File name: Pandora25s1_HoustonTX_20220918_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T155047.1Z 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_20220918_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: 20220918 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 20220918T130154.2Z 8296.542988 245 1 10.18 2 79.07 94.27 4.98 240.83 0.00 1 0.00 1 0 25 5.126e-01 2.876e-02 2.254e-01 1.247e-02 5.996442e-01 6.838920e-03 6.534334e-03 -6.000000e+00 3.003184e-01 228.36 -2.00 3.24 -2.00 320.76 0.00e+00 -5.247920e-03 2.900577e-03 3.450360e-03 -6.000000e+00 1.566297e-02 293.34 -2.00 20.00 -2.00 320.00 0.00e+00 5.079 0.002 302.00 328.00 3 3.4570e+00 2.2530e-02 6.2159e-02 -6.0000e+00 7.5138e-01 1.7369e-01 2.9235e-02 4.3331e-02 -6.0000e+00 8.1915e-01 -2.7751e-01 2.4445e-02 1.4392e-02 -6.0000e+00 4.8421e-01 1.2673e-01 1.1971e-02 9.7530e-03 -6.0000e+00 2.1067e-01 5.7740e-05 4.3565e-04 3.6975e-04 5.6470e-05 -6.0000e+00 1.4888e-02 -4.7871e-03 3.3156e-04 12 9 9 12 1 1 99.98 24.72 0.64 -0.00479 -0.00151 5 6 1 5 0 1667.130 27.15 20.00 24.72 32.15 27.1 989.01 900000 900000 32984 900000 -193484 -104165 900000 -114963 900000 900000 -105988 900000 -123324 371425 -66646 900000 -43233 900000 -32697 94230 900000 -9729 -15722 11038 63596 -50515 65623 -66866 26775 -64077 900000 7066 53168 45355 -15088 190971 -19288 900000 17683 62308 1017 64027 2397 37802 17669 53484 6769 -10401 27094 3279 37727 10484 20217 -956 30850 2448 33015 -14974 24294 -2985 17166 -1173 -4809 6222 -4592 7151 2896 9966 1092 8749 -3123 8174 385 -3347 4416 4400 -13279 -1186 -8045 -2968 5446 -7502 476 3447 4708 -2285 3456 -1966 -2047 -1143 795 -4084 498 -3589 -4024 4664 -4837 1060 -1473 -591 -72 -2991 -1497 -4670 -331 -303 -1233 -3098 3610 -1107 1272 -247 1946 751 1180 -877 1517 -1170 -716 -436 -1525 2690 597 1821 889 3340 89 3394 174 214 17 -198 -621 1802 -515 -353 517 -624 -405 -1044 750 -1677 74 900000 900000 400 900000 -8731 -2076 900000 -3317 900000 900000 -3555 900000 -6426 4506 -2886 900000 -1839 900000 -1424 1297 900000 -362 -666 406 1561 -3768 1650 -5421 875 -5129 900000 381 2092 1977 -1099 2317 -1658 900000 1576 4313 137 5080 346 3932 2209 4810 944 -1732 3295 529 4881 1928 3687 -229 5810 627 6552 -4600 5030 -781 3835 -338 -1598 2045 -1706 2305 959 3204 422 3580 -1544 3778 188 -1606 1817 1642 -5486 -446 -3570 -1454 2831 -4897 312 2325 3343 -1827 2742 -1672 -1734 -926 596 -3014 342 -2637 -3270 3965 -5010 1160 -1746 -691 -79 -3110 -1451 -4738 -345 -330 -1422 -3830 4542 -1576 1915 -391 3016 1138 1703 -1246 2127 -1740 -1113 -699 -2454 4090 899 2643 1260 4501 120 4607 265 355 30 -367 -1196 3561 -1087 -773 1142 -1409 -910 -2295 1559 -3407 146 SS 20220918T130638.4Z 8296.546277 248 1 49.54 2 78.05 94.88 5.89 246.15 0.00 1 0.00 1 0 25 2.026e-01 9.554e-03 3.012e-02 1.012e-03 5.523397e-01 5.236801e-04 5.932975e-03 -6.000000e+00 1.160611e-01 228.36 -2.00 3.24 -2.00 320.18 0.00e+00 2.931228e-03 1.903823e-04 6.392552e-04 -6.000000e+00 5.351698e-03 293.34 -2.00 20.00 -2.00 319.37 0.00e+00 4.677 0.001 302.00 328.00 3 1.0660e+00 1.6076e-03 5.3491e-02 -6.0000e+00 2.8767e-01 1.9726e-02 2.0116e-03 2.6738e-02 -6.0000e+00 3.1177e-01 -4.2448e-02 1.7046e-03 1.3672e-02 -6.0000e+00 1.8684e-01 1.1951e-02 8.6877e-04 4.9062e-03 -6.0000e+00 8.0055e-02 9.8069e-04 -4.1513e-04 2.8295e-05 5.3707e-05 -6.0000e+00 5.5174e-03 -4.1982e-03 7.2220e-05 12 8 8 10 0 0 49.52 24.72 0.30 -0.00420 -0.00732 289 61 1 5 0 171.380 27.15 19.99 24.72 32.34 27.2 990.68 -206997 1147 -45180 -13987 -54806 -42580 18019 -39754 16778 -32080 -30351 -18125 -17664 -10388 -1351 -16274 7275 8726 875 3631 -2483 -1827 -13575 -195 -5759 -660 -4179 -2617 -4768 -3557 7166 8359 6484 2643 -1159 1248 253 6060 1690 -591 531 591 2518 1781 3140 2268 964 1127 2499 1495 3133 2049 1704 2676 1836 2115 933 -174 36 470 780 1077 1801 2245 1551 961 1209 -102 845 458 472 543 169 373 376 5 -1695 -1113 -1240 -689 -1077 -1067 -1841 -1086 -1084 -969 -307 -19 413 666 765 370 8 -287 -125 12 70 175 176 -339 -182 -906 -704 -691 -822 -1248 -658 -620 -81 947 354 334 286 313 33 232 -3 21 -88 -154 -296 117 287 259 419 540 381 734 684 413 324 -16 -81 -9 -81 -135 -251 139 -63 -98 -178 -277 -328 -9303 9 -567 -122 -664 -462 118 -531 143 -475 -463 -283 -345 -219 -32 -522 205 266 31 132 -98 -72 -639 -9 -293 -34 -221 -131 -244 -197 420 567 471 206 -90 96 22 605 216 -91 90 106 433 315 558 416 182 219 496 321 734 538 489 821 597 713 326 -61 12 160 278 395 742 1016 723 434 534 -47 431 252 284 338 104 216 199 3 -828 -549 -688 -419 -761 -801 -1509 -936 -947 -902 -298 -19 408 629 672 322 7 -248 -114 12 79 212 228 -437 -219 -1046 -757 -761 -979 -1499 -829 -835 -112 1440 564 554 469 491 51 344 -5 31 -141 -257 -493 189 446 407 631 781 533 1064 1053 710 578 -28 -153 -17 -166 -281 -535 302 -136 -204 -368 -543 -652 SS 20220918T131217.2Z 8296.550199 251 1 49.46 2 76.83 95.61 7.01 250.75 0.00 1 0.00 1 0 25 9.052e-02 4.746e-03 1.520e-02 7.614e-04 5.109822e-01 3.916610e-04 5.474635e-03 -6.000000e+00 5.186459e-02 228.36 -2.00 3.24 -2.00 319.81 0.00e+00 1.324165e-03 1.258068e-04 2.176995e-04 -6.000000e+00 2.391404e-03 293.34 -2.00 20.00 -2.00 318.97 0.00e+00 4.275 0.001 302.00 328.00 3 9.8667e-01 1.1537e-03 4.9053e-02 -6.0000e+00 1.2855e-01 -3.9183e-03 1.4051e-03 2.4835e-02 -6.0000e+00 1.3932e-01 -6.6884e-03 1.1426e-03 1.2102e-02 -6.0000e+00 8.3492e-02 -4.2347e-03 5.9352e-04 3.9019e-03 -6.0000e+00 3.5776e-02 1.6338e-03 -3.0840e-04 2.1436e-05 4.0000e-05 -6.0000e+00 2.4654e-03 -4.3665e-03 7.7030e-05 11 1 0 11 8 0 68.82 24.71 0.27 -0.00437 -0.00668 385 82 1 5 0 128.430 27.15 20.00 24.71 32.82 27.1 993.16 -59249 -16978 -40242 -17530 -42348 -30693 -9322 -27224 -10043 -18712 -20989 -14207 -12060 -10831 -9191 6871 -226 -313 -4500 -1813 -1755 -3923 -7825 -4872 -5433 -2683 -5494 -4772 -6628 -4933 -316 956 -732 -709 -4333 -1512 -4177 617 -1153 -1275 -1039 239 -18 -311 519 377 357 -506 345 -292 1357 1027 998 1282 1064 1058 841 425 -5 400 295 800 1198 1904 918 112 -188 -357 700 602 451 386 438 343 569 79 -529 -882 -649 -745 -904 -1019 -1653 -1152 -913 -579 -83 124 718 994 882 626 343 276 327 93 263 457 201 -247 -189 -885 -642 -443 -695 -1051 -602 -698 -80 541 229 264 262 107 17 159 67 -7 -199 -142 -490 -200 75 124 448 453 362 697 430 429 315 46 -27 84 -18 -104 -138 99 -58 -204 -99 -198 -224 -1060 -225 -701 -230 -657 -431 -118 -474 -166 -360 -431 -311 -319 -352 -327 240 -9 -14 -226 -94 -92 -213 -471 -311 -377 -190 -401 -332 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