File name: Pandora257s1_AustinTX_20240427_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240429T113655.3Z 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_20240427_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: 20240427 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 20240427T134246.3Z 8883.571369 264 1 30.40 2 67.10 86.56 86.62 234.30 0.00 1 0.00 1 0 25 2.877e-01 2.751e-02 1.161e-01 7.998e-03 3.320825e-01 4.433169e-03 3.673168e-03 -6.000000e+00 1.842239e-01 229.98 -2.00 3.25 -2.00 319.00 0.00e+00 2.969331e-03 1.086365e-03 2.598220e-04 -6.000000e+00 8.608708e-03 287.57 -2.00 20.00 -2.00 318.17 0.00e+00 2.549 0.000 302.00 328.00 3 6.2927e+00 1.2425e-02 2.9766e-02 -6.0000e+00 4.5821e-01 1.2234e-02 1.4379e-02 1.6402e-02 -6.0000e+00 4.9477e-01 1.8472e-02 9.8193e-03 8.2204e-03 -6.0000e+00 2.9513e-01 -1.2738e-02 4.9472e-03 3.3311e-03 -6.0000e+00 1.2192e-01 5.2613e-05 -1.1004e-03 2.9349e-04 4.4121e-05 -6.0000e+00 1.0455e-02 2.5305e-02 -2.7949e-04 12 9 9 12 1 1 99.99 28.06 1.91 0.02531 0.01704 27 5 1 5 0 1085.620 36.00 20.00 28.06 29.31 0.0 966.90 145246 -44416 -18699 900000 -58374 -63234 -71484 -41814 85406 -29393 81322 -13227 6525 75145 105218 -11354 -1597 109616 39662 33359 80921 24254 81289 30531 28933 -23187 -6229 26504 -2535 25711 5784 -8080 -9330 22962 -11690 82673 -14545 -9357 2001 7038 3336 8623 4388 -6770 -913 -8582 -303 11024 1245 1909 1265 22410 -1652 15240 -6211 -3134 -999 -3252 607 -2314 -6349 -369 14179 846 -8169 -3667 12871 4122 -3220 3107 1537 3172 -1152 1193 5095 725 -724 -6655 -766 -3423 -4094 -1098 -5150 -2153 2804 -2785 -251 34 2721 -34 -3975 -23 1820 -895 1724 4585 1362 281 -2308 -1240 -83 -1823 1072 -417 984 -1920 -72 803 475 1079 1081 1465 605 2533 92 -1028 -454 -1762 -304 -223 -264 -2094 1048 3783 -2952 -2087 1609 130 3091 -173 -679 -1218 275 502 -2578 560 -153 522 1986 -100 235 -674 -728 1133 -2488 -822 900000 -3559 -4035 -5220 -2460 1514 -1730 1672 -769 356 2637 3118 -1195 -164 3932 3000 2783 4291 2307 4501 2928 2933 -4032 -908 2728 -346 2727 803 -1399 -1739 3169 -2288 6511 -3335 -2349 521 1976 1061 2757 1516 -2666 -343 -3487 -113 3662 460 723 510 7812 -778 6370 -3332 -1669 -527 -1752 314 -1249 -3723 -218 7773 555 -5874 -2437 7016 2472 -2210 2186 1181 2486 -940 914 3500 478 -453 -4349 -498 -2530 -3400 -973 -4658 -2013 2658 -2964 -272 38 2932 -37 -4145 -24 1730 -867 1716 4866 1504 343 -3027 -1600 -102 -2125 1168 -467 1143 -2428 -94 1100 692 1661 1745 2392 974 3796 133 -1431 -624 -2535 -454 -348 -420 -3379 1598 5401 -4303 -2888 2085 172 4199 -259 -1082 -2034 469 888 -4946 1090 -310 1070 4017 -202 458 -1284 -1368 SS 20240427T140304.6Z 8883.585470 275 1 54.73 2 62.71 89.03 90.12 236.85 0.00 1 0.00 1 0 17 1.217e-02 5.739e-03 9.578e-04 3.418e-04 3.097354e-01 1.893990e-04 3.383097e-03 -6.000000e+00 7.799401e-03 229.99 -2.00 3.25 -2.00 317.02 0.00e+00 3.455271e-04 2.670954e-05 1.234206e-04 -6.000000e+00 3.571557e-04 287.57 -2.00 20.00 -2.00 316.20 0.00e+00 2.170 0.000 302.00 328.00 3 2.0962e+00 4.9890e-04 2.5924e-02 -6.0000e+00 1.9412e-02 -4.0736e-03 5.5805e-04 1.4777e-02 -6.0000e+00 2.0948e-02 -8.3204e-03 3.2544e-04 7.1720e-03 -6.0000e+00 1.2500e-02 -5.6751e-04 1.5189e-04 1.9753e-03 -6.0000e+00 5.1686e-03 5.3218e-03 1.5819e-04 1.2042e-05 3.0070e-05 -6.0000e+00 4.3980e-04 2.0817e-02 -1.2651e-05 10 0 0 10 0 0 100.00 28.07 0.35 0.02082 0.02201 1317 127 1 5 0 41.550 36.00 20.00 28.07 29.76 0.0 970.19 -2759 -3283 -4828 -4936 -4393 -3495 -3129 -1907 -1685 -3404 -2414 -2446 -793 395 359 -549 -292 378 904 1131 1107 540 1614 1250 666 226 -346 -804 -253 705 1114 792 847 -1114 -2477 -1372 -1138 -515 -137 -299 -896 -672 -243 -437 -331 -37 -434 -86 -103 124 968 1085 776 1209 535 717 980 493 441 805 1086 1445 1572 1350 198 -559 -48 44 626 955 285 45 -78 90 -24 -457 -383 -497 -289 -454 -1290 -1395 -1872 -1751 -1005 -662 -321 -105 233 217 76 331 98 245 686 493 214 489 110 -559 -504 -565 -650 9 -24 -1013 -735 -427 -224 350 379 200 97 38 -78 94 443 353 357 388 -36 -64 393 378 454 621 164 632 957 304 133 -69 -265 -101 113 25 -197 131 204 -355 -318 -416 -692 -338 -392 -590 -642 -544 -428 -403 -265 -229 -497 -366 -401 -143 80 82 -127 -72 97 241 311 311 155 475 387 216 75 -115 -260 -80 222 369 282 294 -402 -907 -512 -466 -224 -69 -161 -528 -392 -145 -266 -202 -22 -261 -51 -62 76 616 734 526 857 396 513 708 358 318 585 816 1152 1266 1137 169 -462 -40 37 523 825 267 42 -77 84 -21 -389 -320 -407 -247 -406 -1229 -1392 -1930 -1920 -1115 -778 -378 -127 279 250 86 363 101 262 730 549 253 603 143 -728 -628 -690 -766 10 -30 -1297 -989 -580 -309 510 557 299 142 54 -109 126 606 480 511 561 -54 -95 565 544 623 845 218 841 1332 436 194 -105 -403 -160 181 41 -330 223 348 -599 -520 -683 -1120 SS 20240427T140742.4Z 8883.588685 278 1 54.72 2 61.71 89.61 90.93 237.41 0.00 1 0.00 1 0 17 1.106e-02 5.776e-03 7.803e-04 3.012e-04 3.002500e-01 1.673370e-04 3.280818e-03 -6.000000e+00 7.089688e-03 229.99 -2.00 3.25 -2.00 316.82 0.00e+00 3.270725e-04 2.239896e-05 1.168186e-04 -6.000000e+00 3.246463e-04 287.57 -2.00 20.00 -2.00 316.02 0.00e+00 2.100 0.000 302.00 328.00 3 1.9371e+00 4.3944e-04 2.5094e-02 -6.0000e+00 1.7645e-02 -5.0169e-03 4.9083e-04 1.4302e-02 -6.0000e+00 1.9042e-02 -8.3994e-03 2.8347e-04 6.9430e-03 -6.0000e+00 1.1363e-02 -4.3782e-04 1.3076e-04 1.9132e-03 -6.0000e+00 4.6984e-03 6.7691e-03 1.8168e-04 1.0593e-05 2.8763e-05 -6.0000e+00 3.9977e-04 2.0723e-02 -8.8112e-06 10 0 0 10 0 0 99.99 28.07 0.31 0.02072 0.02209 1459 141 1 5 0 37.500 36.00 19.99 28.07 29.80 0.0 970.67 -1991 -3703 -3380 -4571 -4254 -3352 -2066 -1424 -1181 -2517 -2921 -1559 -426 181 518 -215 -392 884 716 1064 1011 600 1476 1134 397 37 -144 -707 -384 845 1116 761 698 -785 -2531 -1409 -1126 -589 -123 -198 -887 -640 -339 -566 -243 -40 -366 -131 -266 140 898 1118 821 1186 522 765 927 500 531 800 1161 1518 1430 1332 106 -541 -93 -47 762 1015 229 66 -17 58 -57 -316 -323 -534 -302 -470 -1228 -1421 -1866 -1736 -1058 -701 -320 -150 181 202 57 229 41 283 620 499 190 498 110 -530 -504 -554 -601 46 -29 -981 -737 -396 -238 303 392 205 82 97 -106 137 392 391 388 384 21 -61 366 397 427 672 228 654 963 313 101 -101 -307 -112 146 56 -221 168 181 -371 -333 -414 -696 -257 -519 -475 -627 -557 -433 -278 -208 -185 -421 -513 -291 -88 39 124 -56 -110 257 217 332 297 180 454 366 135 13 -49 -237 -125 275 381 279 270 -314 -1031 -543 -475 -266 -64 -110 -542 -388 -211 -358 -153 -25 -228 -80 -164 88 589 735 574 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