File name: Pandora32s1_GreenbeltMD_20230718_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230720T115024.2Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230718_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: 20230718 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 20230718T110329.5Z 8599.460758 72 1 48.23 2 78.84 71.90 84.31 63.97 0.00 1 0.00 1 0 17 5.101e-01 1.734e-02 2.607e-01 6.049e-03 6.137356e-01 3.290685e-03 7.375947e-03 -6.000000e+00 3.013241e-01 232.59 -2.00 3.47 -2.00 320.91 0.00e+00 5.585620e-03 1.466011e-03 3.742892e-03 -6.000000e+00 1.382270e-02 290.29 -2.00 20.00 -2.00 320.23 0.00e+00 4.982 0.002 302.00 328.00 3 3.4635e+00 1.0977e-02 6.1000e-02 -6.0000e+00 7.5631e-01 1.4700e-01 1.4350e-02 3.7718e-02 -6.0000e+00 8.1855e-01 -2.2214e-01 1.3172e-02 1.9317e-02 -6.0000e+00 4.8430e-01 9.3856e-02 6.4494e-03 5.7229e-03 -6.0000e+00 2.0318e-01 6.1125e-05 -4.5174e-04 1.7083e-04 9.8918e-05 -6.0000e+00 1.4068e-02 2.8685e-02 1.5084e-04 12 8 8 10 0 0 18.96 26.80 1.54 0.02868 0.02529 17 4 1 5 0 2836.520 31.19 25.00 26.80 29.00 3.1 1020.51 -87728 -174563 -46320 -95644 -139285 -187168 900000 900000 -133230 288663 -73330 -82976 49405 16434 900000 76810 56125 118747 77076 900000 -63547 -63915 139436 -24497 149047 -36642 900000 48748 49305 -38967 107910 -43065 11725 -37133 -39890 25800 -36383 10235 -17833 62342 -745 6944 -11096 41071 19447 55810 29036 49066 24004 9901 -4483 22884 16131 11491 11760 -947 -947 -3170 4871 8330 7363 8180 3360 -33 4604 -2735 4209 4728 -1195 5435 -2564 -3106 -2279 2680 -130 -3383 -602 248 -1237 -1141 -1139 1007 -1603 -2412 4561 559 -839 -851 -1572 2458 1003 -2769 840 -1306 -3511 -292 -1263 1915 293 -1201 -1442 -1629 -989 -3014 -720 -456 514 -1057 -498 -28 -174 1961 -354 29 1375 49 716 -661 1188 335 46 -633 1851 1360 -1039 337 -78 1224 -272 573 1120 -618 -586 -68 -437 -200 -495 321 207 502 -141 487 -1389 -780 -4383 -360 -1204 -2469 -4991 900000 900000 -2714 1701 -920 -1247 291 148 900000 582 594 747 799 900000 -2855 -2865 862 -811 958 -1538 900000 887 878 -1725 1321 -2761 515 -2847 -3065 1017 -2785 584 -1617 3115 -77 721 -1440 3351 1989 4118 2838 4066 2626 1306 -743 3266 2682 2159 2332 -219 -226 -773 1080 1758 1610 1931 934 -11 1508 -946 1325 1500 -435 2117 -1190 -1520 -1108 1195 -55 -1343 -216 88 -483 -519 -600 587 -1046 -1674 3156 426 -679 -711 -1327 1960 766 -2055 576 -922 -2755 -252 -1247 2064 347 -1462 -1681 -1747 -978 -3030 -753 -503 587 -1289 -648 -40 -266 3107 -576 45 2052 71 1033 -1001 1862 550 76 -1026 2860 2056 -1554 483 -109 1726 -422 971 2029 -1188 -1167 -141 -954 -453 -1146 748 485 1146 -310 1021 -2878 SS 20230718T110944.1Z 8599.465094 75 1 48.76 2 77.68 72.81 83.26 64.86 0.00 1 0.00 1 0 17 3.258e-01 1.136e-02 8.152e-02 3.562e-03 5.734522e-01 1.886600e-03 6.614442e-03 -6.000000e+00 1.902805e-01 232.59 -2.00 3.47 -2.00 320.49 0.00e+00 4.595142e-03 7.341874e-04 1.470538e-03 -6.000000e+00 8.493921e-03 290.29 -2.00 20.00 -2.00 319.75 0.00e+00 4.550 0.002 302.00 328.00 3 3.0689e+00 5.9243e-03 5.4476e-02 -6.0000e+00 4.7713e-01 9.3448e-02 7.4623e-03 3.0600e-02 -6.0000e+00 5.1543e-01 -1.3071e-01 6.4897e-03 1.6301e-02 -6.0000e+00 3.0641e-01 4.9819e-02 3.2586e-03 6.0919e-03 -6.0000e+00 1.2953e-01 1.4305e-04 -5.5697e-04 9.9218e-05 7.1397e-05 -6.0000e+00 8.7545e-03 2.9956e-02 1.2092e-04 12 9 8 11 4 0 41.92 26.82 0.76 0.02996 0.02577 31 7 1 5 0 1572.870 31.19 25.01 26.82 29.44 3.1 1023.05 -125311 -127319 -25903 -136447 -107249 -166679 900000 -71026 -69822 -53964 -105128 -90796 -39349 -47514 47495 -31118 31729 -7718 7191 68031 -23414 -7817 -9536 -24654 -1860 -5598 43329 -5814 15399 -34564 26527 -19989 -5655 -12200 -13533 6783 -15514 4380 -16295 16518 -2579 2838 5726 5446 4685 11608 3733 13524 3315 3316 -1703 11303 5620 11280 4948 1382 2751 -777 2693 188 4503 1972 1028 3200 -741 2599 1573 37 2727 1904 -452 -2196 -1704 944 1579 -2807 -293 149 -1934 -86 -1709 -646 -2082 -1275 749 -543 -331 -235 117 1936 282 104 -1390 -1010 -14 -779 -102 484 -572 -477 -558 -805 -791 -1266 -959 -841 -1084 -514 -124 717 318 472 -125 317 966 411 -316 -188 258 167 -255 463 787 585 75 -143 480 841 35 903 388 2 -553 366 -1 240 -86 -736 -112 -66 255 -255 -526 -2211 -2735 -227 -3479 -1903 -4965 900000 -989 -1084 -776 -2562 -2088 -671 -1116 556 -932 587 -229 201 1121 -963 -277 -351 -1119 -73 -240 1189 -250 530 -1997 983 -1363 -389 -968 -1062 426 -1286 352 -1923 1701 -357 402 831 818 722 1713 605 2045 569 598 -350 2285 1304 2675 1314 393 795 -233 767 54 1275 618 364 1232 -312 1044 615 15 1149 915 -244 -1261 -976 508 790 -1333 -126 63 -901 -45 -1049 -439 -1553 -993 606 -470 -300 -219 109 1740 244 85 -1093 -796 -12 -739 -108 564 -722 -609 -683 -913 -838 -1350 -1078 -994 -1334 -660 -169 1047 500 771 -205 507 1469 604 -467 -288 410 276 -425 754 1245 905 114 -210 682 1210 54 1521 698 3 -1073 733 -2 523 -192 -1662 -254 -147 543 -524 -1060 SS 20230718T111511.0Z 8599.468877 78 1 48.61 2 76.67 73.60 82.34 65.64 0.00 1 0.00 1 0 17 5.471e-01 8.660e-03 1.003e-01 2.617e-03 5.470074e-01 1.371022e-03 6.272051e-03 -6.000000e+00 3.173372e-01 232.59 -2.00 3.47 -2.00 320.17 0.00e+00 2.043486e-03 4.806650e-04 1.043345e-03 -6.000000e+00 1.419380e-02 290.29 -2.00 20.00 -2.00 319.40 0.00e+00 4.228 0.001 302.00 328.00 3 2.8823e+00 4.1527e-03 5.1037e-02 -6.0000e+00 7.9587e-01 5.6528e-02 5.1277e-03 2.9174e-02 -6.0000e+00 8.5964e-01 -6.5969e-02 4.3522e-03 1.4513e-02 -6.0000e+00 5.1253e-01 2.0476e-02 2.2211e-03 4.2342e-03 -6.0000e+00 2.1738e-01 2.4123e-04 -7.6963e-04 7.2705e-05 4.8951e-05 -6.0000e+00 1.4598e-02 3.0271e-02 8.4428e-05 11 9 0 11 4 0 71.78 26.83 0.72 0.03027 0.02449 44 10 1 5 0 1104.750 31.30 25.00 26.83 29.90 3.1 1025.24 -74690 -108072 -58462 -87214 -66919 -121706 577988 -30372 -48734 -60606 -85789 -77546 -15709 -20476 7585 2218 -13770 -10500 -14829 28899 -27340 -11199 16374 -20604 3027 -8502 8306 -3729 -8324 -13779 -5542 -16419 -5079 -10747 -7737 -2400 -6412 -858 -3017 8005 781 2599 -3648 3704 882 7288 3632 8847 607 -310 106 3368 6274 6141 3044 976 -1547 904 -31 2115 3672 2349 2889 1270 294 272 873 2006 507 1886 -468 -495 -571 -145 -349 -2068 -159 -1623 -2042 -520 -1090 -1193 -2438 -1440 66 -77 -178 -17 198 592 1215 -276 718 -664 734 998 95 694 -474 -354 -130 -1330 -851 -1166 -1496 -757 -733 -664 110 468 -97 648 93 371 616 260 120 -69 521 -59 -333 306 743 387 245 275 -23 743 224 200 293 -235 -496 119 34 125 -130 -252 -355 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