 1693 4374 -2213 2548 2879 2123 7622 -11671 199 -2134 -5402 -730 -6225 -667 4001 -589 -1073 921 2037 1918 -6979 -3049 895 18 606 2858 388 518 -1886 -1622 1102 -1338 1272 -2530 495 -2837 -1300 1358 542 2841 -440 642 -89 2274 -414 183 -566 -652 -455 -1018 -472 -1153 1313 3587 -534 -452 1381 -824 2063 -863 -928 -392 539 653 -942 -327 -388 778 1628 -654 -216 -676 -351 900000 1235 900000 900000 -3781 -3712 -490 -6187 621 -396 900000 -3052 1096 341 900000 285 868 900000 900000 982 116 473 900000 1340 1438 -5232 -1364 1474 -99 898 1636 697 -335 2077 -1715 900000 -3048 914 -1534 2942 2665 2436 5013 -2026 1106 -1613 -936 4354 1574 2629 3866 5318 72 5441 -1240 50 488 -1085 1864 -2152 -2359 27 5470 -465 -4396 -1175 4957 1330 -752 2850 842 2195 -1175 1230 1285 881 2852 -5392 89 -1116 -3331 -481 -4300 -468 2862 -468 -896 770 1675 1524 -5723 -2273 687 14 476 2475 390 576 -2271 -1947 1227 -1425 1258 -2618 522 -3269 -1567 1709 745 4162 -657 983 -136 3309 -591 275 -856 -937 -684 -1592 -738 -1781 1920 5387 -802 -656 1942 -1225 3228 -1396 -1625 -725 1042 1331 -2063 -689 -841 1693 3498 -1395 -476 -1431 -727 SS 20240804T130043.5Z 8982.542170 70 1 54.78 2 76.57 77.94 77.52 73.58 0.00 1 0.00 1 0 25 1.498e-01 6.751e-03 1.153e-02 7.273e-04 5.386886e-01 4.038643e-04 5.760335e-03 -6.000000e+00 9.583526e-02 229.75 -2.00 3.25 -2.00 319.50 0.00e+00 5.369831e-04 1.225742e-04 9.332138e-04 -6.000000e+00 4.505647e-03 293.39 -2.00 20.00 -2.00 318.63 0.00e+00 4.200 0.001 302.00 328.00 3 1.3665e+00 1.1703e-03 4.8613e-02 -6.0000e+00 2.3789e-01 6.9100e-03 1.3918e-03 2.6430e-02 -6.0000e+00 2.5658e-01 -4.6195e-02 1.0346e-03 1.2795e-02 -6.0000e+00 1.5371e-01 1.2865e-02 5.3128e-04 3.4610e-03 -6.0000e+00 6.3918e-02 1.2575e-03 -4.0076e-05 2.4067e-05 5.1884e-05 -6.0000e+00 5.4162e-03 2.7851e-02 -4.9402e-05 11 8 0 10 0 0 82.42 28.66 0.34 0.02785 0.02755 414 40 1 5 0 132.290 36.50 20.00 28.66 35.24 0.0 1005.46 -45139 -41695 -48281 -47963 -60649 -70200 -46944 -57551 -39673 -53242 -22311 -36786 -23793 -11042 -13865 -11972 -7165 -1595 494 -2697 -1003 -10250 2217 -4050 -3486 -10637 -8483 -6951 -7852 -5734 -3155 -2977 -2820 -1882 -6917 2998 -4143 -219 -1535 1505 -500 996 2305 -150 859 -192 -588 1178 307 1199 2179 2636 1131 2775 888 848 1271 695 536 87 961 1860 2737 1695 510 -165 983 482 942 1367 692 711 71 -71 126 -756 -478 -1615 -918 -1218 -1584 -1350 -2097 -1472 -478 -158 47 364 604 530 60 375 -222 197 432 223 130 325 -17 -669 -665 -939 -827 -380 -312 -1318 -781 -439 -192 367 344 195 58 217 -72 141 360 411 353 334 -66 -88 507 588 367 451 93 599 838 65 -33 -162 -303 -162 20 -29 -169 341 333 -292 -237 -268 -542 -692 -683 -877 -861 -1217 -1593 -919 -1400 -895 -1503 -511 -1125 -766 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