File name: Pandora25s1_HoustonTX_20221025_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T043814.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20221025_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20221025 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20221025T132626.1Z 8333.560024 62 1 18.95 2 79.11 110.96 81.19 109.75 0.00 1 0.00 1 0 25 3.207e-01 1.450e-02 2.557e-01 7.305e-03 5.655077e-01 3.856397e-03 6.115906e-03 -6.000000e+00 1.860048e-01 226.35 -2.00 3.24 -2.00 320.46 0.00e+00 2.216622e-03 1.518258e-03 1.204830e-03 -6.000000e+00 8.813007e-03 290.45 -2.00 20.00 -2.00 319.72 0.00e+00 5.098 0.002 302.00 328.00 3 3.2166e+00 1.2076e-02 5.7867e-02 -6.0000e+00 4.6237e-01 1.0738e-01 1.5575e-02 2.9516e-02 -6.0000e+00 5.0420e-01 -4.2085e-02 1.4163e-02 1.3615e-02 -6.0000e+00 2.9892e-01 7.9392e-03 7.0818e-03 5.3205e-03 -6.0000e+00 1.2659e-01 7.1415e-05 -1.7593e-03 2.1012e-04 4.7646e-05 -6.0000e+00 8.8913e-03 -4.4384e-03 -6.6372e-06 12 9 9 12 33 1 98.92 24.78 0.47 -0.00444 -0.01766 6 4 1 5 0 2682.220 27.26 20.00 24.78 21.24 26.5 931.74 -63867 104296 -27017 -59949 -138502 -54448 900000 -17917 900000 35000 -114509 900000 -17545 95994 -13666 900000 17322 900000 -4214 73647 22296 21116 -947 78789 -48309 -14756 -51222 -5954 22342 -64421 190293 7826 16017 -12341 -21097 26996 8821 81435 3644 -5158 -7745 13330 13391 9915 12431 11991 -10504 -8465 2411 928 15117 -1887 2914 5446 4991 5197 3063 -2094 5630 -6239 2314 -2680 -1152 -788 -890 269 4136 -478 -831 2910 3044 3004 3073 -3079 3273 1757 3828 2313 -404 -222 -1313 -1880 -4241 -3427 -1876 -2664 652 -511 -1304 1653 -724 -1360 714 552 -1101 1356 179 1915 1021 12 653 -1352 -1087 -1936 1508 537 -1598 -429 981 -120 32 1368 1104 173 181 -265 -1253 482 -2027 -1145 -224 835 1036 -418 265 795 -483 855 -96 934 583 -682 -293 1124 -848 -109 51 498 40 -420 282 -1043 334 -598 742 -213 -619 -2797 -500 900000 -147 900000 249 -2951 900000 -258 683 -296 900000 361 900000 -126 1113 558 539 -32 1351 -2932 -688 -3387 -250 714 -5031 1575 422 907 -948 -1687 1395 604 3369 379 -681 -1159 1746 1833 1430 1780 1758 -1933 -1569 419 174 2741 -442 708 1390 1343 1448 891 -636 1557 -1913 684 -909 -431 -322 -374 108 1583 -196 -376 1439 1628 1662 1679 -1691 1573 779 1572 976 -193 -122 -828 -1325 -3265 -2751 -1575 -2377 589 -477 -1222 1464 -617 -1098 548 433 -957 1291 192 2238 1272 15 771 -1500 -1136 -2066 1660 622 -1966 -549 1326 -177 50 2199 1771 271 270 -385 -1841 723 -3240 -1879 -365 1320 1597 -634 388 1127 -674 1211 -148 1548 1030 -1264 -558 2204 -1764 -233 111 1095 87 -909 586 -2105 655 SS 20221025T133205.7Z 8333.563955 65 1 3.69 2 77.97 111.76 80.09 110.52 0.00 1 0.00 1 0 17 1.505e-01 6.581e-03 8.812e-02 3.391e-03 5.155099e-01 1.733318e-03 5.532692e-03 -6.000000e+00 8.561857e-02 226.35 -2.00 3.24 -2.00 319.84 0.00e+00 1.021788e-03 5.660204e-04 2.581538e-04 -6.000000e+00 3.926014e-03 290.45 -2.00 20.00 -2.00 319.05 0.00e+00 4.651 0.001 302.00 328.00 3 9.4214e-01 5.1073e-03 5.2308e-02 -6.0000e+00 2.1145e-01 1.1761e-02 6.2396e-03 2.4951e-02 -6.0000e+00 2.2956e-01 -3.9619e-03 5.1991e-03 1.2216e-02 -6.0000e+00 1.3755e-01 -4.4472e-03 2.6954e-03 3.8410e-03 -6.0000e+00 5.9053e-02 1.1840e-03 -2.9267e-04 9.5210e-05 3.9638e-05 -6.0000e+00 4.0954e-03 -7.5035e-03 1.1622e-04 12 9 1 12 1 1 74.53 24.79 0.28 -0.00750 -0.00970 18 57 1 5 0 185.030 27.26 19.99 24.79 21.12 26.4 931.03 -27782 -66003 41017 -37270 -19787 -80791 59466 -51935 26096 -25057 -35642 4949 -33639 9467 -34290 46953 -3786 28442 -15813 6234 3367 10536 -1394 -4564 -4938 3242 -291 -16726 9925 -15126 8622 -5359 6826 -7720 -1627 -188 -3268 533 -3395 945 -1525 2610 -2100 1722 -1643 3588 -2928 495 -929 750 2429 1528 -74 2065 1552 758 1955 -857 1955 -702 2075 -1588 2580 1080 1127 -482 1435 -744 511 583 516 1485 -1049 821 359 1103 -1303 -497 -1312 -686 -1120 -1021 -1827 -1574 -542 -1312 388 -336 541 403 804 235 729 108 262 182 450 483 494 -165 -17 -642 -607 290 -994 -455 -1045 -611 53 654 97 252 555 58 -102 21 242 -261 -53 -524 -229 -44 183 167 63 326 201 702 300 549 237 331 -627 329 -252 -1 -321 337 -27 -265 -230 -114 12 -332 -1310 317 -550 -227 -1727 377 -1070 279 -478 -789 83 -1027 234 -1482 1123 -154 984 -848 283 161 473 -75 -278 -327 208 -19 -1264 565 -1190 621 -481 614 -832 -157 -18 -369 70 -568 168 -308 539 -475 382 -382 805 -709 118 -232 196 690 485 -24 719 572 293 765 -343 744 -273 821 -719 1189 555 592 -246 701 -381 287 356 345 1020 -729 531 214 619 -699 -267 -788 -454 -815 -836 -1557 -1417 -518 -1290 394 -353 563 402 779 213 626 95 255 193 521 605 636 -211 -21 -762 -673 327 -1173 -564 -1376 -819 73 993 156 403 907 91 -156 30 352 -401 -83 -866 -378 -70 284 259 94 465 287 1033 471 919 415 589 -1172 622 -494 -2 -659 702 -56 -538 -457 -222 23 SS 20221025T133637.8Z 8333.567104 68 1 49.42 2 77.06 112.40 79.21 111.15 0.00 1 0.00 1 0 25 5.236e-02 4.493e-03 9.034e-03 5.539e-04 4.855470e-01 2.828495e-04 5.243774e-03 -6.000000e+00 2.978191e-02 226.35 -2.00 3.24 -2.00 319.60 0.00e+00 7.008428e-04 8.463842e-05 3.037386e-04 -6.000000e+00 1.375172e-03 290.45 -2.00 20.00 -2.00 318.79 0.00e+00 4.347 0.001 302.00 328.00 3 3.5420e-01 8.1518e-04 4.8977e-02 -6.0000e+00 7.3546e-02 5.2221e-03 9.7867e-04 2.3484e-02 -6.0000e+00 7.9870e-02 -1.5593e-03 7.8204e-04 1.1405e-02 -6.0000e+00 4.7867e-02 -6.4169e-03 4.0964e-04 3.4179e-03 -6.0000e+00 2.0678e-02 2.9518e-03 -4.3259e-04 1.5768e-05 3.6645e-05 -6.0000e+00 1.4317e-03 -6.6057e-03 6.8180e-05 10 0 0 10 0 0 91.99 24.78 0.28 -0.00661 -0.00986 672 143 1 5 0 73.520 27.26 19.99 24.78 20.99 26.5 931.32 900000 -23659 -13175 -15480 -21054 -23060 -12118 -17168 -8399 -11732 -19648 -6189 -13371 -3258 -7061 15277 -2751 1328 -3746 678 -2884 -2853 -2184 -3401 -2508 -2654 -1072 -4470 -1970 -5712 700 -851 235 -1225 -3717 -2863 -3712 -680 -1898 -661 -1456 -220 -529 15 -291 491 -603 -154 -514 156 878 514 1014 831 1168 813 967 21 715 194 797 845 1431 1604 971 450 -8 -248 375 627 363 509 174 470 304 140 -730 -778 -530 -833 -793 -971 -1548 -1272 -786 -768 -144 128 490 705 924 690 474 512 368 158 279 607 153 -112 -329 -701 -553 -302 -677 -967 -623 -519 -119 334 273 260 216 59 5 127 117 -113 -140 -275 -462 -237 51 204 302 397 335 848 433 418 248 60 60 78 -49 -85 -136 131 -43 -160 -126 -244 -213 900000 -433 -226 -256 -339 -384 -201 -346 -175 -270 -507 -158 -428 -116 -302 626 -142 71 -226 41 -185 -185 -149 -257 -195 -217 -86 -356 -156 -481 64 -90 28 -152 -449 -349 -494 -106 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