File name: Pandora32s1_GreenbeltMD_20240710_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240711T052123.4Z 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_20240710_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: 20240710 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 20240710T104640.8Z 8957.449083 61 1 47.22 2 81.08 68.67 124.15 37.03 0.00 1 0.00 1 0 17 3.953e-01 2.030e-02 1.587e-01 6.903e-03 7.124864e-01 3.793185e-03 8.267033e-03 -6.000000e+00 2.309175e-01 232.70 -2.00 3.47 -2.00 321.47 0.00e+00 -1.068763e-03 1.920100e-03 5.861836e-03 -6.000000e+00 1.068864e-02 289.81 -2.00 20.00 -2.00 320.85 0.00e+00 6.101 0.004 302.00 328.00 3 2.3911e+00 1.3729e-02 7.8643e-02 -6.0000e+00 5.7923e-01 4.2453e-01 1.8260e-02 5.9533e-02 -6.0000e+00 6.2625e-01 -7.1342e-01 1.5347e-02 2.2318e-02 -6.0000e+00 3.7268e-01 3.0319e-01 7.2150e-03 6.8936e-03 -6.0000e+00 1.5877e-01 5.8440e-05 -4.8170e-04 1.9276e-04 7.0608e-05 -6.0000e+00 1.0684e-02 9.1796e-03 -3.5358e-05 12 9 9 12 1 1 52.29 22.41 1.04 0.00918 0.00556 28 7 1 5 0 1628.050 26.73 20.00 22.41 32.37 4.7 1050.23 900000 -137244 -70755 -66801 -162295 -100189 -108347 -46503 -145081 -75989 -144563 -169417 -8986 -90267 17889 -47811 -12332 78016 -11112 900000 -56473 -9728 60057 -10840 47949 -32191 900000 -26040 -10280 -44893 -13391 27260 23912 20262 756 43724 -14164 -30662 -8839 20996 37927 23008 39047 54188 32976 45058 29266 43530 43 9845 21091 16178 32504 17301 21553 5317 14324 9620 11332 23042 8360 15333 9456 10593 9072 837 8732 -2079 6880 7233 -586 5762 2442 7396 -648 1780 -3719 -1152 -3137 -3876 89 -3960 2848 -1534 1254 1356 -4030 1147 -1401 1502 1109 2925 -2569 -3929 -970 -2396 -2003 431 -3223 -1432 -2404 -2435 -3302 -3965 -1240 -3506 -818 -1419 -399 144 358 1198 120 183 -102 114 655 -302 991 639 326 861 2587 496 1100 1271 459 833 -16 849 774 -285 281 20 162 400 -86 -598 -91 11 263 -448 -1682 900000 -4029 -1125 -981 -5460 -1655 -1988 -512 -4792 -1348 -5217 -8290 -115 -2926 265 -1462 -324 892 -329 900000 -2487 -288 889 -350 936 -1473 900000 -1069 -339 -2114 -523 844 885 845 37 1324 -800 -2372 -672 1427 2475 1873 2811 3390 2529 3062 2343 3075 5 1066 2242 2024 3805 2328 2966 901 2295 1618 1809 3457 1319 2420 1787 2242 2103 209 1965 -531 1755 2123 -209 2037 893 2447 -213 510 -1030 -309 -940 -1387 36 -1945 1458 -879 746 862 -2861 802 -1010 1024 713 1728 -1533 -2420 -645 -1882 -1676 407 -3519 -1583 -2559 -2343 -2899 -3446 -1122 -3477 -834 -1557 -474 193 538 1783 184 276 -147 170 971 -472 1500 1021 525 1332 4088 777 1656 1845 648 1197 -25 1449 1473 -590 611 42 375 978 -217 -1545 -235 28 615 -985 -3850 SS 20240710T105847.2Z 8957.457491 66 1 48.48 2 78.88 70.43 122.77 40.06 0.00 1 0.00 1 0 17 3.334e-01 8.930e-03 6.598e-02 2.435e-03 6.065162e-01 1.304017e-03 6.982366e-03 -6.000000e+00 1.938946e-01 232.70 -2.00 3.47 -2.00 320.75 0.00e+00 2.359082e-03 5.480783e-04 2.021842e-03 -6.000000e+00 8.642886e-03 289.81 -2.00 20.00 -2.00 320.05 0.00e+00 4.999 0.002 302.00 328.00 3 1.8892e+00 4.2080e-03 5.9621e-02 -6.0000e+00 4.8652e-01 6.0438e-02 5.4465e-03 3.4022e-02 -6.0000e+00 5.2501e-01 -1.5456e-01 4.9386e-03 1.7081e-02 -6.0000e+00 3.1289e-01 6.0208e-02 2.4362e-03 4.8697e-03 -6.0000e+00 1.3305e-01 3.0876e-04 -5.2755e-04 6.7708e-05 6.7295e-05 -6.0000e+00 8.8904e-03 9.0380e-03 -3.3605e-05 11 8 0 10 0 0 96.18 22.46 0.59 0.00904 0.00507 97 23 1 5 0 499.750 26.73 20.00 22.46 33.05 4.7 1053.87 -80217 -124128 -84584 -108941 -143810 -110178 -81719 -75976 -91635 -103592 -115343 -115487 -66360 -54183 -45219 -39534 -31020 -27378 -30810 3623 -14963 -15339 -16204 -27566 -26005 -10002 -380 -10552 -19310 -27709 -25923 -10534 16635 -651 -8313 -4499 -14546 -6476 -6106 1669 10437 5044 -4264 7192 2340 3830 4039 7304 -1128 -2294 2115 6535 8127 6332 5029 1949 3609 840 1719 2474 3623 3849 3477 4748 2603 1008 1900 -197 1682 2462 907 1230 562 1170 80 -1764 -3362 -2885 -2225 -949 -1770 -1612 -1348 -1984 -726 -412 -476 834 325 1173 484 1045 -592 -848 -127 -269 -213 481 -242 -588 -791 -1034 -1332 -467 -1363 -1566 -782 -334 192 370 539 420 504 427 82 325 42 -258 -87 66 263 437 860 223 217 324 -354 806 147 0 206 -162 -96 98 94 -186 27 92 214 -313 -154 56 -585 -629 -1828 -924 -1527 -2630 -1361 -796 -794 -1284 -1796 -2356 -2551 -1088 -1004 -967 -967 -796 -748 -951 84 -437 -452 -493 -1015 -1031 -361 -13 -386 -748 -1204 -1268 -530 747 -38 -521 -262 -995 -480 -505 155 1019 565 -554 862 299 491 528 946 -165 -358 347 1150 1555 1343 1154 483 913 221 438 612 901 1035 1062 1617 974 379 683 -73 662 1018 428 615 285 566 36 -731 -1414 -1185 -984 -446 -988 -1031 -954 -1509 -537 -326 -400 719 284 991 388 838 -456 -654 -98 -240 -220 525 -295 -737 -946 -1121 -1421 -488 -1539 -1761 -919 -416 257 516 832 694 841 691 125 473 60 -391 -141 112 450 726 1369 346 325 465 -526 1200 228 1 373 -313 -194 198 203 -427 63 210 488 -742 -344 117 -1190 SS 20240710T110434.9Z 8957.461515 69 1 48.86 2 77.82 71.27 122.08 41.47 0.00 1 0.00 1 0 17 2.339e-01 6.664e-03 1.066e-01 3.245e-03 5.676346e-01 1.727721e-03 6.453455e-03 -6.000000e+00 1.360908e-01 232.70 -2.00 3.47 -2.00 320.62 0.00e+00 2.096654e-03 6.968661e-04 1.225590e-03 -6.000000e+00 6.065880e-03 289.81 -2.00 20.00 -2.00 319.90 0.00e+00 4.596 0.002 302.00 328.00 3 2.7984e+00 5.4908e-03 5.4727e-02 -6.0000e+00 3.4148e-01 1.2171e-02 7.0512e-03 3.0625e-02 -6.0000e+00 3.6848e-01 -6.2008e-02 6.3952e-03 1.5626e-02 -6.0000e+00 2.1961e-01 1.8865e-02 3.1791e-03 4.7947e-03 -6.0000e+00 9.3390e-02 1.8811e-04 -3.5199e-04 9.1659e-05 5.7075e-05 -6.0000e+00 6.2390e-03 8.7800e-03 -1.1646e-05 11 8 0 10 0 0 99.63 22.49 0.46 0.00878 0.00613 64 15 1 5 0 763.390 26.73 20.00 22.49 33.17 4.7 1053.59 -67824 -81805 -100694 -63070 -90972 -108967 -17097 -60411 -10902 -12074 -86460 -82141 -55582 -31737 -28236 -6655 19691 -9495 23584 11330 -29124 -27540 -6577 -9467 -18236 -5279 13668 -13472 -10725 -32461 -1729 -12165 5052 -6626 -4383 -4980 -11272 -4258 -9341 3248 1057 2461 -2972 4488 2113 2751 1451 3712 1568 -1496 783 4572 3888 3810 2158 -295 510 393 194 1466 2830 2591 2276 3876 956 21 965 1167 -235 864 939 78 127 1511 -495 114 -2409 -895 -1187 -416 -1003 -877 -1491 -2142 -133 -168 -664 690 515 1366 259 1498 -870 270 -351 -162 253 673 8 -584 -277 -1079 -1178 -257 -1220 -741 -739 -548 -333 797 409 164 557 8 59 122 -167 114 150 291 -248 192 266 339 517 115 187 73 -8 283 111 -526 -128 223 -171 216 39 -47 36 82 110 -70 -616 -546 -918 -1381 -653 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