File name: Pandora257s1_AustinTX_20241117_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241119T080059.4Z 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 v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20241117_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: 20241117 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 20241117T164923.8Z 9087.700970 393 1 54.64 2 53.67 154.33 107.16 317.37 0.00 1 0.00 1 0 17 7.517e-03 6.020e-03 1.545e-04 1.126e-04 1.765742e-01 6.243809e-05 2.005202e-03 -6.000000e+00 4.724815e-03 224.82 -2.00 3.25 -2.00 314.70 0.00e+00 3.909659e-04 5.420713e-06 1.641462e-05 -6.000000e+00 2.200768e-04 286.96 -2.00 20.00 -2.00 314.07 0.00e+00 1.684 0.000 302.00 328.00 3 7.0270e-01 1.5835e-04 1.8327e-02 -6.0000e+00 1.1619e-02 -9.2618e-03 1.7561e-04 8.3531e-03 -6.0000e+00 1.2587e-02 3.0527e-03 1.0062e-04 4.0854e-03 -6.0000e+00 7.5397e-03 -4.5119e-03 4.2799e-05 1.1757e-03 -6.0000e+00 3.1461e-03 4.3718e-02 2.0425e-04 4.0098e-06 2.0663e-05 -6.0000e+00 2.7120e-04 2.3363e-02 -2.3895e-05 10 0 0 10 0 0 99.72 27.87 0.33 0.02336 0.02490 2686 259 1 5 0 20.340 35.75 20.00 27.87 30.07 0.0 966.17 -503 -1524 -1765 -2449 -1726 -179 671 966 621 -772 -1488 -181 421 392 442 -31 -136 566 674 1163 845 543 1005 1053 574 372 -126 -359 244 1380 1420 965 1032 -715 -2124 -1090 -536 -354 -206 -670 -1316 -1084 -839 -854 -627 -357 -709 -435 -306 103 896 834 673 937 472 597 808 421 439 761 1059 1354 1123 1072 17 -596 -136 13 809 935 158 -41 -49 91 -35 -274 -207 -391 -94 -281 -1124 -1406 -1816 -1678 -931 -664 -383 -191 112 148 45 255 73 376 802 576 276 505 172 -452 -443 -443 -542 92 -57 -932 -687 -403 -234 272 350 182 52 35 -60 157 371 298 356 330 -71 -99 340 329 500 752 362 787 1007 348 196 -46 -267 -86 106 12 -251 93 83 -414 -328 -401 -703 -186 -591 -677 -898 -628 -63 244 356 244 -301 -597 -75 187 182 213 -15 -69 296 362 634 447 291 547 592 334 210 -73 -199 135 743 780 531 586 -413 -1232 -640 -327 -227 -146 -500 -1032 -859 -678 -696 -507 -294 -573 -341 -243 82 706 689 564 813 408 525 715 373 388 677 944 1271 1080 1029 17 -555 -123 12 747 907 157 -42 -51 90 -34 -257 -185 -347 -83 -261 -1119 -1441 -1945 -1854 -1059 -782 -460 -229 134 174 52 280 77 392 858 630 321 603 209 -549 -527 -512 -625 108 -69 -1146 -865 -529 -313 371 480 250 71 45 -76 193 451 374 462 433 -96 -135 452 430 637 933 446 961 1240 442 253 -62 -358 -119 150 17 -368 136 122 -619 -477 -583 -1014 SS 20241117T165438.8Z 9087.704616 397 1 53.01 2 53.19 155.76 107.88 318.24 0.00 1 0.00 1 0 17 8.224e-03 6.111e-03 1.159e-03 7.469e-04 1.731717e-01 4.115235e-04 1.951992e-03 -6.000000e+00 5.169860e-03 224.82 -2.00 3.25 -2.00 315.26 0.00e+00 2.341885e-04 3.987819e-05 2.926049e-05 -6.000000e+00 2.407791e-04 286.96 -2.00 20.00 -2.00 314.58 0.00e+00 1.665 0.000 302.00 328.00 3 4.3019e+00 1.0505e-03 1.8087e-02 -6.0000e+00 1.2713e-02 9.5141e-03 1.1697e-03 8.1714e-03 -6.0000e+00 1.3772e-02 7.9344e-03 6.6777e-04 4.0006e-03 -6.0000e+00 8.2496e-03 -6.0431e-03 2.8817e-04 1.1324e-03 -6.0000e+00 3.4428e-03 1.2144e-03 3.5792e-04 2.6600e-05 1.9307e-05 -6.0000e+00 2.9671e-04 2.2961e-02 -9.8388e-06 12 1 1 12 1 1 100.00 27.89 0.35 0.02296 0.02565 244 24 1 5 0 216.350 35.75 20.00 27.89 30.72 0.0 970.92 -854 -1496 -2430 -2636 -2551 -443 520 946 472 -1465 -917 -746 -404 630 1130 -122 -120 710 1076 1329 1314 377 1600 1051 620 -142 -393 -332 -257 1509 1015 593 612 -471 -2522 -246 -988 -424 -498 -500 -1084 -617 -492 -892 -617 -475 -1041 -314 -337 -87 829 1132 730 1209 424 594 870 656 317 834 1047 1422 1438 1041 -202 -790 140 183 562 817 235 121 -72 60 36 -277 -135 -694 -225 -478 -1328 -1547 -2101 -1686 -678 -631 -228 -137 343 101 -113 51 145 290 882 645 346 450 167 -522 -360 -566 -457 94 -33 -834 -632 -423 -183 387 417 178 -40 72 31 50 265 252 291 240 -70 -126 378 443 425 603 399 702 991 317 143 -90 -207 -109 36 39 -205 150 130 -269 -401 -357 -737 -263 -442 -715 -804 -733 -122 148 289 155 -462 -293 -249 -145 246 478 -55 -52 316 488 614 615 180 769 525 321 -75 -203 -163 -121 743 473 289 307 -240 -1292 -126 -555 -252 -340 -358 -842 -468 -381 -698 -479 -388 -834 -243 -256 -66 644 918 583 997 362 514 756 570 275 728 945 1269 1351 1008 -194 -721 127 164 524 774 240 121 -72 61 35 -261 -117 -581 -192 -444 -1283 -1628 -2243 -1902 -764 -755 -285 -167 414 124 -130 57 150 308 960 715 398 556 205 -638 -442 -659 -546 109 -40 -1029 -817 -570 -245 539 597 255 -55 98 39 64 330 325 376 328 -94 -170 523 590 538 764 489 854 1243 419 187 -121 -287 -155 52 58 -302 226 197 -402 -614 -533 -1091 SS 20241117T165831.2Z 9087.707305 400 1 1.74 2 52.86 156.82 108.41 318.90 0.00 1 0.00 1 0 17 7.476e-03 6.078e-03 9.100e-04 6.712e-04 1.735039e-01 3.727708e-04 1.973730e-03 -6.000000e+00 4.698695e-03 224.82 -2.00 3.25 -2.00 314.63 0.00e+00 3.851749e-04 3.183042e-05 1.617172e-05 -6.000000e+00 2.188976e-04 286.96 -2.00 20.00 -2.00 314.00 0.00e+00 1.652 0.000 302.00 328.00 3 8.4078e-01 9.4459e-04 1.7991e-02 -6.0000e+00 1.1555e-02 -5.1964e-03 1.0473e-03 8.2103e-03 -6.0000e+00 1.2518e-02 2.8647e-03 6.0034e-04 4.0168e-03 -6.0000e+00 7.4983e-03 -4.2552e-03 2.5492e-04 1.1523e-03 -6.0000e+00 3.1285e-03 3.9408e-02 6.3714e-05 2.3861e-05 2.0399e-05 -6.0000e+00 2.6975e-04 2.3512e-02 -5.3417e-05 12 1 1 12 1 1 95.79 27.90 0.32 0.02351 0.02399 69 213 1 5 0 24.710 36.00 20.00 27.90 31.14 0.0 972.55 -754 -1312 -1941 -2407 -1742 -116 764 821 962 -748 -1222 -431 405 323 379 51 -39 460 627 1160 759 412 1042 1009 549 541 -197 -358 123 1218 1342 1145 1161 -620 -1788 -1021 -265 -648 -69 -833 -1292 -1032 -732 -807 -634 -486 -675 -350 -331 98 833 936 660 813 424 704 805 377 491 731 1112 1247 1099 1192 19 -704 -155 57 941 986 229 -45 -115 76 -12 -360 -86 -491 -103 -205 -1268 -1463 -1877 -1643 -994 -704 -369 -165 74 163 -22 120 191 444 816 523 225 560 130 -523 -501 -363 -509 128 -15 -904 -711 -427 -209 233 402 190 70 107 -43 176 275 260 337 387 0 28 330 300 539 712 337 806 1021 323 232 -100 -209 -136 141 18 -215 -46 73 -432 -323 -380 -731 -282 -512 -751 -937 -635 -41 278 321 379 -309 -518 -180 181 151 184 26 -20 243 338 635 423 233 571 571 322 320 -115 -200 68 657 738 656 658 -358 -1033 -598 -161 -435 -49 -627 -1019 -850 -596 -661 -517 -403 -547 -275 -264 78 658 774 555 708 368 620 714 335 435 652 994 1175 1060 1146 19 -657 -140 52 867 956 227 -46 -119 76 -12 -337 -76 -433 -93 -189 -1260 -1498 -2007 -1812 -1131 -828 -443 -198 88 193 -26 132 204 460 869 569 261 666 157 -648 -593 -427 -584 150 -18 -1109 -893 -559 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