File name: Pandora25s1_HoustonTX_20231129_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T232159.3Z 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_20231129_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: 20231129 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 20231129T140453.0Z 8733.586724 278 1 49.59 2 78.00 123.54 77.11 294.84 0.00 1 0.00 1 0 25 1.652e-01 4.999e-03 3.875e-02 1.173e-03 5.838995e-01 6.079568e-04 6.247519e-03 -6.000000e+00 9.364987e-02 224.69 -2.00 3.24 -2.00 320.26 0.00e+00 2.052034e-03 2.269512e-04 3.716646e-04 -6.000000e+00 4.281634e-03 287.52 -2.00 20.00 -2.00 319.56 0.00e+00 4.664 0.001 302.00 328.00 3 1.3753e+00 1.8466e-03 5.4071e-02 -6.0000e+00 2.3066e-01 1.2268e-02 2.3366e-03 2.8369e-02 -6.0000e+00 2.5061e-01 -1.2616e-02 2.1359e-03 1.4267e-02 -6.0000e+00 1.5010e-01 -5.6440e-03 1.0846e-03 5.2535e-03 -6.0000e+00 6.5154e-02 6.9434e-04 -5.5950e-04 3.2484e-05 5.1355e-05 -6.0000e+00 4.5138e-03 -2.9982e-02 1.3105e-04 10 0 0 10 0 0 94.72 24.10 0.23 -0.02998 -0.03419 200 42 1 5 0 247.890 26.62 19.99 24.10 16.59 29.5 1004.93 900000 -32475 -90629 2457 -98454 -68974 -12063 -43918 -22989 -30935 -64197 -17237 -47300 -27631 -19110 24087 -3330 -3739 -1089 -8281 338 -11847 -4087 -11261 -6056 -6862 -12506 -10473 -12641 -7467 -2107 -72 -3144 716 -7391 2430 -5835 7550 -670 -1046 -1799 -61 -861 -431 2794 512 -18 -1439 2299 -516 2191 -20 1012 1630 1078 616 1361 -533 -6 153 193 1147 1119 1967 227 982 -66 -255 718 1007 1074 472 573 -155 791 -150 -1034 -1065 -442 -709 -561 -1207 -1404 -1338 -909 -491 15 507 398 1055 679 1101 327 489 -60 336 -12 415 287 -113 -279 -863 -535 -765 -608 -1134 -534 -715 -41 18 328 273 374 340 -14 221 6 63 -275 -121 -491 -136 36 326 118 425 220 841 347 297 346 -80 -18 145 -103 -65 -139 20 -35 -142 -43 -117 -178 900000 -245 -1262 14 -1336 -711 -80 -449 -219 -344 -1021 -200 -899 -549 -432 430 -85 -106 -32 -278 11 -426 -144 -463 -257 -310 -606 -486 -592 -357 -112 -4 -225 52 -564 169 -484 654 -76 -140 -270 -10 -144 -74 471 90 -3 -270 433 -106 481 -5 269 464 325 194 437 -174 -2 48 63 402 437 839 102 429 -29 -113 343 538 623 285 345 -90 426 -74 -488 -505 -227 -416 -372 -892 -1114 -1110 -792 -448 14 489 385 990 607 932 269 407 -54 334 -13 500 368 -146 -346 -1002 -584 -838 -700 -1368 -666 -933 -56 26 515 444 609 540 -22 328 9 95 -437 -198 -809 -220 57 502 177 622 314 1215 539 497 613 -148 -34 285 -212 -138 -299 43 -76 -306 -90 -235 -350 SS 20231129T141043.1Z 8733.590776 281 1 49.51 2 76.95 124.43 78.22 295.41 0.00 1 0.00 1 0 17 1.937e-01 1.551e-02 2.180e-02 9.745e-04 5.399296e-01 4.980561e-04 5.872555e-03 -6.000000e+00 1.098329e-01 224.69 -2.00 3.24 -2.00 319.95 0.00e+00 5.186704e-03 1.667595e-04 6.802723e-04 -6.000000e+00 4.993999e-03 287.52 -2.00 20.00 -2.00 319.24 0.00e+00 4.315 0.001 302.00 328.00 3 1.3950e+00 1.4689e-03 4.9916e-02 -6.0000e+00 2.7053e-01 5.7882e-02 1.7895e-03 2.5815e-02 -6.0000e+00 2.9384e-01 -1.0299e-01 1.4863e-03 1.4049e-02 -6.0000e+00 1.7598e-01 4.2746e-02 7.6863e-04 6.6666e-03 -6.0000e+00 7.5899e-02 9.7977e-04 -4.8376e-04 2.7120e-05 6.7143e-05 -6.0000e+00 5.2612e-03 -3.0510e-02 1.4982e-04 12 9 8 11 8 0 75.75 24.10 0.21 -0.03051 -0.03414 250 53 1 5 0 198.010 26.62 20.00 24.10 16.95 29.6 1007.64 -214056 4416 -25650 6361 -22906 -14401 5302 -17217 2716 1004 -21457 3688 -13386 7883 5854 20805 13539 15434 15070 13463 14247 5896 8964 3524 4184 1324 2835 -1372 2983 4773 11772 11999 10158 9358 3935 8133 5286 9713 3598 4052 1243 2959 2060 4113 5493 5019 4149 4364 5563 3853 5497 3324 3543 3260 2618 1285 972 -366 220 362 976 1652 2066 2860 1951 1784 797 149 662 1093 221 260 4 -377 -33 -591 -1568 -2007 -1220 -1014 -1138 -1382 -2111 -1987 -1718 -1502 -848 -462 -64 562 530 332 -306 -249 -351 -351 -332 263 63 -143 -184 -804 -701 -837 -741 -1011 -731 -581 -43 96 393 383 237 280 54 210 228 66 64 274 -49 292 382 661 580 944 520 1136 782 615 594 265 67 121 -82 -185 -216 -32 -247 -304 -383 -513 -606 -16025 51 -423 73 -321 -180 58 -265 38 15 -419 63 -310 187 176 636 495 606 639 609 652 292 445 198 248 84 180 -88 181 304 756 902 889 873 370 725 533 1107 530 652 230 574 424 853 1141 1073 910 977 1270 945 1457 997 1076 1069 908 467 362 -138 80 131 364 673 946 1355 971 860 376 72 347 654 138 170 2 -234 -20 -322 -800 -1024 -680 -622 -811 -1057 -1775 -1766 -1541 -1438 -849 -476 -66 555 488 300 -264 -216 -335 -363 -376 320 83 -191 -231 -968 -775 -930 -884 -1224 -930 -786 -60 141 630 618 382 452 82 317 343 99 102 439 -79 479 605 1008 886 1381 735 1623 1182 996 1047 477 126 230 -166 -382 -459 -70 -518 -643 -770 -1015 -1156 SS 20231129T141644.8Z 8733.594963 284 1 49.53 2 75.88 125.35 79.36 296.02 0.00 1 0.00 1 0 25 7.534e-02 4.737e-03 1.534e-02 7.698e-04 5.077667e-01 3.925128e-04 5.521408e-03 -6.000000e+00 4.270818e-02 224.69 -2.00 3.24 -2.00 319.65 0.00e+00 1.157847e-03 1.189077e-04 2.513660e-04 -6.000000e+00 1.942169e-03 287.52 -2.00 20.00 -2.00 318.90 0.00e+00 4.009 0.001 302.00 328.00 3 1.2953e+00 1.1281e-03 4.6571e-02 -6.0000e+00 1.0520e-01 6.2792e-03 1.3565e-03 2.4360e-02 -6.0000e+00 1.1427e-01 -1.1952e-02 1.1115e-03 1.2072e-02 -6.0000e+00 6.8439e-02 -3.0537e-03 5.8231e-04 3.7819e-03 -6.0000e+00 2.9507e-02 1.5230e-03 -6.7180e-04 2.1670e-05 4.0386e-05 -6.0000e+00 2.0469e-03 -2.9727e-02 8.9740e-05 10 0 0 10 0 0 98.73 24.10 0.25 -0.02973 -0.03478 346 73 1 5 0 143.120 26.62 20.00 24.10 17.45 29.5 1010.35 34973 -19412 -24292 -17783 -30857 -30880 -14010 -25846 -14168 -24031 -25403 -12046 -16470 -13893 -9342 6672 -5354 -2979 -3212 -1877 -1884 -2948 -3748 -3690 -3794 -2698 -4901 -6431 -4864 -3535 -213 347 238 169 -3859 -2007 -2781 176 -429 -929 -1079 152 -399 -67 664 515 -4 -177 338 -171 907 469 710 1163 1099 1099 928 102 518 269 357 854 1184 1477 898 577 259 -384 578 728 514 587 490 229 457 48 -823 -1017 -534 -721 -967 -1105 -1530 -1469 -1083 -732 -177 228 548 762 810 980 470 397 226 151 253 495 278 -171 -262 -824 -698 -622 -642 -919 -577 -595 -218 620 224 273 244 229 -54 183 125 87 -124 -114 -524 -184 58 171 223 452 129 667 484 437 326 64 -47 36 -25 -34 -226 119 -7 -116 -110 -190 -260 279 -306 -426 -280 -507 -504 -211 -504 -279 -564 -628 -289 -506 -474 -372 264 -264 -156 -181 -110 -113 -180 -243 -261 -290 -216 -406 -520 -376 -284 -19 33 26 19 -440 -224 -346 25 -76 -183 -239 36 -98 -17 167 132 -1 -47 91 -49 281 161 248 436 434 451 392 44 214 110 151 394 572 787 498 309 134 -203 330 476 350 417 347 155 301 29 -457 -560 -319 -473 -735 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