File name: Pandora257s1_AustinTX_20240601_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240602T063448.2Z 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_20240601_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: 20240601 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 20240601T123608.8Z 8918.525102 177 1 54.69 2 77.59 71.41 37.01 137.84 0.00 1 0.00 1 0 17 3.156e-01 8.304e-03 1.049e-01 1.725e-03 5.662492e-01 9.688621e-04 5.976901e-03 -6.000000e+00 2.027983e-01 230.95 -2.00 3.25 -2.00 320.21 0.00e+00 1.260803e-03 3.710057e-04 1.102747e-03 -6.000000e+00 9.369703e-03 290.35 -2.00 20.00 -2.00 319.46 0.00e+00 4.520 0.001 302.00 328.00 3 2.5655e+00 2.9939e-03 5.2199e-02 -6.0000e+00 5.0544e-01 -5.0173e-03 3.7266e-03 2.8258e-02 -6.0000e+00 5.4494e-01 -3.8673e-02 3.1412e-03 1.4126e-02 -6.0000e+00 3.2548e-01 5.1178e-03 1.5689e-03 4.1498e-03 -6.0000e+00 1.3460e-01 2.7490e-04 -7.1929e-05 5.7368e-05 6.4563e-05 -6.0000e+00 1.1410e-02 2.6383e-02 -3.5225e-05 11 8 0 10 0 0 63.20 28.00 0.44 0.02638 0.02584 121 12 1 5 0 451.900 36.00 20.00 28.00 29.91 0.0 970.46 -41195 -55247 -108320 11136 -104274 -105592 -107947 -91817 -67429 -42082 96002 -33028 -14803 215688 25780 -1622 -3402 57596 32938 15483 45455 -17821 48035 1853 -89 -27395 -19184 -7877 -23743 7491 -3773 1789 -9984 -3451 -18257 19574 -18323 -4831 -2825 3343 -982 4215 5465 -4098 -1144 -3197 -1630 4839 1528 4154 3901 5507 1753 5788 -2492 -1271 1249 166 307 716 -2596 1806 6344 1241 -1374 -1035 3962 1281 168 686 672 2008 -323 903 705 39 -378 -3416 -682 -944 -1241 -1679 -2582 -1186 262 -453 140 567 1077 804 -734 -22 127 198 331 973 263 252 -148 -560 -614 -1212 -14 -241 22 -1214 -1190 -270 -40 733 142 189 -60 415 170 150 304 62 64 115 -60 -539 614 920 -286 244 -64 550 901 -153 -331 -263 -315 -36 -97 50 -200 359 425 -200 -87 -264 -252 -265 -456 -1590 49 -1451 -1534 -1925 -1560 -998 -531 339 -494 -224 399 382 -37 -88 882 693 409 925 -710 1050 69 -4 -1525 -997 -367 -1334 334 -213 109 -754 -257 -1612 1248 -1917 -521 -355 458 -156 686 921 -782 -217 -630 -323 928 318 903 930 1293 466 1591 -787 -413 404 54 100 236 -927 670 2475 549 -645 -484 1773 614 81 367 389 1191 -195 514 373 21 -195 -1849 -361 -572 -864 -1215 -2063 -1005 234 -433 129 533 1003 782 -686 -19 109 173 317 971 300 297 -186 -711 -744 -1379 -17 -277 26 -1463 -1523 -368 -55 1097 217 300 -95 639 266 228 463 98 100 185 -98 -863 942 1442 -436 357 -93 821 1454 -259 -572 -484 -613 -69 -199 108 -424 770 908 -418 -183 -534 -501 SS 20240601T124133.7Z 8918.528862 180 1 54.73 2 76.48 72.01 36.24 139.64 0.00 1 0.00 1 0 17 1.715e-01 7.235e-03 2.665e-02 1.299e-03 5.282630e-01 7.260109e-04 5.590252e-03 -6.000000e+00 1.102010e-01 230.95 -2.00 3.25 -2.00 319.79 0.00e+00 1.595947e-03 2.395806e-04 8.333368e-04 -6.000000e+00 5.091388e-03 290.35 -2.00 20.00 -2.00 318.99 0.00e+00 4.174 0.001 302.00 328.00 3 2.4501e+00 2.1502e-03 4.8239e-02 -6.0000e+00 2.7466e-01 -3.0538e-03 2.5916e-03 2.5955e-02 -6.0000e+00 2.9612e-01 -3.4280e-02 2.0422e-03 1.2943e-02 -6.0000e+00 1.7686e-01 3.6316e-03 1.0360e-03 3.9775e-03 -6.0000e+00 7.3143e-02 4.4045e-04 -4.4823e-05 4.3628e-05 5.9201e-05 -6.0000e+00 6.2003e-03 2.5906e-02 -4.4188e-05 11 8 0 10 0 0 55.90 28.00 0.34 0.02591 0.02557 161 16 1 5 0 339.870 36.00 20.00 28.00 30.29 0.0 974.34 -30944 -49796 -71246 -36393 -74206 -76437 -67800 -59016 -43114 -51820 24018 -39361 -20994 28207 1561 -16200 5419 17921 13402 8652 15634 -8088 17871 -1544 -3912 -18271 -11457 -9676 -12517 -33 -1649 -475 -7639 -4345 -12283 6726 -13298 -1197 416 3357 -131 2565 2614 -2847 300 -826 -1233 2315 530 1492 2545 3876 964 2988 -464 -128 753 229 133 -428 -1253 1877 4162 1324 -225 -4 1462 944 422 1065 763 1324 24 568 277 250 -206 -1871 -281 -585 -1514 -1203 -2204 -1518 -95 -573 -19 643 772 725 -136 16 149 -54 426 666 211 363 -73 -676 -639 -968 -589 -192 99 -1484 -967 -446 -153 417 206 236 134 216 56 -98 324 102 331 155 -122 -269 533 866 12 338 117 507 975 -151 -235 -172 -187 -153 3 50 -150 394 434 -335 -168 -244 -486 -333 -719 -1327 -475 -1392 -1501 -1323 -1174 -809 -1156 277 -988 -527 525 45 -643 193 613 513 365 638 -434 779 -87 -241 -1350 -799 -662 -901 -2 -129 -41 -783 -451 -1409 670 -1812 -170 69 622 -25 519 553 -654 68 -193 -294 547 133 395 725 1194 332 1081 -183 -52 311 95 55 -181 -513 807 1915 672 -119 -2 758 510 249 638 495 888 16 364 166 150 -118 -1102 -178 -389 -1158 -953 -1924 -1413 -87 -559 -20 665 794 721 -129 15 138 -51 407 715 242 432 -93 -862 -778 -1175 -678 -221 120 -1811 -1246 -612 -214 629 317 376 214 331 87 -147 484 158 508 247 -197 -427 816 1345 18 490 166 744 1537 -250 -398 -310 -337 -292 6 101 -313 831 912 -690 -331 -484 -953 SS 20240601T125150.7Z 8918.536004 183 1 54.65 2 74.36 73.13 34.83 143.25 0.00 1 0.00 1 0 17 8.046e-02 6.104e-03 7.497e-03 7.316e-04 4.661508e-01 4.058365e-04 4.982921e-03 -6.000000e+00 5.170653e-02 230.95 -2.00 3.25 -2.00 319.00 0.00e+00 1.004732e-03 1.028767e-04 4.557043e-04 -6.000000e+00 2.388861e-03 290.35 -2.00 20.00 -2.00 318.15 0.00e+00 3.642 0.001 302.00 328.00 3 1.9865e+00 1.1390e-03 4.2168e-02 -6.0000e+00 1.2887e-01 -9.1840e-03 1.3179e-03 2.2664e-02 -6.0000e+00 1.3894e-01 -2.8945e-02 9.1170e-04 1.1033e-02 -6.0000e+00 8.2984e-02 5.6093e-03 4.6642e-04 3.1875e-03 -6.0000e+00 3.4319e-02 1.2316e-03 2.1867e-05 2.4951e-05 4.5036e-05 -6.0000e+00 2.9091e-03 2.5969e-02 -3.8661e-05 10 0 0 10 0 0 13.94 28.00 0.36 0.02597 0.02613 325 31 1 5 0 168.130 36.00 20.00 28.00 31.06 0.0 979.59 -18938 -24931 -31273 -26040 -36508 -40594 -23773 -24627 -25036 -24698 -12249 -14789 -10772 -834 994 -4605 -1774 2949 3166 -1062 4309 -2869 4545 -199 -1183 -4882 -3662 -4585 -4074 -594 -415 -21 -3308 -1706 -5492 768 -4726 -481 -31 870 -305 364 894 -916 28 -205 -574 843 475 845 1412 2169 1258 1995 191 614 944 631 480 837 747 1497 2310 1401 154 -333 716 542 617 1198 486 532 130 233 14 -295 -452 -1434 -643 -938 -1267 -1535 -1963 -1658 -815 -593 -150 223 668 495 63 317 70 147 471 511 164 393 -114 -548 -599 -657 -570 -42 -158 -1184 -811 -425 -157 282 396 107 36 147 -55 94 427 304 350 280 -103 -178 486 488 247 502 107 582 884 141 44 -108 -253 -84 13 7 -180 223 272 -307 -244 -247 -500 -451 -692 -953 -741 -1128 -1329 -709 -821 -920 -976 -465 -652 -537 -45 61 -340 -140 240 272 -100 396 -292 451 -22 -140 -620 -461 -577 -514 -76 -59 -3 -530 -279 -948 130 -944 -108 -8 239 -93 118 301 -322 10 -73 -208 306 178 333 552 914 577 968 99 305 476 320 242 426 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