File name: Pandora257s1_AustinTX_20250307_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250308T064634.9Z 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 v1.8.74 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250307_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: 20250307 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 20250307T165230.1Z 9197.703127 247 1 55.29 2 43.89 138.67 104.66 44.38 0.00 1 0.00 1 0 17 2.233e-02 1.206e-02 4.541e-03 2.635e-03 1.538477e-01 1.456993e-03 1.714711e-03 -6.000000e+00 1.412453e-02 226.44 -2.00 3.25 -2.00 315.70 0.00e+00 1.127677e-04 1.505954e-04 2.093189e-05 -6.000000e+00 6.464774e-04 284.17 -2.00 20.00 -2.00 315.01 0.00e+00 1.386 0.000 302.00 328.00 3 6.6728e+00 3.7516e-03 1.5299e-02 -6.0000e+00 3.4898e-02 1.8869e-02 4.1743e-03 7.2662e-03 -6.0000e+00 3.7782e-02 2.7833e-02 2.3862e-03 3.5527e-03 -6.0000e+00 2.2563e-02 -1.3795e-02 1.0375e-03 1.0047e-03 -6.0000e+00 9.3573e-03 1.5185e-04 7.4441e-04 9.4734e-05 1.6958e-05 -6.0000e+00 8.0617e-04 2.2299e-02 -5.1359e-05 12 9 8 11 8 0 99.95 27.70 0.66 0.02230 0.02789 21 2 1 5 0 2632.660 35.75 20.01 27.70 28.31 0.0 950.42 -6738 -4908 -2271 3432 -9669 -4574 -2656 -2651 -215 -1400 1778 -3058 746 4607 5928 -542 -1133 6071 3063 3721 6528 -502 4238 838 875 -2853 -2528 3083 -1613 1359 1570 29 -2629 -93 -5326 5984 -5753 -2303 -1123 -483 871 625 1427 -1157 -1090 -1712 -3273 803 -200 -368 858 3664 -193 2190 -41 161 -1004 305 647 971 478 1371 3449 242 -1529 -1619 1050 85 69 1383 293 1357 -306 373 18 1120 482 -3325 -1124 -437 -2783 -1758 -2547 -1665 443 -406 -111 431 878 440 -537 -1336 252 -595 230 1628 1068 210 -497 -170 175 -736 -207 -644 421 -829 -302 543 -112 1355 768 111 242 900 -390 -293 -461 -349 -322 -497 -88 -885 1066 1296 -422 181 82 107 1436 -338 -403 -782 536 316 -278 -216 -531 408 1161 735 -973 -764 -587 -1814 -1342 -595 803 -2433 -1074 -639 -686 -58 -391 490 -919 232 1508 2072 -213 -464 2376 1264 1556 2686 -224 1835 388 417 -1419 -1224 1345 -704 564 660 13 -1226 -42 -2514 2579 -3041 -1344 -676 -323 620 465 1076 -900 -843 -1311 -2477 565 -139 -257 609 2642 -150 1730 -34 135 -856 256 540 816 418 1251 3237 240 -1504 -1499 892 71 61 1302 299 1419 -325 380 17 973 388 -2665 -903 -376 -2683 -1818 -2831 -1782 494 -485 -138 550 1109 537 -619 -1553 267 -615 243 1815 1193 254 -629 -211 207 -835 -249 -729 498 -1050 -399 742 -160 1994 1168 170 354 1220 -497 -352 -549 -429 -420 -686 -124 -1266 1465 1708 -538 238 104 135 1842 -423 -523 -1045 722 440 -408 -332 -843 655 1864 1169 -1536 -1173 -890 SS 20250307T165613.1Z 9197.705707 250 1 0.44 2 43.36 139.78 104.12 44.96 0.00 1 0.00 1 0 17 8.087e-03 6.828e-03 4.409e-03 3.439e-03 1.622277e-01 1.927369e-03 1.822869e-03 -6.000000e+00 5.114746e-03 226.44 -2.00 3.25 -2.00 314.26 0.00e+00 2.247685e-04 1.514651e-04 1.433317e-05 -6.000000e+00 2.340822e-04 284.17 -2.00 20.00 -2.00 313.70 0.00e+00 1.374 0.000 302.00 328.00 3 2.5974e+00 4.8857e-03 1.5390e-02 -6.0000e+00 1.2637e-02 2.9683e-02 5.4061e-03 7.6401e-03 -6.0000e+00 1.3681e-02 -4.2961e-03 3.0996e-03 3.7394e-03 -6.0000e+00 8.1703e-03 -2.4279e-03 1.2968e-03 1.0533e-03 -6.0000e+00 3.3888e-03 8.9497e-03 7.8493e-05 1.2195e-04 1.9339e-05 -6.0000e+00 2.9190e-04 2.1212e-02 -6.7485e-05 12 9 1 12 1 1 999.00 27.71 0.31 0.02121 0.02180 2 36 1 5 0 145.270 35.75 20.01 27.71 28.45 0.0 951.55 268 -878 -1784 -1635 -1956 348 863 2545 383 -935 -1835 -811 -1029 662 946 26 -92 53 912 344 961 1155 1284 335 1448 574 192 -630 -217 1022 932 745 205 -1108 -1119 -385 -974 139 -355 -1637 -1144 -865 -505 -461 -540 -1075 -948 -787 -160 172 921 484 998 542 922 503 1040 500 368 1164 452 1207 1748 813 218 -687 -576 31 725 1044 -155 517 -88 509 248 -430 128 -29 147 242 -1589 -1504 -1868 -1597 -1169 -1111 -476 -444 18 8 275 13 623 294 1099 749 217 248 364 -232 -318 -628 -400 418 281 -741 -833 -666 -576 340 66 -216 89 86 -288 -14 23 774 511 851 -270 90 598 -39 479 550 479 553 1286 389 269 -230 -65 -156 -38 182 -550 294 -4 -147 -295 -332 -948 111 -382 -770 -704 -794 135 346 1078 166 -424 -854 -388 -504 332 512 14 -53 31 517 200 561 677 765 208 914 352 121 -381 -130 592 548 455 124 -678 -675 -235 -622 96 -262 -1324 -959 -730 -434 -398 -464 -913 -810 -651 -133 143 754 415 860 486 816 454 940 453 332 1052 425 1151 1688 811 214 -662 -539 28 687 1032 -156 538 -92 513 242 -411 115 -26 130 224 -1587 -1533 -1982 -1741 -1314 -1291 -577 -538 22 10 313 15 655 309 1141 813 251 292 444 -283 -381 -735 -453 481 332 -912 -1049 -853 -750 457 89 -294 118 110 -361 -18 28 950 648 1109 -357 119 772 -51 597 670 577 662 1533 477 343 -295 -85 -205 -52 250 -784 414 -5 -208 -415 -468 -1328 SS 20250307T165932.3Z 9197.708012 253 1 0.36 2 42.90 140.78 103.64 45.48 0.00 1 0.00 1 0 17 9.351e-03 7.453e-03 6.211e-03 4.848e-03 1.613822e-01 2.722980e-03 1.831258e-03 -6.000000e+00 5.913944e-03 226.44 -2.00 3.25 -2.00 314.25 0.00e+00 6.143568e-04 2.149693e-04 2.020535e-05 -6.000000e+00 2.706531e-04 284.17 -2.00 20.00 -2.00 313.71 0.00e+00 1.364 0.000 302.00 328.00 3 2.7848e+00 6.9020e-03 1.5314e-02 -6.0000e+00 1.4612e-02 3.1721e-02 7.6324e-03 7.6972e-03 -6.0000e+00 1.5819e-02 -4.6778e-03 4.3785e-03 3.7453e-03 -6.0000e+00 9.4468e-03 -1.2786e-03 1.8361e-03 1.1173e-03 -6.0000e+00 3.9184e-03 7.4836e-03 8.1421e-05 1.7181e-04 1.9380e-05 -6.0000e+00 3.3751e-04 2.1012e-02 -6.9268e-05 12 9 1 12 1 1 999.00 27.72 0.36 0.02101 0.02162 1 30 1 5 0 175.490 35.75 20.00 27.72 28.73 0.0 954.31 -413 -1504 -2592 -2784 -1805 -1202 -27 460 1317 -482 -1829 -4 803 -673 467 789 -231 729 242 1332 2240 1734 1922 872 555 656 317 740 -353 1654 3378 989 858 -1098 -977 -1018 -1321 -1179 -172 -1252 -1602 -924 -1408 164 -482 -1038 -1288 -819 -1189 -178 934 1583 641 996 39 -123 508 -8 643 337 -52 1978 990 98 221 -635 65 1048 285 611 999 -19 434 2 413 231 760 -94 -1033 -252 -561 -547 -1318 -1389 -971 -312 -898 -487 467 254 180 -103 212 138 -75 883 -312 693 -159 -275 -978 -402 -718 574 138 -1371 -725 -297 -51 54 201 -450 339 -403 292 -385 1034 677 624 -3 932 270 152 -165 787 -54 546 1159 1148 506 21 640 -789 -324 22 553 -794 273 -264 -813 -47 -382 -524 -179 -645 -1106 -1188 -716 -490 -11 194 583 -211 -826 -2 395 -349 248 441 -129 413 141 781 1315 1030 1158 522 343 407 193 447 -206 969 1977 586 524 -683 -598 -635 -859 -836 -128 -1014 -1353 -782 -1223 141 -415 -885 -1072 -682 -971 -144 769 1353 557 892 35 -112 462 -8 580 308 -49 1873 964 99 218 -612 60 950 271 607 1026 -20 452 2 414 220 685 -85 -929 -235 -555 -568 -1387 -1549 -1114 -368 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