File name: Pandora143s1_LibertyTX_20240903_L2Fit_fout2c8d20230920p1-8.txt File generation date: 20240904T073918.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c8p1-8 Local principal investigator: Yuxuan Wang Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 143 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora143_OF_v1d20230920.txt Instrument calibration file used: Pandora143s1_CF_v8d20230920.txt Level 1 file used: Pandora143s1_LibertyTX_20240903_L1_smca1c8d20230920p1-8.txt Full location name: Sam Houston Regional Library and Research Center Short location name: LibertyTX Country of location: United States Location latitude [deg]: 30.0965 Location longitude [deg]: -94.7635 Location altitude [m]: 3 Local noon date: 20240903 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 7 First and last pixel inside fitting window: 242 384 Nominal wavelengths inside fitting window [nm]: 305.0091 305.1500 305.2909 305.4317 305.5726 305.7134 305.8542 305.9950 306.1358 306.2766 306.4174 306.5581 306.6989 306.8396 306.9803 307.1211 307.2618 307.4025 307.5432 307.6838 307.8245 307.9651 308.1058 308.2464 308.3870 308.5276 308.6682 308.8088 308.9494 309.0900 309.2305 309.3710 309.5116 309.6521 309.7926 309.9331 310.0736 310.2140 310.3545 310.4950 310.6354 310.7758 310.9162 311.0566 311.1970 311.3374 311.4778 311.6181 311.7585 311.8988 312.0392 312.1795 312.3198 312.4601 312.6003 312.7406 312.8809 313.0211 313.1614 313.3016 313.4418 313.5820 313.7222 313.8624 314.0025 314.1427 314.2828 314.4230 314.5631 314.7032 314.8433 314.9834 315.1235 315.2635 315.4036 315.5436 315.6836 315.8237 315.9637 316.1037 316.2437 316.3836 316.5236 316.6635 316.8035 316.9434 317.0833 317.2232 317.3631 317.5030 317.6429 317.7827 317.9226 318.0624 318.2022 318.3421 318.4819 318.6217 318.7614 318.9012 319.0410 319.1807 319.3204 319.4602 319.5999 319.7396 319.8792 320.0189 320.1586 320.2982 320.4379 320.5775 320.7171 320.8567 320.9963 321.1359 321.2755 321.4150 321.5546 321.6941 321.8337 321.9732 322.1127 322.2522 322.3916 322.5311 322.6706 322.8100 322.9494 323.0889 323.2283 323.3677 323.5071 323.6464 323.7858 323.9252 324.0645 324.2038 324.3431 324.4824 324.6217 324.7610 324.9003 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240903T130204.8Z 9012.543111 53 1 24.00 2 76.92 89.15 82.64 86.73 0.00 1 0.00 1 0 25 3.618e-01 7.447e-02 3.154e-01 3.978e-02 4.305146e-01 2.116399e-02 1.038250e-02 -6.000000e+00 2.101549e-01 228.96 -2.00 3.25 -2.00 319.98 0.00e+00 9.858866e-03 7.336933e-03 1.122012e-02 -6.000000e+00 1.157775e-02 293.94 -2.00 20.00 -2.00 319.15 0.00e+00 4.304 0.001 302.00 328.00 3 6.1595e+00 6.3671e-02 6.6462e-02 -6.0000e+00 5.2909e-01 2.2848e-01 7.8269e-02 6.5200e-02 -6.0000e+00 5.8089e-01 -9.6910e-03 6.0152e-02 2.3436e-02 -6.0000e+00 3.4008e-01 -6.1182e-03 3.1137e-02 2.6909e-03 -6.0000e+00 1.4722e-01 8.1300e-06 4.9640e-03 1.1270e-03 1.3673e-04 -6.0000e+00 9.3852e-03 3.0578e-02 0.0000e+00 12 8 8 10 0 0 42.98 26.79 3.12 0.03058 0.06788 6 6 2 8 0 4000.000 19.99 26.79 31.48 25.79 26.00 21.6 1024.09 900000 900000 -111079 125256 900000 900000 900000 -162460 -69700 900000 900000 900000 -25887 900000 900000 900000 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-4244 -3711 8404 1655 -3251 505 6238 1389 5747 8200 2432 7380 3507 -12108 4012 7284 3180 11748 -1532 6755 3712 8482 9915 2569 9449 8704 -1083 -6134 3754 -2288 10142 -4861 -7003 -2705 -2964 8141 -8428 -5834 1086 15319 -13820 7243 -9615 3357 -2202 8757 4207 8832 7108 -6238 14363 627 7574 -378 -7846 3697 598 -15107 -15399 6584 10981 -29397 -4657 -1597 -8662 5757 -10949 -224 2335 477 -8613 2028 -6647 10041 880 10724 6781 4229 1235 5948 17743 8953 2045 -1374 -7550 1548 -1128 9209 -1769 -2298 1082 8027 -9647 15463 2798 -2980 -4865 2054 -6779 -4859 1463 -5224 SS 20240903T132956.5Z 9012.562460 62 1 26.25 2 70.90 92.68 76.82 90.19 0.00 1 0.00 1 0 17 5.324e-02 7.334e-03 2.960e-02 3.508e-03 3.733020e-01 1.726866e-03 4.043139e-03 -6.000000e+00 2.942378e-02 228.96 -2.00 3.25 -2.00 318.68 0.00e+00 -3.769327e-04 3.826046e-04 1.862745e-04 -6.000000e+00 1.354735e-03 293.94 -2.00 20.00 -2.00 317.75 0.00e+00 3.019 0.000 302.00 328.00 3 4.4842e+00 4.7735e-03 3.5025e-02 -6.0000e+00 7.3134e-02 1.6870e-02 5.5348e-03 1.7988e-02 -6.0000e+00 7.9244e-02 2.5270e-03 3.8216e-03 8.7271e-03 -6.0000e+00 4.7454e-02 -6.2220e-03 2.0330e-03 2.4137e-03 -6.0000e+00 2.0612e-02 1.8771e-04 1.1583e-03 9.1857e-05 2.1315e-05 -6.0000e+00 1.2732e-03 2.8545e-02 0.0000e+00 11 9 0 11 4 0 98.21 28.85 0.24 0.02854 0.03725 11 11 2 8 0 2385.580 20.00 28.85 32.23 25.79 26.00 21.8 1030.42 1515 10093 -11216 -8802 41963 1488 -900 -21213 -16741 -12867 21267 -5488 -848 2847 -3003 -1356 -6628 -2231 8278 -3794 778 -795 -3278 2103 1041 2829 975 -6 -271 7717 1593 -2230 4810 2662 3044 -3840 -127 -2557 877 763 723 -465 -1513 -997 -2518 -2210 -3371 -539 -2105 719 1184 1394 806 406 -1682 802 344 -687 1054 -1169 2078 1273 2697 1925 671 387 459 -450 -724 1731 235 1352 -427 -300 309 251 392 -1236 -7 146 -305 -1142 -1417 -2490 -495 -1191 759 88 807 1013 390 1671 262 861 72 -28 1 481 -491 -585 361 -249 -1879 -184 -709 -1208 -181 -1039 -617 93 441 12 553 -262 390 -218 526 185 64 21 -193 212 383 -14 380 37 -214 769 984 633 205 -260 85 -624 238 63 1 411 145 -276 112 -685 -517 51 357 -509 -376 984 49 -32 -1072 -933 -740 883 -302 -52 199 -263 -132 -723 -246 876 -471 96 -99 -424 279 152 430 151 -1 -38 1000 237 -389 876 522 559 -720 -25 -601 243 247 258 -176 -597 -396 -1015 -900 -1379 -214 -843 286 497 635 393 210 -916 440 195 -393 582 -647 1140 753 1717 1327 479 262 291 -282 -486 1286 191 1132 -362 -247 239 178 256 -787 -4 109 -253 -1039 -1367 -2506 -515 -1314 863 104 942 1157 426 1690 251 804 72 -30 1 614 -669 -798 466 -299 -2166 -215 -884 -1580 -242 -1440 -888 141 702 19 886 -405 566 -304 728 265 97 33 -309 334 587 -21 552 53 -290 1040 1415 977 331 -429 142 -1077 426 117 1 786 279 -525 207 -1226 -905 SS 20240903T134517.2Z 9012.573116 65 1 13.20 2 67.59 94.69 73.61 92.14 0.00 1 0.00 1 0 17 2.180e-02 6.009e-03 1.477e-02 3.018e-03 3.216555e-01 1.481068e-03 3.514242e-03 -6.000000e+00 1.204630e-02 228.96 -2.00 3.25 -2.00 317.97 0.00e+00 1.779568e-04 2.657359e-04 1.610670e-04 -6.000000e+00 5.546171e-04 293.94 -2.00 20.00 -2.00 317.02 0.00e+00 2.601 0.000 302.00 328.00 3 2.8778e+00 3.9947e-03 3.0158e-02 -6.0000e+00 2.9942e-02 -1.2901e-02 4.5538e-03 1.5440e-02 -6.0000e+00 3.2442e-02 2.1754e-03 2.8850e-03 7.4993e-03 -6.0000e+00 1.9427e-02 -1.6280e-03 1.5053e-03 2.0899e-03 -6.0000e+00 8.4395e-03 1.5254e-03 1.1168e-03 7.8754e-05 1.8741e-05 -6.0000e+00 5.2117e-04 2.7847e-02 0.0000e+00 12 1 1 12 5 1 84.10 32.31 0.07 0.02785 0.03624 10 23 5 8 0 1199.690 20.01 32.31 32.93 25.79 26.00 21.8 1035.71 1301 1144 857 -4015 16968 -2607 6402 -7599 5574 -5690 862 -3534 3425 -4179 -537 -1616 -4126 -482 1165 915 -130 562 -3441 854 -243 780 990 234 -2044 2944 487 -165 3079 447 -749 -2803 -2595 -1557 962 299 -508 -425 -731 -1291 -628 -1300 -931 745 -142 -517 1066 1530 -272 346 -615 832 1179 -211 945 -566 1103 573 1392 1574 935 83 -186 -553 -91 1601 50 1011 -1005 1150 358 -139 -383 -948 -317 69 -645 -832 -1560 -1993 -1087 -558 -68 -470 623 710 496 835 395 482 55 300 233 648 32 -167 -710 -236 -1259 -649 -226 -732 56 -846 -29 -463 454 502 631 253 -410 319 510 394 141 -72 -536 47 327 160 205 275 -264 753 179 534 83 -276 -303 -282 412 -363 59 302 297 -261 1 -366 -369 81 80 62 -292 900 -156 373 -584 432 -520 73 -318 328 -503 -73 -247 -680 -80 200 164 -24 104 -665 169 -52 175 222 50 -422 571 103 -39 779 121 -193 -702 -693 -480 347 125 -232 -203 -359 -643 -312 -655 -465 362 -69 -253 542 832 -159 209 -387 529 765 -138 604 -361 708 392 1021 1227 745 63 -133 -386 -67 1299 44 915 -923 1016 303 -109 -278 -665 -229 55 -570 -796 -1574 -2078 -1177 -635 -81 -571 752 841 562 886 393 469 56 331 277 827 43 -226 -921 -285 -1463 -768 -283 -959 74 -1172 -41 -695 709 796 983 380 -584 434 690 550 206 -110 -835 72 491 235 293 383 -354 1001 252 796 129 -437 -483 -462 699 -641 105 547 540 -472 2 -625 -619 SS 20240903T135213.4Z 9012.577933 69 1 27.47 2 66.10 95.62 72.15 93.03 0.00 1 0.00 1 0 17 1.786e-02 6.131e-03 1.171e-02 2.539e-03 3.058152e-01 1.245478e-03 3.354171e-03 -6.000000e+00 9.869328e-03 228.96 -2.00 3.25 -2.00 317.92 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