File name: Pandora32s1_GreenbeltMD_20240827_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240828T051434.7Z 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_20240827_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: 20240827 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 20240827T111737.8Z 9005.470577 222 1 48.90 2 82.15 83.73 13.17 147.11 0.00 1 0.00 1 0 25 4.048e-01 2.608e-02 2.172e-01 9.981e-03 7.823835e-01 5.449750e-03 9.149315e-03 -6.000000e+00 2.335130e-01 230.66 -2.00 3.47 -2.00 321.79 0.00e+00 9.384067e-03 2.836138e-03 3.601447e-03 -6.000000e+00 1.049883e-02 290.03 -2.00 20.00 -2.00 321.21 0.00e+00 6.822 0.005 302.00 328.00 3 2.1088e+00 2.0204e-02 7.9668e-02 -6.0000e+00 5.8292e-01 8.3935e-01 2.5725e-02 4.2179e-02 -6.0000e+00 6.3015e-01 -1.2550e+00 1.8961e-02 2.2700e-02 -6.0000e+00 3.7625e-01 5.2938e-01 9.1578e-03 8.8552e-03 -6.0000e+00 1.6061e-01 3.3777e-05 -1.1694e-03 2.6766e-04 1.5217e-04 -6.0000e+00 1.0792e-02 1.0740e-02 -1.4870e-04 12 9 9 12 4 4 -3.00 -62.18 1.39 0.01074 0.00195 25 6 1 5 0 1955.700 26.62 20.01 -62.18 26.49 5.0 1014.75 -45839 23356 -76965 -91310 -79455 -121624 100764 -59339 -11631 -96522 -130782 -125396 37197 -184 -16014 46692 19064 -28694 55042 107316 12698 19001 113028 -17483 -7881 3329 95776 17207 -17888 -41114 -34156 -13452 82750 34642 57165 58205 -16038 21037 -10340 64499 59936 77499 59116 65685 54538 12095 70206 121020 28180 42082 24573 98451 37590 46306 41698 19780 18005 10213 17572 19990 29137 22141 14342 14353 16027 14401 10186 6232 11464 7640 9318 4572 6489 9127 -2165 3932 -5374 6347 -1468 -479 404 -2610 -429 -3498 6663 -5505 -2680 334 -2629 4254 -1586 9796 -3079 -3449 -3863 -1196 -3739 -1334 -5 -4205 -2024 -4149 -2501 -3109 -3446 -3413 -2882 -1250 -3245 -1996 -386 563 725 -255 662 908 -1437 -811 234 220 798 1564 4054 2296 2673 1192 -103 2159 137 2840 1617 198 -274 241 540 516 -336 -1172 156 99 401 -707 -2638 -1420 413 -3814 -4848 -3164 -6349 981 -1575 -196 -3758 -6943 -6546 507 -4 -538 992 590 -1523 1447 1671 494 647 1430 -817 -337 126 1398 519 -731 -2201 -1995 -773 2094 1517 1892 1756 -1030 1044 -825 2825 3034 3470 3280 3452 3185 1083 3553 3769 2304 3154 2392 5079 3878 4687 4627 2792 2611 1571 2395 2549 3403 2996 2387 2724 3245 2958 2132 1383 2622 2082 2775 1359 1872 2647 -636 964 -1329 1402 -391 -152 138 -1065 -191 -1715 3131 -3107 -1551 194 -1579 2319 -862 4447 -1529 -1767 -2239 -797 -3021 -1227 -5 -4632 -2081 -3917 -2082 -2539 -3009 -3192 -2839 -1304 -3822 -2655 -527 831 1102 -387 953 1257 -2038 -1199 364 360 1291 2413 5837 3268 4007 1755 -149 3139 212 4950 3203 431 -636 549 1317 1333 -898 -3204 420 258 974 -1742 -6290 SS 20240827T113511.6Z 9005.482773 227 1 48.80 2 78.75 86.45 11.75 163.49 0.00 1 0.00 1 0 17 3.712e-01 8.704e-03 5.215e-02 2.101e-03 6.226211e-01 1.112289e-03 7.118021e-03 -6.000000e+00 2.142064e-01 230.66 -2.00 3.47 -2.00 320.73 0.00e+00 3.004182e-03 4.732921e-04 1.757295e-03 -6.000000e+00 9.630032e-03 290.03 -2.00 20.00 -2.00 320.03 0.00e+00 4.948 0.002 302.00 328.00 3 1.6984e+00 3.6097e-03 5.9127e-02 -6.0000e+00 5.3473e-01 7.1330e-02 4.6851e-03 3.3696e-02 -6.0000e+00 5.7801e-01 -1.4667e-01 4.2377e-03 1.7448e-02 -6.0000e+00 3.4512e-01 5.7931e-02 2.0940e-03 5.4283e-03 -6.0000e+00 1.4735e-01 3.8154e-04 -6.1941e-04 5.7661e-05 6.8035e-05 -6.0000e+00 9.8966e-03 1.0029e-02 -1.2327e-04 12 9 1 12 4 4 21.33 -62.18 0.54 0.01003 0.00537 109 26 1 5 0 447.670 26.73 20.00 -62.18 27.15 5.0 1018.07 -139353 -120024 -134979 -108173 -147530 -130853 -121550 -108842 -96932 -121665 -80035 -89786 -75637 -60593 -47962 -27374 -30874 1496 -21069 534 -31237 -33363 -8931 -23739 -18934 -20193 -9185 -12279 -20386 -15324 -17644 -12089 -4214 -7548 -6483 -5892 -11022 -832 -3506 5437 -494 5905 -3246 7342 3600 5909 4124 3160 3399 -2496 4201 7180 4836 6445 3449 3583 2455 2115 2329 728 2119 3184 4567 4056 2211 1851 1294 1020 1541 2729 1143 797 348 -208 -291 -1134 -1980 -2139 -2611 -731 -1743 -331 -2101 -1454 -793 -734 34 -111 736 877 790 850 -507 -355 -284 -364 -251 164 -303 -676 -230 -973 -1100 -785 -1169 -1339 -1121 -632 -284 349 352 538 373 328 262 -39 172 113 39 341 -277 278 696 548 562 434 -158 643 446 420 361 -226 -379 168 -96 -27 -98 -47 83 -170 206 -487 -429 -1827 -1574 -2268 -1396 -2599 -1850 -1644 -1472 -1331 -2343 -1066 -1435 -1286 -1142 -1012 -572 -765 30 -574 12 -1043 -1142 -245 -817 -679 -782 -327 -443 -777 -578 -788 -617 -233 -476 -398 -348 -729 -58 -283 487 -54 657 -418 881 455 746 542 431 482 -398 689 1284 978 1397 823 894 642 559 600 186 545 881 1414 1310 782 651 443 354 579 1169 558 414 182 -105 -135 -479 -773 -825 -1102 -357 -1014 -218 -1441 -1057 -611 -605 29 -100 663 767 650 651 -372 -262 -230 -340 -252 188 -360 -827 -285 -1098 -1128 -792 -1268 -1556 -1369 -818 -371 505 531 867 608 519 393 -59 259 178 61 562 -462 447 1074 875 864 643 -226 926 714 716 677 -429 -754 351 -204 -62 -227 -111 196 -393 447 -1000 -896 SS 20240827T114117.9Z 9005.487013 230 1 48.69 2 77.57 87.39 11.48 169.91 0.00 1 0.00 1 0 17 2.549e-01 7.246e-03 3.287e-02 1.454e-03 5.749217e-01 7.593708e-04 6.555657e-03 -6.000000e+00 1.470931e-01 230.66 -2.00 3.47 -2.00 320.32 0.00e+00 2.113913e-03 2.824617e-04 1.087678e-03 -6.000000e+00 6.612648e-03 290.03 -2.00 20.00 -2.00 319.59 0.00e+00 4.512 0.002 302.00 328.00 3 1.5197e+00 2.3283e-03 5.3894e-02 -6.0000e+00 3.6719e-01 2.6685e-02 2.9251e-03 3.0382e-02 -6.0000e+00 3.9690e-01 -7.7686e-02 2.5641e-03 1.5410e-02 -6.0000e+00 2.3699e-01 2.7721e-02 1.2985e-03 4.7045e-03 -6.0000e+00 1.0119e-01 7.2460e-04 -5.1315e-04 4.0033e-05 5.2759e-05 -6.0000e+00 6.7953e-03 9.7646e-03 -1.1576e-04 12 9 1 12 4 4 24.78 -62.18 0.37 0.00976 0.00591 162 38 1 5 0 300.520 26.83 20.01 -62.18 27.27 5.0 1018.53 -108725 -69365 -80454 -60685 -98500 -102745 -74508 -79645 -60882 -73346 -68701 -79607 -58574 -33927 -34902 -20836 -22986 -22440 -18009 -11421 -10580 -15717 -4745 -17584 -9989 -5115 -7786 -5593 -12463 -8077 -8280 -4691 369 -2924 -4092 -7181 -7645 -3793 30 1557 2026 3637 -1853 3743 2203 1432 2000 2610 1478 598 2268 3635 2794 2802 2580 3018 1585 937 543 80 1621 1929 2890 3364 1878 546 452 262 206 1683 678 598 147 627 -71 -942 -1460 -2296 -1759 -1061 -1246 -799 -1731 -1847 -817 -775 214 68 801 1144 599 957 -397 -58 -197 53 -390 403 256 -304 -479 -1044 -926 -149 -901 -1410 -974 -838 -137 570 436 368 504 310 297 25 49 195 -83 242 -267 236 377 420 504 95 -254 822 487 342 269 -345 -267 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