File name: Pandora32s1_GreenbeltMD_20240729_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240730T052007.0Z 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_20240729_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: 20240729 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 20240729T111655.7Z 8976.470089 224 1 49.18 2 77.87 75.82 19.40 147.71 0.00 1 0.00 1 0 17 4.452e-01 1.685e-02 1.774e-01 6.754e-03 6.343888e-01 3.639286e-03 7.632495e-03 -6.000000e+00 2.600646e-01 232.18 -2.00 3.47 -2.00 320.96 0.00e+00 2.790587e-03 1.642633e-03 4.318876e-03 -6.000000e+00 1.164128e-02 290.56 -2.00 20.00 -2.00 320.28 0.00e+00 4.616 0.002 302.00 328.00 3 3.9892e+00 1.2201e-02 6.0343e-02 -6.0000e+00 6.5133e-01 1.5407e-01 1.5886e-02 4.3030e-02 -6.0000e+00 7.0327e-01 -3.0007e-01 1.3936e-02 1.8887e-02 -6.0000e+00 4.1835e-01 1.2932e-01 6.7921e-03 4.6871e-03 -6.0000e+00 1.7754e-01 5.0966e-05 -3.4250e-04 1.8814e-04 8.0273e-05 -6.0000e+00 1.1942e-02 1.2403e-02 -1.1486e-05 12 9 8 11 32 0 53.55 22.34 1.04 0.01240 0.00983 14 3 1 5 0 3512.180 26.73 20.00 22.34 27.92 4.9 1023.85 -148743 -126218 -171326 -91739 -108830 -123669 900000 -150811 -106953 -124101 -132829 -129769 -119570 -2530 -51854 -25006 -83830 -14359 106729 105320 7285 -60739 75027 -33566 20470 -4378 101549 27217 4891 -41401 1720 -23555 19715 -3327 7037 -7371 -30811 14114 -14594 26331 5573 21961 41262 6093 19092 4334 44601 13245 8210 15648 738 17205 8368 11626 3194 11637 -1993 2598 9450 263 8160 -2391 9854 3535 -1090 8329 733 2636 -2279 4713 1882 3173 2291 -1386 742 -3181 -3218 -2775 979 1822 -3335 1213 690 -2855 839 -1953 407 -1944 205 1053 -645 3828 -615 -1067 -812 -1039 -2556 909 141 -1949 -1061 -2239 -2009 -1986 -2837 -1403 -1571 246 -183 160 476 240 244 -1006 942 1851 1137 -519 244 454 -20 958 1322 891 991 259 541 -51 377 1124 432 -303 -93 353 636 472 -248 -1311 -888 -254 742 295 -1104 -2774 -2261 -5160 -1266 -1618 -1994 900000 -3682 -1926 -2854 -3444 -3522 -3539 -30 -1259 -562 -3764 -361 891 936 175 -2796 938 -1294 506 -146 1231 663 143 -1959 62 -1282 822 -189 355 -411 -2270 788 -1300 1902 556 2024 3327 705 1975 525 3757 1533 1036 1935 115 2557 1482 2163 684 2398 -482 604 2017 60 1750 -609 2514 1075 -369 2570 235 840 -823 1818 829 1451 1062 -637 311 -1255 -1170 -994 365 787 -1757 695 437 -1973 593 -1503 323 -1631 170 845 -497 2670 -425 -747 -616 -897 -2533 982 167 -2398 -1245 -2440 -2016 -1979 -3010 -1560 -1821 297 -237 227 731 390 400 -1629 1440 2704 1662 -795 390 755 -34 1557 2083 1372 1484 378 762 -74 588 1922 799 -592 -188 743 1409 1088 -588 -3164 -2147 -600 1666 634 -2327 SS 20240729T112224.5Z 8976.473894 227 1 48.76 2 76.84 76.63 18.86 151.12 0.00 1 0.00 1 0 17 3.467e-01 1.263e-02 9.684e-02 4.372e-03 6.016840e-01 2.320775e-03 7.226397e-03 -6.000000e+00 2.012294e-01 232.18 -2.00 3.47 -2.00 320.62 0.00e+00 7.077677e-03 9.415328e-04 2.845352e-03 -6.000000e+00 9.016163e-03 290.56 -2.00 20.00 -2.00 319.90 0.00e+00 4.279 0.001 302.00 328.00 3 3.6112e+00 7.3792e-03 5.3805e-02 -6.0000e+00 5.0414e-01 1.3642e-01 9.3526e-03 3.3385e-02 -6.0000e+00 5.4421e-01 -2.1853e-01 8.0712e-03 1.8727e-02 -6.0000e+00 3.2463e-01 8.6983e-02 4.0308e-03 7.2300e-03 -6.0000e+00 1.3825e-01 1.0262e-04 -5.4814e-04 1.2055e-04 9.9622e-05 -6.0000e+00 9.2455e-03 1.1602e-02 -3.3269e-06 12 9 8 11 8 0 -21.94 22.36 0.90 0.01160 0.00748 24 6 1 5 0 2031.290 26.73 20.00 22.36 28.08 4.9 1024.90 -39576 -131871 -158494 -99844 -138218 -140240 -94206 -95342 -100857 -75422 -123720 -97989 -31387 -43917 -4451 -19746 -35940 271 12005 37482 -8680 -30242 5545 -25578 -6910 1025 15126 -17751 3738 -26160 -13194 -10025 -12785 -2173 -10719 -5610 -19689 -11802 -6692 4773 9511 2578 9024 13976 7044 9767 14485 14393 -451 7518 2739 13279 5673 5045 9595 1651 2140 1147 -1247 3228 3290 4713 4114 8233 3154 1159 2984 2329 1403 3466 119 -492 1143 1110 -1736 -1736 -4022 -1305 -3846 -2024 -1784 -1941 -919 -2476 -294 -1728 462 168 88 678 614 1658 -927 -1307 -477 -601 -638 -467 -190 -907 -698 -1201 -1326 -1458 -836 -1308 -945 -631 -179 245 335 938 708 325 532 457 639 -214 102 4 281 602 1039 -11 181 -212 375 659 713 770 422 -440 -62 -116 653 -260 -132 -707 130 -365 -161 334 -703 -304 -3092 -4853 -1873 -3477 -3348 -1446 -1626 -2021 -1254 -3428 -2256 -455 -936 -82 -514 -1256 7 312 799 -303 -1302 168 -1112 -265 38 497 -795 132 -1305 -669 -594 -910 -153 -804 -383 -1628 -1047 -685 521 1123 321 1112 1871 936 1295 2062 2105 -72 1166 486 2367 1198 1159 2231 431 571 309 -336 817 850 1306 1299 2818 1219 451 1097 866 567 1577 63 -276 632 586 -871 -782 -1694 -526 -1723 -1046 -1083 -1239 -641 -1866 -231 -1470 408 155 81 607 517 1281 -692 -978 -387 -563 -638 -534 -240 -1181 -861 -1345 -1349 -1465 -893 -1500 -1135 -804 -246 347 524 1555 1187 530 814 664 921 -324 163 6 478 993 1639 -18 268 -303 548 974 1081 1318 743 -833 -123 -241 1441 -575 -300 -1643 300 -826 -345 711 -1451 SS 20240729T112818.9Z 8976.477996 230 1 48.73 2 75.72 77.50 18.33 154.97 0.00 1 0.00 1 0 25 2.631e-01 8.961e-03 6.599e-02 3.176e-03 5.709874e-01 1.667367e-03 6.532683e-03 -6.000000e+00 1.526717e-01 232.18 -2.00 3.47 -2.00 320.31 0.00e+00 2.546377e-03 6.191215e-04 1.152880e-03 -6.000000e+00 6.840993e-03 290.56 -2.00 20.00 -2.00 319.56 0.00e+00 3.966 0.001 302.00 328.00 3 3.4436e+00 5.1497e-03 4.9694e-02 -6.0000e+00 3.8249e-01 5.7398e-02 6.4167e-03 3.0305e-02 -6.0000e+00 4.1292e-01 -1.1995e-01 5.4739e-03 1.5350e-02 -6.0000e+00 2.4632e-01 4.7316e-02 2.7758e-03 4.7369e-03 -6.0000e+00 1.0488e-01 1.7254e-04 -5.3000e-04 8.7696e-05 5.5499e-05 -6.0000e+00 7.0165e-03 1.1824e-02 -5.3366e-05 11 8 0 10 0 0 1.73 22.38 0.72 0.01182 0.00784 34 8 1 5 0 1432.990 26.73 20.00 22.38 28.29 4.9 1026.09 -113332 -70609 -104194 -80914 -99586 -100517 -23371 -74896 -70319 -87740 -75726 -67254 -26778 -26587 -51015 -12547 -39254 -10183 5390 16044 -13462 -24646 -3834 -27209 -3600 -6796 13167 -11984 -22983 -17684 -5395 -7088 -1514 -5566 -3229 -11372 -13437 -5687 -6477 5559 -197 6274 -2006 4329 5732 1808 6992 7267 1308 1308 370 5153 3118 7551 2440 3438 1744 -71 2939 -582 2984 970 2840 3417 1518 943 1270 157 -259 772 156 193 1331 914 -73 -1704 -2463 -1595 -2841 -1231 -1089 -577 -1725 -1922 -33 -54 -320 -507 607 1011 928 1683 -494 -318 -876 -358 -357 760 -186 -518 -499 -1440 -1307 -833 -1032 -1334 -687 -283 -384 278 357 372 603 204 520 -48 458 -81 7 130 -478 652 429 617 192 44 306 635 576 324 413 -138 34 428 119 -213 -418 -115 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