File name: Pandora257s1_AustinTX_20250206_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250208T213026.9Z 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 v1.8.70 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250206_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: 20250206 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 20250206T184649.5Z 9168.782517 298 1 54.77 2 45.59 180.58 88.32 61.02 0.00 1 0.00 1 0 17 2.043e-02 1.115e-02 4.677e-03 2.587e-03 1.604200e-01 1.418952e-03 1.783359e-03 -6.000000e+00 1.284907e-02 224.86 -2.00 3.25 -2.00 315.87 0.00e+00 -1.544090e-04 1.525814e-04 3.223321e-05 -6.000000e+00 5.893119e-04 283.35 -2.00 20.00 -2.00 315.18 0.00e+00 1.427 0.000 302.00 328.00 3 6.5836e+00 3.6485e-03 1.5748e-02 -6.0000e+00 3.1640e-02 1.2904e-02 4.0693e-03 7.4994e-03 -6.0000e+00 3.4291e-02 3.1973e-02 2.3298e-03 3.6861e-03 -6.0000e+00 2.0494e-02 -1.5660e-02 1.0240e-03 1.0512e-03 -6.0000e+00 8.5231e-03 1.5788e-04 7.8381e-04 9.2907e-05 1.7339e-05 -6.0000e+00 7.3698e-04 2.0707e-02 1.2411e-05 12 8 8 10 0 0 100.00 28.13 0.94 0.02071 0.02660 49 5 1 5 0 1117.700 36.00 20.00 28.13 30.95 0.0 970.32 -824 -3480 911 1445 -10414 -3458 -2413 1021 -1840 -2207 -151 -3878 -3570 5150 4768 -1667 216 3841 2906 1553 5181 -1215 4704 1967 1673 -1823 -1141 44 -910 790 2015 -1045 -2218 -1556 -6227 7109 -5117 -1601 -1149 3 -258 870 1737 -2068 -640 -1507 -2421 803 -826 166 1640 2969 471 3064 -850 467 45 420 365 886 -191 1181 2619 108 -1874 -1377 1855 716 -278 657 218 1163 -93 19 452 93 1379 -3378 -922 -416 -1797 -869 -3126 -1404 264 -678 -317 711 848 826 -873 -779 524 95 130 1467 65 580 -393 -713 -304 -865 447 -501 588 -1323 -453 229 367 1565 573 346 -62 438 -6 -330 -311 -560 -419 -167 125 -713 438 1954 -673 -358 198 256 517 -358 -394 -520 308 192 26 259 -665 650 902 541 -800 -530 -729 -193 -869 215 321 -2459 -748 -540 238 -470 -585 -40 -1107 -1093 1582 1594 -629 83 1460 1142 632 2058 -520 1937 861 758 -863 -524 19 -380 317 813 -451 -996 -694 -2875 2934 -2601 -898 -671 2 -181 630 1274 -1584 -481 -1124 -1776 553 -566 113 1132 2114 359 2360 -698 385 37 347 301 735 -166 1064 2443 106 -1831 -1261 1551 595 -244 618 220 1210 -99 19 430 81 1095 -2695 -736 -356 -1708 -888 -3486 -1496 294 -811 -396 902 1072 1005 -1009 -902 555 98 138 1641 74 702 -499 -899 -364 -989 534 -567 697 -1687 -601 315 526 2309 879 529 -91 603 -8 -401 -373 -696 -550 -232 178 -1026 611 2581 -868 -438 253 325 677 -452 -517 -702 421 271 39 400 -1071 1056 1470 873 -1277 -823 -1121 SS 20250206T185049.8Z 9168.785298 301 1 14.78 2 45.61 181.93 87.59 61.47 0.00 1 0.00 1 0 17 7.530e-03 6.138e-03 5.530e-04 4.190e-04 1.667178e-01 2.331878e-04 1.896141e-03 -6.000000e+00 4.735983e-03 224.86 -2.00 3.25 -2.00 314.44 0.00e+00 3.867749e-04 1.901034e-05 1.522936e-05 -6.000000e+00 2.172477e-04 283.35 -2.00 20.00 -2.00 313.89 0.00e+00 1.427 0.000 302.00 328.00 3 2.2643e+00 5.9022e-04 1.5925e-02 -6.0000e+00 1.1662e-02 8.4609e-03 6.5379e-04 7.8615e-03 -6.0000e+00 1.2640e-02 5.2042e-03 3.7483e-04 3.8616e-03 -6.0000e+00 7.5542e-03 -5.0873e-03 1.5834e-04 1.1155e-03 -6.0000e+00 3.1411e-03 1.1808e-02 3.0869e-04 1.4853e-05 1.9898e-05 -6.0000e+00 2.7168e-04 2.1424e-02 -1.1042e-06 12 1 1 12 1 1 99.97 28.14 0.35 0.02142 0.02374 185 66 1 5 0 79.420 36.00 20.00 28.14 31.17 0.0 972.32 -287 -1154 -1697 -2426 -1746 -324 741 1026 697 -868 -1478 -195 438 394 577 103 -205 466 625 1238 1063 405 946 935 480 381 -145 -334 148 1332 1509 1031 1015 -708 -2129 -1060 -699 -468 -215 -575 -1272 -1030 -784 -903 -630 -336 -688 -381 -361 91 1000 840 689 999 391 677 838 542 515 785 1040 1297 1127 985 44 -672 -292 -95 677 980 164 -7 -51 182 45 -330 -362 -515 -175 -310 -1127 -1371 -1862 -1758 -950 -677 -436 -182 157 173 148 188 84 370 809 596 279 571 224 -415 -441 -463 -651 65 -73 -870 -658 -402 -249 291 414 236 64 47 -51 99 327 287 426 410 -48 -44 334 360 431 693 350 732 983 373 179 -142 -259 -107 72 -7 -295 105 114 -402 -335 -391 -711 -112 -472 -688 -993 -669 -120 282 418 286 -373 -650 -88 201 188 299 54 -112 260 357 684 595 230 544 555 295 225 -88 -194 86 749 861 586 595 -422 -1271 -638 -436 -318 -155 -449 -1041 -849 -659 -765 -530 -278 -576 -309 -287 74 808 711 589 883 344 604 752 486 460 707 966 1226 1088 976 43 -646 -273 -87 643 940 165 -7 -53 184 44 -317 -331 -453 -157 -290 -1095 -1406 -1990 -1932 -1072 -787 -517 -221 189 206 171 210 90 382 854 657 318 679 271 -500 -522 -534 -752 76 -88 -1059 -839 -521 -328 388 568 324 87 61 -63 119 399 352 538 534 -63 -58 441 469 549 838 421 872 1207 468 229 -186 -340 -145 99 -10 -420 153 167 -582 -473 -552 -995 SS 20250206T190258.0Z 9168.793727 310 1 54.61 2 45.79 186.01 85.34 62.83 0.00 1 0.00 1 0 17 7.480e-03 6.103e-03 1.282e-04 9.666e-05 1.678262e-01 5.374684e-05 1.910142e-03 -6.000000e+00 4.703881e-03 224.86 -2.00 3.25 -2.00 314.48 0.00e+00 3.452109e-04 4.419587e-06 1.454998e-05 -6.000000e+00 2.157829e-04 283.35 -2.00 20.00 -2.00 313.93 0.00e+00 1.432 0.000 302.00 328.00 3 6.4683e-01 1.3612e-04 1.5990e-02 -6.0000e+00 1.1583e-02 -3.5162e-03 1.5093e-04 7.9094e-03 -6.0000e+00 1.2554e-02 4.3279e-03 8.6457e-05 3.8871e-03 -6.0000e+00 7.5031e-03 -4.7424e-03 3.6458e-05 1.1157e-03 -6.0000e+00 3.1197e-03 5.9425e-02 2.8042e-04 3.4279e-06 1.9957e-05 -6.0000e+00 2.6984e-04 2.1557e-02 -5.0899e-06 10 0 0 10 0 0 99.98 28.18 0.32 0.02156 0.02366 4292 414 1 5 0 12.720 36.00 20.00 28.18 31.61 0.0 974.80 -264 -1236 -1705 -2456 -1635 -258 631 1005 685 -768 -1445 -344 332 395 432 -7 -95 457 685 1171 874 487 932 1001 602 352 -70 -354 268 1321 1408 996 1056 -698 -2202 -1181 -621 -403 -173 -615 -1282 -1073 -812 -846 -619 -342 -681 -417 -288 118 916 844 664 918 496 631 860 468 465 723 1092 1356 1151 1090 27 -624 -221 -56 705 944 168 -29 -36 122 -34 -287 -287 -491 -145 -304 -1141 -1406 -1846 -1704 -960 -665 -369 -162 138 141 58 230 54 337 774 541 314 535 223 -419 -459 -472 -584 51 -37 -910 -677 -409 -234 309 402 222 92 38 -73 130 336 320 348 386 -44 -75 318 342 493 730 324 764 1008 376 208 -64 -278 -91 97 4 -257 86 92 -414 -347 -434 -724 -104 -510 -697 -959 -631 -96 243 391 284 -333 -609 -149 154 191 216 -4 -50 247 378 657 497 281 544 577 359 212 -41 -210 151 722 783 577 630 -406 -1284 -695 -395 -269 -127 -473 -1036 -875 -675 -708 -514 -290 -564 -334 -234 96 733 708 563 805 433 559 766 417 413 648 1008 1276 1107 1076 27 -598 -206 -51 646 906 170 -29 -38 124 -33 -266 -261 -431 -130 -285 -1112 -1448 -1982 -1883 -1091 -779 -442 -199 168 166 67 252 58 350 824 602 361 644 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