File name: Pandora25s1_HoustonTX_20221031_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T161017.7Z 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_20221031_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: 20221031 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 20221031T132231.4Z 8339.557308 62 1 10.17 2 80.93 112.17 159.37 83.74 0.00 1 0.00 1 0 25 1.266e+00 5.378e-02 2.591e-01 6.053e-03 6.047716e-01 3.248147e-03 1.412268e-02 -6.000000e+00 7.411426e-01 225.98 -2.00 3.24 -2.00 320.94 0.00e+00 4.571783e-02 1.573569e-03 1.787143e-02 -6.000000e+00 3.614796e-02 289.92 -2.00 20.00 -2.00 320.32 0.00e+00 6.011 0.003 302.00 328.00 3 1.2707e+00 1.1251e-02 9.1508e-02 -6.0000e+00 1.8404e+00 9.5418e-01 1.2874e-02 5.2768e-02 -6.0000e+00 2.0065e+00 -1.5050e+00 6.5482e-03 1.8615e-02 -6.0000e+00 1.1748e+00 6.9077e-01 3.6118e-03 1.0523e-02 -6.0000e+00 5.0232e-01 1.7075e-04 -2.8152e-03 1.6887e-04 6.3835e-04 -6.0000e+00 3.6309e-02 -1.1941e-02 5.9399e-05 12 9 9 12 1 1 75.20 24.86 0.44 -0.01194 -0.03310 17 19 1 5 0 555.390 27.35 20.00 24.86 25.41 26.7 954.58 -45835 900000 335785 900000 375699 900000 900000 900000 900000 310182 134492 900000 183495 261435 302610 157407 392305 466755 345084 294857 344118 273670 165832 170321 225080 274823 170292 144699 199422 116736 278605 193998 208503 176500 146197 142837 139688 211885 98592 98338 75676 103005 81516 95607 90670 96989 83735 74697 89432 74808 83335 63736 65707 58396 46652 35676 28903 13844 17597 15221 24476 23269 28597 29686 28767 26338 21588 19535 11838 11647 7295 5374 3660 -2072 521 -1687 -8856 -2700 1496 382 372 -4059 -4229 -4277 -6035 -8039 -7388 -8071 -6211 -4703 -4695 -5613 -7224 -10810 -11318 -6921 -6533 -3733 -2686 -1616 -1321 -2532 -4040 -5753 -4119 -4838 -2729 -2815 -273 -732 166 -323 140 -871 -419 -795 749 969 825 3048 3628 5213 4181 5212 4363 4948 3244 4397 2530 2998 3208 2525 1981 1572 -267 -212 -1118 -1120 -1672 -2288 -1313 -2782 -3759 -16854 900000 3959 900000 2215 900000 900000 900000 900000 1829 2379 900000 3065 2826 2825 6853 2313 2752 3144 3911 2766 3496 5214 4184 2895 1915 2928 3199 2993 4359 2837 5051 5224 6070 6033 5544 5559 4268 6539 6332 6246 7186 6876 7414 7771 8225 8430 8502 8963 8922 9674 9567 10042 9772 8547 6908 5675 2995 3551 3217 5117 5203 6984 8063 8237 7464 6173 5676 3963 4375 3072 2342 1566 -870 192 -571 -3021 -891 544 170 180 -2326 -2621 -2773 -4208 -6063 -5455 -6203 -4719 -3647 -3402 -3810 -4736 -7524 -8932 -5794 -6454 -3935 -3095 -1863 -1430 -2653 -3909 -5638 -4264 -5381 -2982 -3337 -349 -1000 250 -519 224 -1364 -618 -1136 1069 1461 1333 5070 6011 8240 6446 7690 6231 7176 4629 6419 3991 5049 5931 4761 3925 3292 -577 -480 -2607 -2648 -3976 -5284 -2822 -5972 -7780 SS 20221031T133322.7Z 8339.564846 67 1 49.53 2 78.76 113.68 157.15 85.50 0.00 1 0.00 1 0 25 1.609e-01 4.885e-03 2.626e-02 9.153e-04 5.519550e-01 4.719055e-04 5.907349e-03 -6.000000e+00 9.145416e-02 225.98 -2.00 3.24 -2.00 320.26 0.00e+00 1.406466e-03 1.772452e-04 2.532608e-04 -6.000000e+00 4.186083e-03 289.92 -2.00 20.00 -2.00 319.52 0.00e+00 4.951 0.001 302.00 328.00 3 6.3281e-01 1.4478e-03 5.5758e-02 -6.0000e+00 2.2573e-01 -9.4760e-03 1.8249e-03 2.6759e-02 -6.0000e+00 2.4506e-01 -5.9926e-03 1.6142e-03 1.3270e-02 -6.0000e+00 1.4683e-01 -5.1537e-03 8.1988e-04 4.4042e-03 -6.0000e+00 6.3128e-02 1.1876e-03 -2.7311e-04 2.5820e-05 4.7157e-05 -6.0000e+00 4.3742e-03 -1.3256e-02 1.6312e-04 10 0 0 10 0 0 -11.17 24.86 0.24 -0.01326 -0.01531 393 83 1 5 0 126.000 27.26 20.00 24.86 26.48 27.2 961.84 -91053 -39803 -48217 -51901 -69986 -68787 -11457 -59732 -6038 -41082 -48802 -17702 -25923 -15124 -21645 -7207 -8906 10339 -8839 -2273 -6041 -8010 -15456 -5742 -7410 -3927 -8995 -3465 -4384 -13070 821 -1067 505 -4062 -4776 -5555 -3012 -353 -2058 -1678 -929 615 956 1379 925 1087 -998 196 537 350 1201 1767 642 1536 1224 1259 1078 -549 807 -427 557 413 1559 1941 1320 524 620 -608 419 936 367 675 296 517 457 71 -1217 -585 -790 -746 -590 -836 -1515 -1179 -977 -666 3 198 673 803 788 723 529 -9 114 -32 156 413 201 -122 -201 -627 -783 -644 -738 -974 -856 -608 -38 719 311 374 363 301 38 64 30 -82 -303 -252 -481 -157 40 156 356 468 158 681 508 433 292 -23 -109 35 -77 -29 -165 168 -125 -171 26 -211 -144 -1204 -362 -505 -539 -806 -793 -91 -809 -60 -567 -764 -233 -463 -306 -576 -195 -272 287 -321 -82 -212 -290 -643 -238 -340 -184 -448 -158 -199 -700 45 -70 37 -328 -372 -442 -263 -36 -244 -236 -145 101 164 242 165 198 -189 38 107 74 281 425 171 438 370 397 351 -181 256 -136 184 151 637 817 577 223 258 -264 199 510 221 422 184 303 246 35 -560 -270 -407 -452 -388 -625 -1239 -960 -851 -618 3 187 668 765 700 598 445 -7 103 -31 175 497 261 -158 -244 -732 -851 -711 -880 -1169 -1082 -819 -52 1041 495 622 600 476 56 96 45 -123 -486 -423 -810 -256 63 238 544 688 225 995 786 714 525 -41 -207 71 -158 -60 -355 366 -274 -364 55 -421 -291 SS 20221031T133921.8Z 8339.569002 70 1 49.43 2 77.57 114.54 155.92 86.39 0.00 1 0.00 1 0 25 1.361e-01 5.363e-03 1.996e-02 9.183e-04 5.079057e-01 4.706678e-04 5.470886e-03 -6.000000e+00 7.736289e-02 225.98 -2.00 3.24 -2.00 320.06 0.00e+00 1.398650e-03 1.626940e-04 2.300566e-04 -6.000000e+00 3.542155e-03 289.92 -2.00 20.00 -2.00 319.30 0.00e+00 4.514 0.001 302.00 328.00 3 1.0300e+00 1.4117e-03 5.0948e-02 -6.0000e+00 1.9094e-01 -1.7482e-02 1.7421e-03 2.4602e-02 -6.0000e+00 2.0733e-01 3.9580e-03 1.4763e-03 1.2142e-02 -6.0000e+00 1.2422e-01 -8.8872e-03 7.6004e-04 3.9218e-03 -6.0000e+00 5.3385e-02 1.2637e-03 -6.3398e-04 2.6249e-05 4.1389e-05 -6.0000e+00 3.7024e-03 -1.2089e-02 1.0728e-04 10 0 0 10 0 0 99.52 24.86 0.26 -0.01209 -0.01685 491 104 1 5 0 100.650 27.26 20.00 24.86 27.21 26.9 964.91 -119563 -17806 -36422 -22415 -54282 -37930 -18271 -28519 188 -28804 -30925 -14467 -15720 -15011 -5073 20940 2032 2753 -341 -81 881 -2111 -6159 -1937 -7301 1157 -5464 -1047 -4637 -3396 1826 2277 390 932 -6166 -2275 -3639 1230 -1635 -2041 -982 -321 1558 -35 2035 650 -368 -221 657 -274 1324 921 553 1304 1034 1216 510 44 192 215 381 866 1229 1773 976 382 157 -439 892 739 701 624 347 92 484 -255 -993 -842 -406 -334 -769 -1022 -1558 -1205 -1139 -657 -184 225 504 879 611 773 279 208 164 166 294 360 149 -114 -187 -739 -625 -717 -637 -1054 -769 -528 -111 775 242 356 433 279 58 183 -40 6 -210 -297 -581 -187 -1 275 354 466 172 719 506 399 301 -3 -113 13 -68 -79 -179 64 -29 -138 -82 -144 -119 -3168 -212 -549 -279 -857 -513 -225 -448 3 -505 -577 -259 -352 -416 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