File name: Pandora32s1_GreenbeltMD_20231228_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T215321.1Z 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_20231228_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: 20231228 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 20231228T132200.8Z 8762.556954 301 1 42.60 2 81.76 129.12 84.13 298.37 0.00 1 0.00 1 0 17 5.680e-01 2.134e-02 2.632e-01 7.632e-03 8.196455e-01 4.155837e-03 9.654794e-03 -6.000000e+00 3.222973e-01 223.44 -2.00 3.47 -2.00 321.62 0.00e+00 1.025778e-02 2.105537e-03 4.666541e-03 -6.000000e+00 1.440208e-02 277.55 -2.00 20.00 -2.00 321.17 0.00e+00 6.551 0.005 302.00 328.00 3 1.9635e+00 1.4445e-02 7.8824e-02 -6.0000e+00 7.9528e-01 6.0030e-01 1.9697e-02 4.5966e-02 -6.0000e+00 8.6700e-01 -8.0647e-01 1.9476e-02 2.8467e-02 -6.0000e+00 5.1398e-01 3.3826e-01 9.2288e-03 1.2931e-02 -6.0000e+00 2.1958e-01 4.8278e-05 -1.2738e-03 2.0072e-04 2.1572e-04 -6.0000e+00 1.5184e-02 -8.2013e-05 2.1905e-05 12 9 9 12 9 1 99.67 21.27 0.44 -0.00008 -0.00965 20 6 1 5 0 2028.450 25.90 20.00 21.27 14.83 3.7 939.86 -35650 -196096 -105937 -195318 184721 -194092 900000 -53231 -176901 31865 -203913 -153213 900000 -69774 -43937 -47152 -63547 -42152 -57412 250352 -3914 -18306 -28130 -8850 -23317 -39733 184620 3487 -4498 -86307 21157 -32832 900000 54015 6920 37647 -39887 -3833 -8865 95152 36957 14223 64610 43580 36540 51198 41829 49027 29676 17081 17592 43306 44767 35594 22346 19528 13846 14195 8794 4891 12739 11698 12759 13140 10942 12835 13487 12171 4675 11395 8555 69 9529 4928 -2185 959 -1616 -4451 -4311 -1377 -348 2851 -504 -4774 1399 -14 3464 823 -1776 1281 -1819 -2796 -232 -4312 -2641 -3040 -3029 -1973 568 -1470 -500 -1399 -4476 -656 -3428 -2655 -761 -2340 -1552 -187 -127 902 -739 -136 129 -821 -481 -194 1333 89 1881 1970 1940 731 2217 1338 897 1543 -975 1277 624 76 -314 159 911 -187 -17 -1047 501 276 -467 -720 -1438 -265 -6255 -1561 -6686 1374 -5265 900000 -396 -4317 237 -6700 -3324 900000 -1137 -730 -1003 -1835 -1098 -1871 1862 -80 -412 -676 -181 -567 -1152 1373 65 -90 -3963 417 -1346 900000 1284 253 966 -2166 -166 -475 2244 1702 874 2600 2211 2008 2495 2296 2618 2008 1388 1565 3389 3805 3569 2694 2489 1901 1926 1213 674 1639 1639 2013 2379 2233 2630 2710 2538 1130 2945 2531 23 2941 1505 -651 249 -396 -1125 -1202 -446 -133 1219 -248 -2610 763 -8 2051 516 -1147 788 -1090 -1596 -125 -2462 -1648 -2214 -2571 -1904 598 -1636 -534 -1373 -4058 -554 -3098 -2532 -748 -2481 -1776 -237 -180 1375 -1181 -215 197 -1223 -710 -295 2102 147 3056 3086 2920 1084 3167 1873 1226 2138 -1528 2223 1205 157 -686 362 2183 -472 -45 -2730 1295 699 -1129 -1642 -3154 SS 20231228T133851.2Z 8762.568648 307 1 21.05 2 79.28 132.13 86.90 300.76 0.00 1 0.00 1 0 17 4.233e-01 1.199e-02 2.316e-01 5.922e-03 6.846753e-01 3.094951e-03 7.861949e-03 -6.000000e+00 2.380981e-01 223.44 -2.00 3.47 -2.00 320.93 0.00e+00 3.682452e-03 1.338332e-03 2.327782e-03 -6.000000e+00 1.042475e-02 277.55 -2.00 20.00 -2.00 320.43 0.00e+00 5.174 0.002 302.00 328.00 3 2.4888e+00 9.7624e-03 6.2361e-02 -6.0000e+00 5.8701e-01 1.4459e-01 1.3113e-02 3.7060e-02 -6.0000e+00 6.3883e-01 -1.8148e-01 1.3493e-02 2.0957e-02 -6.0000e+00 3.8075e-01 7.3624e-02 6.6142e-03 7.4865e-03 -6.0000e+00 1.6338e-01 1.2781e-04 -7.4953e-04 1.5762e-04 9.8226e-05 -6.0000e+00 1.1256e-02 4.1937e-04 1.4946e-05 12 9 9 12 1 1 99.96 21.28 0.39 0.00042 -0.00521 17 10 1 5 0 1169.150 25.90 20.00 21.28 15.95 3.8 947.28 -98632 -173716 -87414 -189653 -110122 -175730 -88788 -35561 -145640 -62427 -180266 -51900 -99201 -60603 -24880 -94569 11067 -68080 -17155 30572 -53367 -23234 -26495 -43327 -6650 -12806 7493 -70068 -25473 -56160 29580 -29521 -1048 4726 -12008 5293 -17899 -7260 -8947 -2576 8555 -740 6863 4093 13123 14283 967 4304 2210 -1437 -3061 9319 5056 9965 11653 8802 8310 2979 3557 748 2301 2217 3919 8063 3520 2936 6026 4155 1603 3696 2104 642 1950 245 -2199 -742 -3690 -781 -4470 -2511 96 -572 -890 -2860 699 -1532 -2243 1170 583 1265 -399 -190 -1353 -1830 278 -1481 -168 813 25 -167 -759 -1264 -1963 -52 -1398 -1897 -14 -383 -277 357 159 -263 523 648 178 229 27 233 253 -257 236 387 1277 502 914 206 -292 1050 317 420 208 -416 -351 39 227 -300 -20 -127 -258 299 22 161 -954 -578 -2573 -634 -3728 -947 -2656 -607 -205 -2183 -465 -4323 -400 -1477 -815 -305 -2749 138 -1992 -343 412 -1657 -543 -650 -1338 -158 -346 172 -3297 -777 -2373 649 -1365 -44 209 -620 224 -986 -418 -632 -207 708 -73 666 423 1272 1399 110 491 270 -193 -457 1393 866 1778 2188 1777 1743 662 769 161 495 514 1008 2265 1119 945 1846 1316 558 1435 925 302 913 112 -953 -288 -1359 -277 -1773 -1139 50 -338 -581 -2017 504 -1188 -1838 963 485 1024 -312 -140 -964 -1317 213 -1308 -166 895 31 -209 -918 -1418 -2030 -51 -1471 -2119 -16 -464 -358 502 245 -430 866 1057 281 347 41 360 408 -431 396 632 2005 775 1371 301 -417 1501 494 722 387 -817 -715 82 503 -693 -47 -302 -617 700 50 345 -1993 SS 20231228T134412.9Z 8762.572372 310 1 11.65 2 78.51 133.11 87.77 301.53 0.00 1 0.00 1 0 25 3.688e-01 8.041e-03 4.813e-02 1.851e-03 6.540184e-01 9.539208e-04 7.463963e-03 -6.000000e+00 2.074449e-01 223.44 -2.00 3.47 -2.00 320.42 0.00e+00 3.855663e-03 3.593319e-04 8.672788e-04 -6.000000e+00 9.082531e-03 277.55 -2.00 20.00 -2.00 319.90 0.00e+00 4.856 0.002 302.00 328.00 3 2.6246e-01 2.8450e-03 5.8215e-02 -6.0000e+00 5.1144e-01 9.3259e-02 3.6569e-03 3.3605e-02 -6.0000e+00 5.5658e-01 -1.0065e-01 3.6097e-03 1.8533e-02 -6.0000e+00 3.3172e-01 3.5283e-02 1.8212e-03 7.3624e-03 -6.0000e+00 1.4235e-01 1.6496e-03 -7.2266e-04 4.8549e-05 7.6657e-05 -6.0000e+00 9.8070e-03 -4.7179e-04 -1.0027e-05 12 9 1 12 1 1 99.06 21.30 0.30 -0.00047 -0.00590 81 80 1 5 0 141.960 25.90 20.00 21.30 16.18 3.7 947.30 -124144 -127926 -110444 -137549 -123783 -125598 -117541 -107081 -119238 -97244 -120428 -99593 -70552 -51268 -39410 -37356 -33591 -27617 -13172 -15025 -10036 -20356 -12071 -24288 -21960 -21372 -20455 -18889 -18697 -25849 -15242 -9214 824 -4640 -3722 -8499 -9878 -1839 -2503 3841 2474 2103 1654 727 3336 3602 2195 3841 902 1636 3402 4846 4940 4490 2853 3342 1931 54 1440 922 1744 3099 3467 3492 2637 1819 1141 866 808 1081 1191 875 646 351 -479 -1475 -2112 -1800 -2086 -933 -1192 -1227 -1865 -1589 -1259 -876 -165 358 413 790 271 576 -366 -216 -310 -121 -203 175 164 -64 -304 -945 -959 -163 -772 -1291 -697 -865 -138 367 463 331 276 306 115 218 143 323 -25 -26 -204 303 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