File name: Pandora32s1_GreenbeltMD_20241126_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241127T050907.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241126_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20241126 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20241126T133632.2Z 9096.567040 219 1 48.87 2 75.89 132.91 45.41 182.36 0.00 1 0.00 1 0 25 1.770e-01 8.419e-03 8.553e-02 3.217e-03 4.948027e-01 1.632373e-03 5.715881e-03 -6.000000e+00 9.949329e-02 223.41 -2.00 3.47 -2.00 320.05 0.00e+00 1.633836e-03 5.399402e-04 3.669169e-04 -6.000000e+00 4.407661e-03 280.24 -2.00 20.00 -2.00 319.44 0.00e+00 4.013 0.001 302.00 328.00 3 3.4122e+00 4.7662e-03 4.6757e-02 -6.0000e+00 2.4505e-01 2.7592e-02 5.8130e-03 2.5245e-02 -6.0000e+00 2.6662e-01 -2.3404e-02 5.1050e-03 1.3002e-02 -6.0000e+00 1.5916e-01 2.5703e-03 2.6419e-03 4.2926e-03 -6.0000e+00 6.8426e-02 1.9019e-04 -3.9641e-04 9.1438e-05 4.6195e-05 -6.0000e+00 4.7073e-03 3.1808e-03 -4.7776e-05 11 8 0 10 0 0 99.98 20.92 0.33 0.00318 0.00020 71 17 1 5 0 688.150 25.90 20.49 20.92 15.11 5.3 949.87 -20811 -31788 -49995 -70852 79512 -103549 57230 -60715 -19485 -2489 -53362 -9889 -47320 21144 -19321 -1582 -134 -27997 27272 -6817 4463 -2630 -3133 5724 -17892 10977 -97 -4270 981 -10040 5686 -10946 18474 -2679 673 4 -6949 5583 -9657 7879 -309 -251 -1062 -2062 7701 -2680 5417 3527 -2495 1227 -2046 8042 -472 4424 902 1178 2237 -1293 507 -719 1695 2033 -436 3455 -590 2050 -284 1266 943 877 1463 -1667 1044 -214 -823 317 -2540 768 -3259 -1145 -1454 -1052 -1031 -2314 139 -1067 337 503 278 1289 -445 1791 -707 195 589 -650 832 42 932 -429 -279 -812 -1458 727 -1442 -778 -777 -682 506 -220 659 53 361 348 66 283 -102 414 -288 -154 -136 -246 550 -171 569 493 -103 961 -242 952 -28 54 -629 -40 111 -239 -10 45 252 -133 14 65 -577 -240 -479 -969 -1664 429 -2873 375 -1333 -334 -40 -1412 -186 -1453 426 -683 -56 -5 -1516 960 -345 212 -134 -163 294 -1234 620 -6 -279 59 -674 364 -940 1382 -265 64 0 -714 589 -1411 1169 -56 -49 -219 -440 1524 -592 1125 753 -574 282 -520 2055 -141 1360 302 409 793 -477 181 -254 597 763 -185 1563 -292 974 -132 574 454 476 874 -1078 665 -134 -486 170 -1279 365 -1683 -660 -958 -771 -821 -1960 121 -998 327 504 280 1267 -421 1566 -595 161 513 -635 894 50 1193 -564 -354 -957 -1607 784 -1668 -945 -982 -900 698 -327 1045 88 600 561 101 416 -149 618 -452 -253 -227 -404 873 -267 856 720 -146 1352 -366 1551 -48 98 -1181 -77 224 -504 -23 98 553 -288 30 130 -1136 SS 20241126T140034.9Z 9096.583737 238 1 26.60 2 72.61 137.64 46.02 190.55 0.00 1 0.00 1 0 25 4.191e-02 5.502e-03 6.065e-03 7.514e-04 4.151500e-01 3.745912e-04 4.906795e-03 -6.000000e+00 2.355596e-02 223.41 -2.00 3.47 -2.00 318.65 0.00e+00 9.054333e-04 8.069120e-05 1.919034e-04 -6.000000e+00 1.043546e-03 280.24 -2.00 20.00 -2.00 317.99 0.00e+00 3.298 0.001 302.00 328.00 3 1.1809e+00 1.0123e-03 3.8588e-02 -6.0000e+00 5.8017e-02 8.7081e-03 1.1615e-03 2.0916e-02 -6.0000e+00 6.3123e-02 -1.5306e-02 8.2643e-04 1.0468e-02 -6.0000e+00 3.7682e-02 1.1682e-03 4.4039e-04 3.1351e-03 -6.0000e+00 1.6202e-02 3.8588e-03 -4.0310e-04 2.1006e-05 3.3334e-05 -6.0000e+00 1.1145e-03 1.6374e-03 -9.7501e-05 12 1 1 12 1 1 99.90 20.94 0.31 0.00164 -0.00139 206 89 1 5 0 128.450 25.90 19.46 20.94 15.52 5.3 951.93 -7651 -14650 -7456 -13316 -17181 -17786 -19104 -9530 -14710 -8304 -14803 -10261 -7687 -6178 -124 -3229 -1311 -826 421 1261 -1109 640 -498 -796 -782 -451 -193 -2681 -777 -2560 271 905 914 370 -2942 -1978 -3079 -1927 -105 -614 -18 -884 65 -304 64 471 33 479 -612 274 1127 1347 1352 1236 1409 984 1120 362 381 423 765 1497 1580 2005 952 143 140 -208 555 843 182 239 -129 123 -17 -372 -572 -1269 -980 -872 -902 -1285 -1749 -1812 -1093 -588 -312 87 187 491 503 737 77 202 610 279 270 419 274 -116 -349 -851 -778 9 -589 -1131 -545 -604 -146 409 263 371 278 432 126 318 346 173 70 -53 -377 -117 137 231 299 511 82 987 508 273 243 -190 -94 11 14 -174 -191 170 -36 -167 -48 -235 -395 -258 -566 -289 -541 -660 -641 -722 -369 -688 -398 -778 -534 -447 -428 -10 -305 -134 -90 48 150 -140 80 -64 -109 -116 -65 -28 -391 -115 -382 42 147 168 74 -592 -376 -623 -447 -29 -190 -6 -334 25 -123 26 191 14 195 -253 115 462 605 658 645 774 524 614 201 208 242 413 860 1005 1312 661 96 95 -138 386 622 142 199 -109 100 -13 -272 -404 -858 -689 -654 -735 -1186 -1675 -1837 -1107 -636 -357 99 212 571 549 780 76 192 613 298 311 517 370 -160 -459 -1073 -901 11 -727 -1432 -719 -841 -206 594 414 588 438 674 184 453 483 251 104 -84 -609 -186 210 343 443 723 115 1377 731 416 383 -315 -161 19 26 -322 -366 317 -68 -322 -88 -430 -698 SS 20241126T141058.7Z 9096.590957 241 1 39.98 2 71.28 139.77 46.48 194.01 0.00 1 0.00 1 0 25 3.403e-02 5.614e-03 1.160e-02 1.601e-03 3.906015e-01 7.966586e-04 4.617362e-03 -6.000000e+00 1.913444e-02 223.41 -2.00 3.47 -2.00 318.52 0.00e+00 9.786655e-04 1.645551e-04 1.911144e-04 -6.000000e+00 8.474367e-04 280.24 -2.00 20.00 -2.00 317.86 0.00e+00 3.077 0.000 302.00 328.00 3 3.2420e+00 2.1469e-03 3.6083e-02 -6.0000e+00 4.7127e-02 2.3999e-02 2.4574e-03 1.9641e-02 -6.0000e+00 5.1270e-02 -1.1418e-02 1.7121e-03 9.8470e-03 -6.0000e+00 3.0606e-02 -5.1646e-04 9.0855e-04 2.9885e-03 -6.0000e+00 1.3163e-02 6.1748e-04 -1.9125e-04 4.5004e-05 3.1385e-05 -6.0000e+00 9.0502e-04 9.4076e-04 -5.3905e-05 12 1 1 12 1 1 99.94 20.97 0.27 0.00094 -0.00050 46 13 1 5 0 850.380 26.00 19.48 20.97 16.01 5.3 955.62 14774 -11185 -7732 -12007 -5865 -16346 -5263 -9269 -8770 -8420 -11726 -11507 -6098 -2862 1313 -1775 -3674 -1615 1453 1033 -482 376 1272 -369 -1293 -49 417 -2207 -1670 -2361 1497 -964 4161 73 -3883 -1980 -4384 -701 -1422 220 -276 -629 382 -421 700 814 -163 172 -162 -16 351 1405 936 1357 870 1009 1024 -227 357 422 1059 1768 1402 2028 612 348 289 34 261 763 320 64 -412 110 -285 -593 -1021 -1043 -976 -853 -1080 -1262 -1972 -1939 -543 -835 -16 239 37 592 393 1052 77 670 616 175 268 420 491 -150 -530 -682 -860 -154 -638 -975 -542 -457 9 321 274 481 220 323 45 435 229 349 106 -70 -546 -75 231 175 446 55 217 723 298 272 108 -184 -230 151 -38 -67 -187 166 3 -50 -63 -103 -510 458 -509 -365 -584 -247 -708 -213 -434 -464 -480 -706 -711 -404 -219 114 -182 -417 -190 177 132 -65 50 170 -53 -201 -8 69 -362 -259 -365 238 -175 802 16 -840 -404 -955 -168 -406 72 -101 -246 153 -173 287 337 -68 71 -68 -7 155 663 470 717 481 571 593 -133 206 239 607 1061 911 1407 444 247 194 22 179 572 261 55 -355 92 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