File name: Pandora32s1_GreenbeltMD_20240506_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240516T070122.3Z 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_20240506_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: 20240506 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 20240506T134507.9Z 8892.573008 183 1 8.65 2 48.49 102.75 38.83 130.36 0.00 1 0.00 1 0 17 1.064e-02 6.744e-03 7.609e-03 4.256e-03 2.111493e-01 2.186759e-03 2.518914e-03 -6.000000e+00 6.144635e-03 230.51 -2.00 3.47 -2.00 315.72 0.00e+00 7.308357e-04 2.158071e-04 4.505716e-05 -6.000000e+00 2.687032e-04 283.53 -2.00 20.00 -2.00 315.05 0.00e+00 1.506 0.000 302.00 328.00 3 5.0810e+00 5.6765e-03 1.8519e-02 -6.0000e+00 1.5368e-02 3.2826e-02 6.3081e-03 1.0834e-02 -6.0000e+00 1.6625e-02 -1.1479e-03 3.6219e-03 5.2710e-03 -6.0000e+00 9.8886e-03 -2.9169e-03 1.6511e-03 1.5166e-03 -6.0000e+00 4.2025e-03 5.7262e-04 -3.2300e-04 1.1917e-04 1.7707e-05 -6.0000e+00 2.8351e-04 1.4615e-03 -4.7490e-05 12 9 1 12 1 1 999.00 22.17 0.30 0.00146 -0.00097 2 4 1 5 0 2880.660 26.62 20.01 22.17 28.03 4.4 1029.96 1160 188 -683 -1731 -111 -4682 -1544 1045 2187 -154 -3808 193 -1411 -1573 184 -252 385 117 726 420 2075 -677 4481 1671 -635 1732 -409 -1335 1047 944 1692 -367 300 -1305 -3393 -980 -581 -1394 -619 -612 -653 151 -780 -667 143 453 -37 -929 -747 -534 -451 -342 2060 982 339 633 1085 93 81 45 889 749 1207 1452 523 -170 -837 -105 182 1556 271 -439 702 674 94 -1119 -685 -1238 -1091 -605 -855 -527 -959 -1420 -818 -274 589 56 357 124 -349 1280 -49 -82 -232 178 -7 700 763 -891 -221 -255 -843 -99 -1351 -805 -302 -951 310 667 -165 664 560 -100 296 65 -45 66 451 -73 -227 321 220 258 859 863 256 -73 468 -252 -108 -251 -166 -103 536 -408 -217 54 380 -163 244 -238 -881 260 47 -177 -438 -25 -1021 -332 239 548 -42 -1058 51 -402 -498 64 -95 150 47 296 175 876 -291 1849 725 -291 808 -195 -620 451 392 708 -164 141 -644 -1650 -447 -273 -727 -365 -404 -464 111 -587 -507 108 341 -28 -685 -539 -381 -328 -260 1599 792 280 529 916 79 68 37 748 655 1107 1389 509 -160 -743 -89 158 1432 269 -453 726 688 93 -1053 -599 -1032 -908 -535 -816 -534 -1019 -1556 -926 -323 716 70 448 154 -418 1443 -53 -84 -242 195 -8 861 981 -1163 -279 -306 -976 -115 -1653 -1024 -393 -1273 422 936 -240 973 809 -139 392 83 -56 85 595 -101 -321 455 308 352 1138 1111 320 -90 592 -333 -147 -348 -232 -146 782 -617 -333 84 596 -254 373 -358 -1309 SS 20240506T141348.7Z 8892.592924 202 1 47.31 2 43.12 108.73 34.86 139.79 0.00 1 0.00 1 0 17 1.073e-02 7.293e-03 3.735e-03 2.107e-03 1.972287e-01 1.082174e-03 2.340718e-03 -6.000000e+00 6.200746e-03 230.51 -2.00 3.47 -2.00 315.69 0.00e+00 3.710839e-04 1.062264e-04 6.903731e-05 -6.000000e+00 2.709802e-04 283.53 -2.00 20.00 -2.00 315.03 0.00e+00 1.368 0.000 302.00 328.00 3 5.8080e+00 2.8092e-03 1.6978e-02 -6.0000e+00 1.5509e-02 4.6525e-02 3.1218e-03 1.0056e-02 -6.0000e+00 1.6773e-02 -2.4728e-03 1.7922e-03 4.8998e-03 -6.0000e+00 9.9777e-03 -1.9434e-03 8.1505e-04 1.3653e-03 -6.0000e+00 4.2426e-03 3.2368e-04 1.5382e-04 5.9038e-05 1.6358e-05 -6.0000e+00 2.8589e-04 4.6550e-04 7.1340e-05 11 8 0 10 0 0 99.99 22.32 0.37 0.00047 0.00162 15 4 1 5 0 3153.900 26.73 20.00 22.32 29.82 4.5 1040.20 557 -152 -956 -1847 -1812 -3191 -141 -2417 -73 260 -2582 -1970 -941 -230 1136 1381 230 326 1312 2079 831 -555 1608 310 193 866 566 -47 -618 -1125 1270 115 4676 -879 -2594 -1712 -4358 -1500 -1099 231 -438 -223 349 235 262 -145 -394 -140 -816 -173 -117 865 390 1122 979 671 443 -227 88 -110 392 1152 1482 1422 273 -207 -710 -294 -433 561 380 685 608 28 254 -560 -1436 -1651 -1711 -1417 -1709 -1408 -952 -1684 47 -375 513 490 624 1244 120 851 -621 -709 203 -437 336 812 812 -333 147 -828 -985 -451 -949 -941 -583 -577 222 604 918 435 547 349 -171 126 -632 -413 -54 356 17 426 911 470 345 -278 4 302 -122 287 -200 -460 -634 36 -35 6 402 -209 634 165 74 -241 -1037 128 -39 -254 -478 -425 -695 -30 -574 -19 71 -722 -539 -269 -72 393 516 90 130 533 861 356 -239 680 137 89 410 270 -22 -269 -471 526 51 2101 -428 -1238 -772 -2069 -773 -648 153 -314 -166 264 180 201 -111 -298 -103 -590 -123 -85 649 306 906 809 563 377 -195 74 -92 331 1009 1366 1372 268 -195 -629 -248 -372 518 378 706 634 29 252 -525 -1252 -1360 -1404 -1241 -1624 -1427 -1010 -1850 53 -444 630 618 791 1552 144 964 -663 -724 209 -477 390 998 1047 -435 185 -996 -1136 -523 -1158 -1201 -763 -775 304 854 1336 644 796 487 -227 159 -786 -523 -71 490 24 604 1269 642 457 -359 4 368 -153 376 -270 -634 -880 51 -50 9 616 -325 991 257 113 -362 -1536 SS 20240506T203357.3Z 8892.856913 459 1 49.60 2 50.56 259.46 67.68 267.31 0.00 1 0.00 1 0 17 1.104e-02 6.475e-03 4.669e-03 2.153e-03 2.240215e-01 1.101364e-03 2.665958e-03 -6.000000e+00 6.377991e-03 230.53 -2.00 3.47 -2.00 316.33 0.00e+00 5.693797e-04 1.245110e-04 7.283920e-05 -6.000000e+00 2.786644e-04 283.56 -2.00 20.00 -2.00 315.63 0.00e+00 1.571 0.000 302.00 328.00 3 5.6272e+00 2.8803e-03 1.9452e-02 -6.0000e+00 1.5953e-02 3.1001e-02 3.2108e-03 1.1502e-02 -6.0000e+00 1.7252e-02 3.6633e-03 1.8616e-03 5.6057e-03 -6.0000e+00 1.0263e-02 -4.1369e-03 8.7256e-04 1.5896e-03 -6.0000e+00 4.3643e-03 3.0338e-04 2.8164e-04 6.0714e-05 1.8060e-05 -6.0000e+00 2.9397e-04 3.0674e-04 1.1271e-04 11 9 0 11 8 0 99.93 22.67 0.49 0.00031 0.00242 18 4 1 5 0 2755.110 27.05 20.00 22.67 32.11 4.4 1051.47 917 -1941 -386 -1302 -4002 -4716 1078 -286 -950 -745 -3433 -2177 -1118 1508 463 248 -1253 839 1346 2732 1074 -632 2302 240 548 659 1787 -620 -341 -625 510 760 2360 21 -1838 -1850 -3302 -1795 -1558 426 -548 -936 -44 -297 -46 -71 167 -74 -463 -911 9 785 547 1562 356 754 520 -25 463 273 740 1451 1540 1361 512 -677 -703 -2 -278 987 162 99 324 670 365 -933 -994 -1382 -1424 -1028 -1397 -1337 -1349 -1743 -151 -167 183 392 508 507 152 713 -335 -322 -259 -437 507 980 746 -113 73 -1036 -1171 -383 -916 -756 -791 -204 115 654 542 724 633 496 355 -449 -232 -546 31 40 -62 86 524 293 350 19 78 464 220 236 -256 -286 -162 -42 179 75 76 -122 314 -153 60 -339 -576 154 -373 -76 -252 -718 -782 172 -50 -188 -158 -744 -461 -250 370 128 76 -406 274 451 931 381 -227 806 88 211 263 714 -244 -126 -222 182 287 942 9 -766 -733 -1369 -821 -821 252 -356 -635 -30 -208 -32 -50 115 -50 -308 -601 6 549 401 1180 278 597 418 -20 369 216 591 1202 1352 1256 482 -618 -599 -2 -231 882 157 99 330 671 352 -852 -838 -1103 -1138 -879 -1303 -1339 -1422 -1902 -170 -196 224 492 643 633 183 804 -356 -327 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