File name: Pandora25s1_HoustonTX_20220507_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T145633.1Z 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 v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220507_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: 20220507 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 20220507T124356.0Z 8162.530509 73 1 49.77 2 76.23 78.19 123.77 18.64 0.00 1 0.00 1 0 25 9.216e-01 5.938e-02 8.988e-02 3.555e-03 4.860668e-01 1.863143e-03 1.055405e-02 -6.000000e+00 5.365546e-01 230.58 -2.00 3.24 -2.00 320.28 0.00e+00 4.581561e-02 6.724470e-04 1.013610e-02 -6.000000e+00 2.549761e-02 289.53 -2.00 20.00 -2.00 319.56 0.00e+00 4.102 0.001 302.00 328.00 3 3.5719e+00 5.7792e-03 5.2252e-02 -6.0000e+00 1.3443e+00 6.3720e-01 6.6220e-03 2.3894e-02 -6.0000e+00 1.4627e+00 -1.0547e+00 3.6652e-03 1.5581e-02 -6.0000e+00 8.6565e-01 5.1673e-01 1.9309e-03 1.8929e-02 -6.0000e+00 3.6504e-01 1.1792e-04 -7.7698e-03 1.0015e-04 5.1050e-04 -6.0000e+00 2.5938e-02 1.2051e-02 -1.1091e-03 12 8 8 10 0 0 99.98 23.61 0.21 0.01205 -0.04634 68 14 1 5 0 731.750 26.21 20.00 23.61 32.29 25.2 1017.84 -64249 900000 341098 900000 302576 229133 900000 254576 900000 177049 137176 301460 148199 216809 200607 900000 247698 242628 219305 240305 192075 186272 137892 134091 91959 97420 75060 88750 101909 82025 147976 132865 130199 111715 92380 112550 99301 92875 61794 44003 32151 42273 46690 49512 56723 59733 53869 51251 58055 49731 51151 41310 34186 31754 17554 10623 7061 -5982 -1758 4619 12869 14383 13654 16563 14986 13262 10515 7198 7002 2186 711 -1666 -4834 -7266 -6530 -4352 -10064 -6959 -2673 -1746 -1856 -5413 -7126 -4069 -8251 -10890 -7891 -6905 -6389 -4202 -4850 -6622 -8733 -9427 -7631 -5074 -3937 -1892 -1365 -1099 128 -2732 -2745 -2840 -2230 -2218 -1662 -1246 816 517 639 483 663 29 -111 425 1232 1521 2145 3481 3920 4731 4727 5174 4045 5080 3566 4076 2978 3325 3106 1858 1131 1090 -443 -1110 -1592 -1474 -2247 -1916 -1733 -2661 -3862 -25363 900000 3832 900000 3447 4058 900000 2514 900000 2633 2731 1620 4251 4537 6001 900000 6009 6467 7250 6462 7315 6593 6444 5456 4729 4446 4083 4374 4886 5537 6717 7926 8619 8507 7539 7273 7375 7701 7207 6304 5250 6524 7377 8089 9199 9916 9768 9729 10457 9894 10588 9845 8962 8590 5229 3216 2113 -1942 -545 1413 3997 4972 5349 6889 6406 5482 4272 2998 3128 1124 392 -946 -2735 -3949 -3241 -1931 -4462 -3087 -1290 -973 -1172 -3867 -5446 -3143 -6948 -9872 -7271 -6488 -5999 -3760 -4103 -5303 -6780 -7487 -6578 -4873 -4259 -2249 -1720 -1374 150 -3020 -2858 -3004 -2493 -2604 -2044 -1617 1118 769 1012 788 1066 46 -165 608 1775 2289 3388 5665 6378 7503 7310 7739 5892 7105 4909 5730 4569 5507 5460 3414 2143 2134 -913 -2376 -3463 -3239 -4963 -4118 -3577 -5305 -7554 SS 20220507T130303.7Z 8162.543793 79 1 15.03 2 72.14 80.34 122.37 23.32 0.00 1 0.00 1 0 25 1.137e-01 1.535e-02 1.061e-01 8.404e-03 4.326436e-01 4.365655e-03 4.321796e-03 -6.000000e+00 6.684947e-02 230.58 -2.00 3.24 -2.00 319.24 0.00e+00 1.376682e-04 1.159788e-03 9.169686e-04 -6.000000e+00 3.038133e-03 289.53 -2.00 20.00 -2.00 318.43 0.00e+00 3.216 0.000 302.00 328.00 3 5.0454e+00 1.2358e-02 3.7960e-02 -6.0000e+00 1.6680e-01 6.1431e-02 1.4602e-02 2.0238e-02 -6.0000e+00 1.8021e-01 1.2386e-03 1.1112e-02 1.0488e-02 -6.0000e+00 1.0728e-01 -1.0549e-02 5.8117e-03 3.6368e-03 -6.0000e+00 4.6273e-02 7.9551e-05 9.2112e-03 2.4543e-04 3.4195e-05 -6.0000e+00 3.1290e-03 -1.3524e-02 2.2518e-03 12 9 9 12 41 1 99.78 23.70 0.56 -0.01352 0.05569 3 3 1 5 0 3713.580 26.32 20.00 23.70 33.21 25.2 1022.99 900000 35764 900000 36969 -12340 -36555 900000 -24616 18168 27379 -11158 -3579 -28224 49428 6921 900000 -6595 16916 666 44217 1388 22719 -21985 19117 -6540 -6951 -13216 -8251 -3768 -33530 24582 8314 18016 -13537 -11502 7448 16631 17193 -2784 -728 -13156 9688 953 7350 1169 5595 -8230 -3401 1764 -398 5328 -3393 171 2468 1211 -3861 8078 -699 -1190 124 1881 -4249 -237 1350 -26 -2752 -741 -704 2765 1200 3115 3075 1492 313 -29 5098 -1452 2646 1339 18 -649 -2547 -1034 2562 -1542 -3652 850 -1600 -1031 1726 -186 772 1922 459 -991 1022 -824 573 532 -701 1054 -1321 -183 -1677 1332 766 -2247 -2482 1596 -989 61 -516 924 -912 -744 202 -40 -255 -169 -369 -798 1068 1130 1195 115 1164 -359 1890 -297 879 573 167 -309 1798 -470 113 -197 243 -668 -662 -292 -632 17 900000 572 900000 588 -285 -1041 900000 -775 432 639 -381 -123 -1432 1448 357 900000 -473 1041 51 2343 113 1514 -2327 1486 -693 -777 -1577 -899 -378 -4572 2163 959 2111 -2216 -1763 953 2153 2608 -612 -183 -4071 2570 284 2091 354 1640 -2737 -1086 543 -130 1775 -1328 69 1041 538 -1848 3556 -332 -556 57 877 -2251 -133 801 -16 -1630 -416 -398 1636 804 2218 2265 1106 226 -20 3005 -844 1466 806 13 -500 -2182 -929 2336 -1533 -3892 910 -1783 -1142 1814 -187 723 1699 412 -961 1072 -963 722 702 -924 1304 -1553 -203 -1929 1587 955 -2975 -3426 2250 -1509 97 -842 1468 -1410 -1091 284 -56 -372 -258 -586 -1277 1661 1718 1766 165 1611 -488 2575 -439 1372 940 283 -537 3188 -883 219 -387 483 -1337 -1297 -554 -1163 31 SS 20220507T131244.4Z 8162.550514 86 1 42.70 2 70.07 81.43 121.55 25.60 0.00 1 0.00 1 0 17 1.971e-02 4.559e-03 6.228e-03 8.404e-04 3.896922e-01 4.290400e-04 4.217353e-03 -6.000000e+00 1.137975e-02 230.58 -2.00 3.24 -2.00 318.69 0.00e+00 3.348616e-04 9.359015e-05 1.173800e-04 -6.000000e+00 5.122743e-04 289.53 -2.00 20.00 -2.00 317.83 0.00e+00 2.901 0.000 302.00 328.00 3 2.4314e+00 1.1822e-03 3.4594e-02 -6.0000e+00 2.8397e-02 2.9172e-03 1.3595e-03 1.8873e-02 -6.0000e+00 3.0748e-02 1.6337e-03 9.2470e-04 9.1300e-03 -6.0000e+00 1.8348e-02 -6.0893e-03 4.8315e-04 2.5330e-03 -6.0000e+00 7.7908e-03 1.6024e-03 -1.5495e-04 2.4136e-05 2.7243e-05 -6.0000e+00 5.3707e-04 -1.7410e-03 8.5446e-05 12 1 1 12 9 1 100.00 23.75 0.26 -0.00174 -0.00291 287 71 1 5 0 147.670 26.32 20.00 23.75 33.60 25.3 1024.88 -6230 -5377 -4582 -4816 -9928 -6989 -1143 -4190 244 -4542 -8956 -764 -4727 -2236 -2842 6860 521 874 -1077 1184 -360 -1091 -491 264 -426 28 -26 -1326 -791 -1644 2159 467 1424 -1029 -2674 -1663 -1499 -676 -988 -1330 -1380 -561 -558 -475 -237 -182 -752 -776 -431 67 639 505 756 1240 616 962 969 249 592 494 1008 718 1154 1390 736 30 -50 -369 647 606 152 547 223 636 343 301 -492 -586 -289 -633 -784 -1093 -1591 -1238 -930 -611 -248 46 370 516 571 532 229 437 344 197 326 473 94 -277 -358 -650 -603 -218 -491 -719 -599 -628 -40 552 105 -3 166 41 -88 176 212 72 42 -32 -339 -150 93 235 314 392 276 845 480 435 279 -100 -26 172 26 -25 -202 202 -49 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