File name: Pandora32s1_GreenbeltMD_20241029_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241030T045803.6Z 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_20241029_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: 20241029 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 20241029T124844.7Z 9068.533851 148 1 4.05 2 77.19 119.80 49.69 138.27 0.00 1 0.00 1 0 17 2.187e-01 9.883e-03 1.992e-01 6.660e-03 5.440118e-01 3.403186e-03 6.199629e-03 -6.000000e+00 1.235361e-01 224.94 -2.00 3.47 -2.00 320.09 0.00e+00 1.310547e-03 1.170323e-03 4.095826e-04 -6.000000e+00 5.517703e-03 283.44 -2.00 20.00 -2.00 319.44 0.00e+00 4.391 0.001 302.00 328.00 3 2.1361e+00 1.0051e-02 5.1332e-02 -6.0000e+00 3.0496e-01 1.6095e-02 1.2406e-02 2.7840e-02 -6.0000e+00 3.3141e-01 -4.3372e-02 1.1040e-02 1.4209e-02 -6.0000e+00 1.9799e-01 1.1961e-02 5.6730e-03 4.5437e-03 -6.0000e+00 8.4996e-02 4.5888e-04 -4.9398e-04 1.8449e-04 4.7997e-05 -6.0000e+00 5.8225e-03 9.4689e-03 -1.3907e-04 12 9 9 12 1 1 92.42 20.87 0.42 0.00947 0.00576 6 20 1 5 0 577.800 25.79 20.29 20.87 15.10 5.2 949.81 -122942 -60897 48575 -85324 57153 -110349 17504 -92371 -21276 29569 -35187 -16182 -48284 -31949 -2255 -23950 5823 -30204 11658 5206 -748 -16814 -16113 18545 -8778 -2425 -20254 -26040 13362 -17981 18285 -23038 9535 -7455 -5643 14665 -12228 -1484 -7486 1530 2189 2641 3606 -123 7576 -4215 3528 6956 1797 7115 -2194 5175 1192 640 6192 965 2379 115 2522 -1867 1816 5367 -199 2300 -1853 1608 -645 381 328 1284 1011 -1333 2053 51 -379 272 -4675 -1040 -2150 -1807 835 -637 -1756 -2621 -867 -1292 640 1857 1571 733 -67 1001 -1302 -1342 886 -1742 1374 -539 763 -266 -225 -345 -1841 828 6 -948 -837 -588 94 -103 -109 371 -108 288 -646 642 240 669 -175 -237 229 -68 1222 157 882 317 -646 566 -242 88 392 -551 449 -70 471 -215 -426 -107 583 -375 -333 87 -374 -2578 -842 315 -1626 371 -2359 116 -2001 -269 253 -583 -241 -1158 -820 -54 -834 172 -1364 386 194 -31 -807 -789 709 -472 -131 -1332 -1772 611 -1125 917 -1983 697 -695 -510 1064 -1211 -155 -999 224 362 468 665 -24 1405 -884 702 1361 379 1494 -542 1320 343 199 1942 329 827 41 868 -654 627 1928 -83 1038 -911 759 -299 175 161 702 610 -859 1295 31 -221 145 -2418 -512 -1135 -1078 555 -474 -1426 -2245 -770 -1212 618 1828 1556 717 -63 883 -1115 -1146 793 -1756 1497 -653 981 -348 -284 -408 -2061 907 7 -1159 -1060 -775 129 -153 -171 607 -177 462 -1000 951 353 1010 -276 -389 377 -111 1927 244 1331 467 -932 815 -374 147 690 -1012 841 -135 951 -451 -911 -232 1261 -803 -689 174 -732 SS 20241029T125928.7Z 9068.541304 151 1 48.53 2 75.40 121.75 48.40 141.32 0.00 1 0.00 1 0 17 1.049e-01 5.689e-03 1.193e-02 8.488e-04 4.870415e-01 4.290905e-04 5.662806e-03 -6.000000e+00 5.923938e-02 224.94 -2.00 3.47 -2.00 319.54 0.00e+00 1.305205e-03 1.226133e-04 4.210431e-04 -6.000000e+00 2.645671e-03 283.44 -2.00 20.00 -2.00 318.86 0.00e+00 3.887 0.001 302.00 328.00 3 1.2733e+00 1.2136e-03 4.5582e-02 -6.0000e+00 1.4624e-01 8.6721e-03 1.4416e-03 2.4808e-02 -6.0000e+00 1.5891e-01 -3.1572e-02 1.1671e-03 1.2506e-02 -6.0000e+00 9.4935e-02 7.9132e-03 6.1547e-04 3.8246e-03 -6.0000e+00 4.0765e-02 1.8578e-03 -5.1686e-04 2.3690e-05 4.1114e-05 -6.0000e+00 2.7915e-03 8.0378e-03 -1.4386e-04 10 0 0 10 0 0 96.98 20.88 0.32 0.00804 0.00415 298 70 1 5 0 162.810 25.90 19.39 20.88 15.81 5.2 954.81 -36592 -41766 -28058 -35553 -30551 -44171 -35730 -32005 -33551 -25995 -32826 -26547 -21621 -13722 -5216 -8016 -5752 -4584 -1290 -456 -1961 -1838 -3170 -2639 -2696 -1708 -2821 -5491 -5207 -6724 812 -2154 2191 280 -3586 -2995 -3394 -853 -520 267 560 -246 -114 106 835 488 341 1456 -341 142 929 1761 1706 1608 1378 801 1511 210 428 371 796 1681 1937 2500 1198 503 162 -166 885 1014 365 659 172 181 -327 -622 -1217 -1247 -1168 -1111 -1011 -1048 -1565 -2036 -870 -786 -98 114 286 582 487 933 -104 100 349 -42 305 392 293 -205 -486 -824 -844 -91 -635 -1116 -577 -670 89 388 291 299 238 384 241 365 266 221 -51 -64 -404 63 323 195 362 389 -126 950 464 140 175 -180 -159 -70 -34 -193 -182 156 86 -85 41 -227 -379 -682 -971 -618 -839 -627 -980 -763 -750 -916 -721 -1011 -813 -743 -490 -210 -393 -308 -263 -77 -29 -130 -122 -218 -194 -216 -145 -248 -481 -436 -577 72 -228 255 36 -470 -375 -453 -130 -89 54 129 -62 -30 29 227 135 95 406 -99 42 297 619 605 615 559 340 658 93 186 158 343 774 996 1320 677 279 86 -87 492 644 261 465 123 124 -225 -386 -691 -684 -680 -747 -736 -866 -1338 -1856 -834 -807 -100 121 303 599 501 881 -93 94 328 -45 348 479 393 -281 -633 -977 -970 -104 -779 -1389 -750 -921 123 589 458 496 395 609 357 537 387 334 -78 -103 -669 102 501 294 548 566 -176 1317 704 226 292 -317 -291 -128 -65 -380 -371 322 180 -173 80 -436 -704 SS 20241029T131008.0Z 9068.548703 154 1 48.53 2 73.66 123.74 47.21 144.48 0.00 1 0.00 1 0 17 6.048e-02 5.503e-03 6.456e-03 6.646e-04 4.432840e-01 3.327097e-04 5.178330e-03 -6.000000e+00 3.416118e-02 224.94 -2.00 3.47 -2.00 319.02 0.00e+00 1.124416e-03 8.065898e-05 2.900007e-04 -6.000000e+00 1.525658e-03 283.44 -2.00 20.00 -2.00 318.31 0.00e+00 3.497 0.001 302.00 328.00 3 1.2853e+00 9.1757e-04 4.1115e-02 -6.0000e+00 8.4331e-02 3.2987e-03 1.0657e-03 2.2454e-02 -6.0000e+00 9.1638e-02 -2.3441e-02 7.9028e-04 1.1222e-02 -6.0000e+00 5.4745e-02 4.9252e-03 4.1949e-04 3.3710e-03 -6.0000e+00 2.3507e-02 2.7891e-03 -4.7068e-04 1.8555e-05 3.5326e-05 -6.0000e+00 1.6098e-03 8.0179e-03 -1.4359e-04 10 0 0 10 0 0 97.22 20.97 0.29 0.00802 0.00448 305 72 1 5 0 159.080 25.90 19.48 20.97 16.82 5.3 961.38 -25770 -19628 -16099 -19948 -16254 -27767 -19803 -20947 -15027 -15662 -18449 -15125 -14415 -5784 -2923 -1637 -1370 -1491 407 221 827 -360 -333 -826 -1135 -879 -1874 -1832 -1991 -3851 -313 -465 1720 -182 -2375 -2390 -3063 -1247 -838 -162 -547 -298 -406 65 778 527 72 161 142 108 873 1378 1147 1557 1254 1027 990 -37 484 241 1065 1551 1739 2123 957 356 29 -272 423 910 341 233 109 136 13 -467 -837 -1136 -1092 -823 -1175 -1139 -1771 -1973 -798 -629 -28 169 347 587 369 690 -108 365 357 156 233 447 291 -220 -400 -929 -771 2 -693 -1091 -685 -503 -93 380 343 253 334 315 229 360 348 210 10 -23 -349 13 217 89 426 343 62 919 456 255 169 -154 -221 -84 -54 -155 -78 182 28 -130 12 -290 -398 -752 -632 -539 -687 -491 -884 -607 -737 -571 -653 -740 -615 -676 -304 -181 -117 -108 -127 36 21 80 -35 -33 -89 -133 -109 -241 -228 -236 -466 -40 -69 281 -30 -390 -411 -515 -241 -197 -45 -161 -94 -134 22 263 180 25 56 50 39 335 579 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