File name: Pandora32s1_GreenbeltMD_20240612_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240613T051528.4Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240612_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: 20240612 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 20240612T102732.9Z 8929.435797 57 1 47.78 2 82.86 65.84 127.80 6.93 0.00 1 0.00 1 0 33 3.748e-01 2.905e-02 2.018e-01 1.323e-02 9.634299e-01 7.497069e-03 1.062816e-02 -6.000000e+00 2.178091e-01 232.71 -2.00 3.47 -2.00 322.08 0.00e+00 -4.198553e-04 3.541537e-03 2.622695e-03 -6.000000e+00 9.604671e-03 287.20 -2.00 20.00 -2.00 321.56 0.00e+00 7.397 0.007 302.00 328.00 3 1.6002e+00 2.7553e-02 9.0331e-02 -6.0000e+00 5.4704e-01 1.4680e+00 3.3662e-02 5.3382e-02 -6.0000e+00 5.9073e-01 -1.9826e+00 2.1268e-02 2.5487e-02 -6.0000e+00 3.5149e-01 7.9516e-01 1.0815e-02 7.2102e-03 -6.0000e+00 1.4896e-01 2.4267e-05 -1.4192e-03 3.3052e-04 1.0725e-04 -6.0000e+00 9.9960e-03 1.1277e-02 -1.2944e-04 12 9 8 11 8 0 71.23 21.50 1.54 0.01128 0.00061 26 6 1 5 0 1837.560 26.00 20.01 21.50 19.78 4.7 982.60 -15262 7952 -1176 20661 -9073 -71965 142633 -58481 -33367 -48218 -69596 -66423 3632 5059 9577 48552 -4868 57397 112622 56370 34867 11950 131182 -39040 -4985 11718 -3415 -26707 -51697 2858 35659 -35610 55473 12522 -14916 -7422 138 40012 -34902 86576 30212 106860 59520 97232 128025 14656 42292 91445 44446 9380 22525 55605 60332 76295 35667 45956 40700 11028 35954 7065 67788 -7684 33109 31960 3828 27467 5979 46362 5576 23229 12801 11981 25655 3061 -2829 -8877 -8234 12903 -20242 -630 -7940 13800 -3027 3918 10460 -2799 1184 1013 3888 5973 -1160 17873 -4923 2137 -5074 -2272 -5063 -1424 -3009 -5613 -305 -6718 -4930 -6200 -7815 -2712 -3349 -1979 -1897 -347 -235 -2719 430 -1451 2427 1580 -1374 -1291 -255 1154 540 3154 5208 2190 1179 1164 1651 1076 -384 2155 1217 -1012 -611 237 936 389 1410 -1542 804 -439 -1037 -943 -1517 -1074 476 -74 921 -436 -5401 1840 -3635 -1643 -2714 -4652 -4362 136 225 483 1879 -343 2221 2509 2115 1513 589 2031 -3067 -286 563 -180 -1597 -3577 125 1288 -2839 2218 808 -1174 -488 8 1806 -3917 3350 2260 3859 3455 3763 3468 1191 2564 3421 2752 871 2005 3945 4436 5117 3772 4505 4252 1508 3571 866 4372 -1110 3587 3999 691 3933 1049 5621 1115 4465 3022 2967 5427 750 -653 -1901 -1604 2064 -5091 -158 -2571 4201 -1226 1587 4196 -1231 524 461 1881 2727 -533 6386 -2159 918 -2690 -1274 -3479 -1109 -2693 -5364 -264 -5538 -3532 -4326 -5865 -2067 -2718 -1712 -1837 -385 -302 -3993 642 -2217 3469 2210 -1986 -1953 -405 1876 869 4689 7200 3033 1605 1539 2110 1443 -605 3917 2336 -2184 -1414 588 2484 1101 4039 -4591 2323 -1231 -2701 -2241 -3409 SS 20240612T104942.0Z 8929.451180 65 1 48.54 2 78.89 69.06 127.15 13.40 0.00 1 0.00 1 0 17 5.447e-01 1.480e-02 3.023e-01 7.471e-03 7.219132e-01 4.107548e-03 8.401921e-03 -6.000000e+00 3.190907e-01 232.71 -2.00 3.47 -2.00 321.28 0.00e+00 4.999015e-03 2.019372e-03 3.983373e-03 -6.000000e+00 1.411832e-02 287.20 -2.00 20.00 -2.00 320.68 0.00e+00 5.002 0.002 302.00 328.00 3 3.4886e+00 1.4335e-02 6.5053e-02 -6.0000e+00 8.0199e-01 2.7099e-01 1.9430e-02 4.3978e-02 -6.0000e+00 8.6718e-01 -3.5620e-01 1.8580e-02 2.3046e-02 -6.0000e+00 5.1400e-01 1.4280e-01 8.8380e-03 7.0289e-03 -6.0000e+00 2.1657e-01 4.9989e-05 -8.1663e-04 2.0298e-04 1.1935e-04 -6.0000e+00 1.4621e-02 1.2731e-02 -8.3375e-05 12 9 8 11 8 0 99.98 21.56 0.80 0.01273 0.00659 26 6 1 5 0 1866.590 26.11 20.00 21.56 21.22 4.7 990.94 -53888 -195365 -154273 -214377 28298 -218564 900000 -153360 -42874 -47636 -145487 -155412 -37202 -9796 29156 3254 -78684 -52909 68583 900000 11208 23375 348439 -38328 -40246 34526 61363 5644 16255 -49649 24777 -52049 29109 50548 -25156 -2986 -33859 -16928 -18208 33780 -4326 22880 3901 30908 20188 9010 26095 39529 -1016 17495 2680 16949 19935 10759 9265 4013 2429 344 8033 5846 9772 -1825 2870 6902 4141 11291 1535 2437 -1088 5724 2953 -356 -657 1999 -1397 -2762 -3111 1016 -4139 -1883 1500 167 -2240 -2647 1278 -1808 2046 278 -718 362 -1368 2644 -2286 -4031 -1350 -1648 163 1407 826 -518 -1214 -2367 -2359 -1140 -1892 -1388 116 -265 -253 -288 134 70 306 408 542 -470 68 214 845 115 507 207 1219 641 1125 309 1095 808 -814 257 193 -926 374 351 57 -325 -147 -560 970 -415 140 -372 -613 -392 -3877 -2266 -5621 206 -5151 900000 -2211 -312 -347 -2441 -3147 -297 -78 212 36 -2214 -1290 566 900000 176 323 2538 -1041 -1194 527 738 114 291 -1767 511 -2710 828 1287 -1294 -120 -1919 -949 -1248 1700 -353 1565 336 2128 1564 792 2006 2772 -109 1688 328 2035 2556 1632 1523 721 456 66 1400 1012 1656 -374 637 1674 1113 2841 414 668 -335 1891 1113 -145 -270 763 -508 -919 -961 301 -1416 -743 673 87 -1309 -1649 814 -1256 1445 206 -538 262 -951 1673 -1445 -2638 -949 -1334 149 1443 937 -609 -1376 -2466 -2243 -1057 -1867 -1445 125 -303 -312 -393 201 112 498 649 827 -697 100 326 1344 191 839 333 1880 964 1641 440 1499 1133 -1274 446 364 -1868 780 769 131 -788 -363 -1400 2404 -1014 326 -820 -1306 SS 20240612T105506.3Z 8929.454934 68 1 48.62 2 77.90 69.84 126.92 14.96 0.00 1 0.00 1 0 17 4.438e-01 8.560e-03 5.148e-02 1.778e-03 6.807244e-01 9.548490e-04 7.749477e-03 -6.000000e+00 2.579570e-01 232.71 -2.00 3.47 -2.00 320.84 0.00e+00 4.113816e-03 4.170068e-04 1.995999e-03 -6.000000e+00 1.137449e-02 287.20 -2.00 20.00 -2.00 320.20 0.00e+00 4.627 0.002 302.00 328.00 3 1.5210e+00 3.0965e-03 5.8857e-02 -6.0000e+00 6.4787e-01 9.8416e-02 4.1020e-03 3.7167e-02 -6.0000e+00 6.9958e-01 -1.4856e-01 3.9100e-03 2.0006e-02 -6.0000e+00 4.1626e-01 5.5895e-02 1.9034e-03 6.9424e-03 -6.0000e+00 1.7643e-01 5.5321e-04 -6.3683e-04 4.7598e-05 8.5735e-05 -6.0000e+00 1.1836e-02 1.0766e-02 -1.1286e-04 11 8 0 10 0 0 98.39 21.57 0.38 0.01077 0.00598 184 43 1 5 0 264.210 26.11 20.00 21.57 21.50 4.6 991.92 -187371 -138687 -150739 -140096 -120386 -175304 -124005 -156642 -128702 -115411 -126430 -110533 -97528 -55608 -47685 -41664 -33096 -31708 -17028 -28622 -16498 -38276 -24911 -32507 -35046 -18928 -22015 -19639 -25029 -24675 -8054 -12436 -1472 -3839 -5049 -9328 -9749 2162 -6742 6442 2363 4757 -3231 5408 4997 1680 4536 5014 3433 1164 3211 7538 6444 7233 4368 4138 3517 1877 2682 1542 3109 3211 3345 4177 2747 2803 1010 1859 1623 1539 1447 762 987 343 -640 -1045 -1452 -1259 -2411 -1455 -1298 -1094 -2088 -1641 -570 -786 71 51 626 685 434 721 -828 -589 -400 -147 46 178 -128 -693 -456 -842 -1020 -287 -1232 -1297 -1054 -478 67 359 381 344 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