File name: Pandora257s1_AustinTX_20240506_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240511T150429.2Z 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_20240506_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: 20240506 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 20240506T144214.1Z 8892.612663 157 1 32.23 2 52.86 91.26 39.09 112.60 0.00 1 0.00 1 0 17 2.205e-02 8.782e-03 6.229e-03 2.423e-03 2.440082e-01 1.343925e-03 2.665944e-03 -6.000000e+00 1.415301e-02 230.47 -2.00 3.25 -2.00 316.82 0.00e+00 -1.769321e-04 1.796449e-04 1.193206e-04 -6.000000e+00 6.490396e-04 288.25 -2.00 20.00 -2.00 316.00 0.00e+00 1.652 0.000 302.00 328.00 3 5.6875e+00 3.5366e-03 2.0003e-02 -6.0000e+00 3.5259e-02 1.6846e-02 3.9511e-03 1.1673e-02 -6.0000e+00 3.8036e-02 1.0203e-02 2.2868e-03 5.6501e-03 -6.0000e+00 2.2697e-02 -8.0217e-03 1.0507e-03 1.5492e-03 -6.0000e+00 9.3783e-03 2.6300e-04 3.7795e-04 8.6416e-05 2.3624e-05 -6.0000e+00 7.9713e-04 2.3069e-02 -3.6768e-05 12 9 1 12 1 1 99.99 28.18 0.33 0.02307 0.02591 26 4 1 5 0 1193.340 36.00 19.99 28.18 31.70 0.0 985.68 432 -5176 -10522 5227 -7526 -7083 -6067 -6252 89 1967 -2446 -2537 -497 3556 2643 -1799 -35 1443 4392 1504 6251 -207 6202 840 1402 -2275 -226 -2018 -3292 -1860 2931 2316 -896 -1053 -2880 -3740 -4080 -3491 26 72 189 670 1327 -1004 -253 -793 -1875 940 350 582 1149 2431 205 2650 -735 122 744 394 777 547 -900 1114 2823 469 -936 -1611 1427 461 99 1542 520 1073 167 819 235 -497 -310 -1274 -469 -1152 -1541 -1302 -2745 -1766 -371 -1118 -264 284 888 773 -171 -112 -95 -450 407 1278 396 308 -633 30 -427 -1034 -764 -30 119 -912 -443 208 73 1079 239 70 -43 506 -283 -255 71 543 173 -248 269 -366 525 1021 -126 416 63 180 898 131 -279 -287 45 562 -167 338 -440 43 827 -93 -516 -640 -663 58 -766 -1636 664 -1035 -962 -860 -965 14 313 -421 -465 -98 753 623 -477 -10 405 1238 448 1808 -65 1874 279 482 -823 -79 -688 -1097 -609 949 797 -332 -395 -1094 -1472 -1606 -1571 13 41 116 431 796 -622 -155 -529 -1240 593 220 371 759 1675 139 1836 -543 91 558 296 579 412 -713 916 2415 424 -849 -1401 1149 373 85 1413 476 1015 159 748 218 -427 -246 -989 -375 -1012 -1499 -1274 -2921 -1977 -436 -1305 -320 351 1086 912 -205 -124 -99 -458 427 1439 457 386 -834 39 -531 -1223 -939 -38 145 -1183 -601 294 101 1559 361 106 -64 699 -393 -337 93 728 246 -347 384 -525 780 1452 -172 541 79 227 1172 182 -408 -433 65 837 -262 552 -749 69 1424 -159 -859 -1036 -1058 SS 20240506T153453.5Z 8892.649230 201 1 41.53 2 41.53 98.83 29.24 126.91 0.00 1 0.00 1 0 17 1.379e-02 7.649e-03 3.031e-03 1.653e-03 1.962640e-01 9.231143e-04 2.153172e-03 -6.000000e+00 8.852922e-03 230.47 -2.00 3.25 -2.00 315.91 0.00e+00 2.102765e-04 9.991185e-05 6.191648e-05 -6.000000e+00 4.059120e-04 288.25 -2.00 20.00 -2.00 315.14 0.00e+00 1.334 0.000 302.00 328.00 3 5.6729e+00 2.4008e-03 1.6113e-02 -6.0000e+00 2.2055e-02 1.1797e-02 2.6670e-03 9.3393e-03 -6.0000e+00 2.3791e-02 1.3466e-02 1.5223e-03 4.5282e-03 -6.0000e+00 1.4197e-02 -6.7905e-03 6.6633e-04 1.2406e-03 -6.0000e+00 5.8670e-03 3.9492e-04 4.3685e-04 5.9046e-05 2.0388e-05 -6.0000e+00 4.9852e-04 2.2712e-02 -5.7082e-06 12 9 1 12 1 1 99.99 28.35 0.61 0.02271 0.02599 49 6 1 5 0 830.520 36.25 20.00 28.35 32.42 0.0 990.50 -2148 -3339 -5336 1074 -5662 -3518 -1729 -1181 697 -1172 -1043 -1678 57 2092 1852 -977 -1801 1130 2575 2412 3521 651 3707 1444 811 -740 -264 -690 -615 2460 2008 570 7 -513 -2834 3703 -3363 -1700 -119 -475 -388 -278 -203 -1092 -489 -859 -1219 214 -564 323 414 1884 270 1813 -326 266 641 503 620 692 -424 1550 2379 589 -765 -1214 725 450 199 1438 263 609 -307 494 384 19 -42 -1694 -706 -867 -1160 -1686 -2111 -1716 -613 -832 112 145 365 573 -268 -415 59 -18 514 975 388 590 -320 -227 -364 -1083 -452 -104 108 -919 -575 -16 12 683 418 48 3 336 -150 -158 366 295 230 143 284 -235 450 679 1 868 483 435 880 -47 -235 -269 -148 301 -212 195 -251 194 511 -209 -400 -720 -640 -494 -811 -1309 235 -1254 -751 -379 -278 172 -304 -277 -471 17 616 597 -345 -670 421 972 933 1366 263 1484 612 357 -335 -116 -292 -250 956 804 242 3 -229 -1279 1602 -1704 -970 -70 -318 -280 -210 -145 -791 -351 -662 -921 156 -406 232 308 1447 204 1400 -264 218 528 414 507 571 -366 1386 2223 575 -744 -1124 623 383 178 1376 253 607 -309 476 373 17 -34 -1369 -581 -776 -1143 -1686 -2267 -1947 -684 -987 138 183 458 691 -305 -466 61 -18 533 1086 474 725 -413 -289 -444 -1259 -543 -127 130 -1179 -771 -22 17 970 614 71 4 448 -199 -198 453 377 310 205 390 -325 645 933 1 1079 623 559 1088 -62 -322 -379 -214 418 -310 297 -397 311 822 -333 -623 -1094 -960 SS 20240506T153912.2Z 8892.652224 204 1 54.58 2 40.61 99.54 28.50 128.42 0.00 1 0.00 1 0 17 2.684e-02 1.198e-02 5.687e-03 2.628e-03 1.864130e-01 1.460701e-03 2.019603e-03 -6.000000e+00 1.723520e-02 230.47 -2.00 3.25 -2.00 316.53 0.00e+00 -3.421656e-04 1.807661e-04 3.277977e-05 -6.000000e+00 7.900516e-04 288.25 -2.00 20.00 -2.00 315.71 0.00e+00 1.316 0.000 302.00 328.00 3 6.5736e+00 3.8283e-03 1.5664e-02 -6.0000e+00 4.2938e-02 -2.5968e-02 4.2707e-03 8.8429e-03 -6.0000e+00 4.6314e-02 3.1066e-02 2.4484e-03 4.2851e-03 -6.0000e+00 2.7637e-02 -1.4068e-02 1.0934e-03 1.1923e-03 -6.0000e+00 1.1424e-02 1.6861e-04 6.5653e-04 9.4852e-05 1.8404e-05 -6.0000e+00 9.7034e-04 2.2015e-02 2.5653e-05 12 8 8 10 0 0 100.00 28.36 0.80 0.02202 0.02695 115 11 2 5 0 474.540 36.25 20.00 28.36 32.69 0.0 993.06 1189 -8267 -11415 439 -7603 -8344 -1644 -4795 -1841 -5084 833 -1479 -546 5838 3624 -1575 -3196 4386 5923 2902 7519 303 8109 950 1326 -3435 -1707 -275 -1988 5088 914 1505 359 -1354 -4032 10283 -5259 -3400 -755 811 500 1076 1267 -2198 -675 -1440 -1929 1556 840 189 271 3018 96 2758 -1821 182 156 373 -314 335 -1168 1291 4080 -403 -1799 -2591 1428 625 -1505 1801 -99 1231 -1027 836 1697 412 989 -1879 -129 -1637 -1109 -2038 -2672 -1323 -58 -1384 133 586 680 993 -1079 457 264 -339 1232 2125 726 644 -548 -701 -354 -1463 -158 175 619 -1435 -773 67 -7 1175 -65 -417 139 1016 -341 162 444 204 205 134 324 -796 335 1364 -696 67 472 81 1355 -225 -683 -541 -131 464 -508 212 -582 551 1188 -370 -204 -739 -407 208 -1653 -2332 76 -1349 -1471 -284 -927 -369 -1093 173 -329 -130 1440 996 -485 -1043 1368 1870 967 2430 107 2704 353 509 -1398 -669 -102 -716 1681 322 550 137 -528 -1600 3622 -2364 -1719 -390 464 311 696 837 -1513 -456 -967 -1271 965 515 118 174 1980 68 1976 -1404 140 122 289 -244 261 -956 1089 3525 -374 -1661 -2281 1142 498 -1283 1611 -97 1234 -1054 814 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