File name: Pandora257s1_AustinTX_20240722_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240723T064500.4Z 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 v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240722_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: 20240722 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 20240722T134646.2Z 8969.574146 259 1 55.28 2 65.53 80.12 101.22 252.71 0.00 1 0.00 1 0 17 5.607e-02 1.179e-02 1.454e-02 2.872e-03 3.001437e-01 1.567501e-03 3.245332e-03 -6.000000e+00 3.590732e-02 230.00 -2.00 3.25 -2.00 318.20 0.00e+00 8.126968e-04 3.133309e-04 1.475221e-04 -6.000000e+00 1.684583e-03 293.23 -2.00 20.00 -2.00 317.27 0.00e+00 2.397 0.000 302.00 328.00 3 5.5622e+00 4.2495e-03 2.7504e-02 -6.0000e+00 8.9194e-02 8.7573e-03 4.8522e-03 1.4500e-02 -6.0000e+00 9.6175e-02 3.5085e-02 3.0126e-03 7.0227e-03 -6.0000e+00 5.7596e-02 -2.0914e-02 1.4956e-03 2.0720e-03 -6.0000e+00 2.3946e-02 1.3437e-04 8.6403e-04 1.0292e-04 2.8957e-05 -6.0000e+00 2.0267e-03 2.6134e-02 -7.0242e-07 12 8 8 10 0 0 99.98 28.35 0.66 0.02613 0.03263 40 4 1 5 0 1381.720 36.25 20.00 28.35 33.71 0.0 994.40 -900 -3277 646 14222 -37212 -16429 -20609 -10268 -3363 -10217 3547 -6503 -785 11384 6994 -6303 -1260 11343 6611 10321 21007 409 15131 -1052 637 4556 -2158 -2942 -1267 1523 -597 -452 -4336 3316 -12274 -2446 -8643 -1204 -2401 1169 -1046 -408 4259 -1958 -785 -3602 -3517 3665 491 606 3743 4215 -99 5187 -752 -108 -464 80 841 -1296 -794 -64 3737 448 -2987 -1200 3060 770 -299 1569 917 1324 -1277 286 740 865 2258 -2964 -47 -758 -1381 -912 -3381 -881 899 -52 -669 229 617 1180 -1437 -577 -223 645 617 1109 -520 431 -198 -1205 74 -1159 -71 283 379 -1069 -613 128 474 1398 627 -87 615 503 -382 -383 262 -127 -402 -445 -291 -1131 651 1555 -460 345 531 -178 1268 -1080 -339 -505 619 192 -150 -322 -144 556 1276 216 -613 -405 -680 -52 -206 39 733 -3085 -1109 -1541 -756 -250 -856 272 -599 -77 1129 815 -918 -186 1556 992 1543 2888 71 2330 -200 124 870 -436 -582 -242 288 -122 -99 -1043 752 -3258 -610 -2532 -379 -889 473 -471 -176 1802 -894 -356 -1676 -1619 1713 238 301 1899 2061 -53 2794 -445 -65 -283 49 506 -806 -512 -43 2616 337 -2315 -878 2069 536 -223 1257 793 1183 -1166 248 594 637 1528 -2075 -34 -602 -1226 -884 -3309 -896 957 -59 -803 279 745 1364 -1597 -590 -233 663 612 1196 -629 561 -270 -1651 95 -1425 -84 337 475 -1440 -865 174 680 2103 992 -140 957 740 -531 -551 373 -173 -579 -672 -447 -1744 962 2189 -683 486 726 -247 1823 -1559 -512 -794 994 323 -265 -554 -256 998 2278 382 -1140 -728 -1212 SS 20240722T140924.8Z 8969.589871 276 1 33.05 2 60.69 82.60 105.69 255.24 0.00 1 0.00 1 0 17 1.002e-02 5.896e-03 1.359e-03 6.642e-04 2.654187e-01 3.703937e-04 2.906009e-03 -6.000000e+00 6.414477e-03 230.00 -2.00 3.25 -2.00 316.25 0.00e+00 3.260479e-04 4.433300e-05 6.932185e-05 -6.000000e+00 3.009521e-04 293.23 -2.00 20.00 -2.00 315.39 0.00e+00 2.033 0.000 302.00 328.00 3 3.1076e+00 9.6519e-04 2.3564e-02 -6.0000e+00 1.5934e-02 1.6242e-02 1.0758e-03 1.2646e-02 -6.0000e+00 1.7181e-02 -2.3100e-03 6.1350e-04 6.1168e-03 -6.0000e+00 1.0289e-02 -1.9230e-03 2.7504e-04 1.6810e-03 -6.0000e+00 4.2775e-03 2.3530e-03 3.5014e-04 2.3465e-05 2.5993e-05 -6.0000e+00 3.6206e-04 2.6329e-02 -7.3586e-06 12 1 1 12 1 1 99.99 28.43 0.30 0.02633 0.02896 136 22 1 5 0 241.180 36.25 19.99 28.43 33.65 0.0 994.28 -846 -2216 -3113 -4198 -4041 -2890 -1169 -415 -834 -2104 -1498 -1403 -169 377 473 -419 -491 1034 1238 1704 1622 845 1728 1330 564 174 -62 -686 -351 1207 1259 685 616 -1048 -2694 -443 -959 -305 -121 -425 -1014 -589 -398 -795 -266 -202 -746 -64 -247 71 1097 1025 751 1353 403 677 978 481 507 630 1170 1453 1390 1014 -111 -587 -6 29 576 847 142 29 -40 130 -16 -285 -120 -838 -480 -563 -1160 -1474 -1860 -1869 -889 -531 -298 -106 195 168 77 239 -40 326 684 534 253 507 116 -476 -430 -602 -589 84 -72 -891 -586 -386 -122 411 383 205 97 65 -5 37 305 318 432 315 -64 -81 416 405 423 589 307 634 948 154 88 -106 -205 4 79 -74 -206 210 196 -391 -306 -418 -720 -157 -441 -625 -816 -749 -526 -221 -85 -168 -448 -330 -330 -43 109 140 -135 -167 362 448 632 569 304 633 511 227 71 -25 -269 -133 453 494 287 271 -474 -1234 -204 -456 -156 -67 -267 -658 -400 -277 -562 -187 -141 -515 -43 -166 49 778 731 566 1061 313 535 779 385 403 506 970 1215 1235 894 -98 -522 -5 25 512 781 135 28 -39 124 -15 -255 -104 -716 -406 -522 -1145 -1527 -1990 -2042 -1024 -622 -351 -128 234 202 90 258 -42 337 737 603 303 632 146 -598 -534 -734 -694 100 -87 -1153 -767 -512 -170 580 563 294 140 91 -6 48 391 421 583 447 -91 -114 588 551 567 781 396 819 1276 213 123 -154 -298 6 120 -115 -331 342 320 -631 -479 -657 -1119 SS 20240722T141332.8Z 8969.592741 279 1 48.01 2 59.81 83.06 106.51 255.70 0.00 1 0.00 1 0 17 2.403e-02 8.656e-03 6.834e-03 2.217e-03 2.526144e-01 1.218901e-03 2.743543e-03 -6.000000e+00 1.538906e-02 230.00 -2.00 3.25 -2.00 317.27 0.00e+00 -5.288516e-04 1.875315e-04 8.583767e-05 -6.000000e+00 7.221184e-04 293.23 -2.00 20.00 -2.00 316.33 0.00e+00 1.980 0.000 302.00 328.00 3 5.5306e+00 3.2338e-03 2.2809e-02 -6.0000e+00 3.8226e-02 3.8114e-04 3.6451e-03 1.2117e-02 -6.0000e+00 4.1220e-02 2.1186e-02 2.1276e-03 5.8464e-03 -6.0000e+00 2.4685e-02 -1.2116e-02 1.0038e-03 1.6291e-03 -6.0000e+00 1.0261e-02 2.2522e-04 5.8944e-04 7.9905e-05 2.4280e-05 -6.0000e+00 8.6874e-04 2.6530e-02 -3.3212e-05 12 9 1 12 1 1 100.00 28.45 0.26 0.02653 0.03096 60 7 1 5 0 786.970 36.25 20.00 28.45 33.87 0.0 997.43 -361 -2350 -330 1474 -13393 -9956 -5789 -5777 -1464 -4823 2651 -3571 -808 1587 -747 -2592 -2054 2696 3607 3403 7881 1233 6185 777 767 -3309 -1508 -1882 -1746 1388 1354 -1516 -2130 -1171 -6110 7687 -4184 -404 -713 893 -287 -296 1586 -2026 -494 -2516 -1249 -38 553 31 1382 3032 919 3052 -338 676 1052 197 1090 212 248 575 2755 344 -1519 -1603 1336 272 100 987 596 356 -269 687 1035 209 918 -2070 -439 -609 -1503 -1137 -2799 -1276 -47 -483 -204 -389 100 502 -760 122 -458 401 447 780 761 160 -250 -706 104 -688 -155 122 341 -1027 -963 225 460 990 533 -15 180 243 -146 -134 36 -194 -254 -44 -135 -678 423 1387 -56 280 570 121 1002 95 -366 -84 464 -28 -305 -25 -144 219 833 -262 -459 -356 -663 -38 -268 -37 155 -1558 -1117 -661 -719 -188 -670 355 -543 -132 284 -151 -576 -479 624 857 833 1882 321 1580 219 226 -1030 -454 -547 -491 378 384 -469 -693 -381 -2083 2357 -1591 -171 -319 444 -157 -170 916 -1224 -293 -1512 -729 -21 310 18 818 1868 610 2074 -245 497 778 147 802 159 193 433 2154 285 -1266 -1275 988 203 79 843 548 340 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