File name: Pandora32s1_GreenbeltMD_20240326_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240327T051912.4Z 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_20240326_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: 20240326 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 20240326T114428.6Z 8851.489220 229 1 48.00 2 82.29 93.03 92.75 261.32 0.00 1 0.00 1 0 25 4.763e-01 2.303e-02 2.577e-01 9.410e-03 8.072657e-01 5.171458e-03 9.300342e-03 -6.000000e+00 2.717936e-01 227.27 -2.00 3.47 -2.00 321.77 0.00e+00 1.175813e-02 2.693424e-03 3.101571e-03 -6.000000e+00 1.208722e-02 279.24 -2.00 20.00 -2.00 321.30 0.00e+00 6.939 0.006 302.00 328.00 3 1.9450e+00 1.8406e-02 8.1145e-02 -6.0000e+00 6.7597e-01 7.2765e-01 2.4409e-02 4.3817e-02 -6.0000e+00 7.3478e-01 -1.0135e+00 2.2720e-02 2.5699e-02 -6.0000e+00 4.3656e-01 4.2852e-01 1.0773e-02 1.3274e-02 -6.0000e+00 1.8549e-01 3.4126e-05 -1.3451e-03 2.4914e-04 2.0375e-04 -6.0000e+00 1.2879e-02 1.0021e-02 -1.4773e-04 12 8 8 10 0 0 94.73 20.68 0.86 0.01002 -0.00009 22 5 1 5 0 2181.500 25.39 20.00 20.68 8.20 4.4 917.78 -4675 -111429 -74379 -121830 900000 -193355 246336 -142173 -148520 -39828 -128404 -132397 -39430 -74745 75196 -41627 -15744 -39359 67121 900000 -28063 -29793 20441 -22918 -1386 -48482 -30809 -35652 -1856 -72052 73649 -46623 57953 28136 4265 24865 -17409 48914 -17644 59400 40011 35484 57382 52087 110549 30358 43682 78537 32669 54931 6709 21114 22681 43884 24549 31597 36730 16540 25947 8073 18942 -834 7164 14953 2143 13967 14596 8506 8882 15503 8956 -921 6531 5990 -5423 528 -770 194 -9313 -5158 -2138 1371 -101 -1497 4462 -3642 6696 853 992 -246 -495 5670 -2271 -6034 -2747 -2796 757 -1712 404 -1308 -1951 -1604 -3212 -2858 -5504 -3748 -1639 -3341 -540 -1696 -299 -258 -424 397 7 124 -1301 -292 414 -47 2008 2726 3022 1628 945 56 1333 1476 513 2158 999 -838 -378 699 2051 -451 -431 -1652 217 110 -743 517 -1739 -43 -2892 -1429 -3565 900000 -8694 2260 -3764 -4327 -402 -3047 -3488 -523 -1867 690 -1185 -397 -1358 872 900000 -932 -954 385 -666 -33 -1829 -965 -1131 -42 -3404 1009 -2543 1349 951 175 781 -839 1395 -1122 2096 1889 1862 2544 2500 3042 1844 2399 3205 2181 3149 667 2047 2366 4018 2840 3500 3923 2105 2907 1035 2223 -128 1163 2578 456 2676 2743 1736 1961 3670 2497 -294 1936 1680 -1543 127 -174 44 -2576 -1645 -786 562 -47 -745 2223 -2065 3630 504 588 -144 -274 2804 -1167 -3308 -1637 -1945 596 -1586 409 -1391 -2004 -1489 -2733 -2361 -4909 -3501 -1580 -3492 -603 -2155 -420 -392 -664 612 10 179 -1905 -441 655 -78 3242 4217 4483 2384 1357 78 1807 2056 805 3791 1954 -1778 -839 1624 4991 -1168 -1139 -4449 576 286 -1835 1190 -3905 SS 20240326T120225.3Z 8851.501682 234 1 48.22 2 78.81 95.89 96.15 263.99 0.00 1 0.00 1 0 17 3.337e-01 7.678e-03 7.542e-02 2.680e-03 6.334421e-01 1.405584e-03 7.171868e-03 -6.000000e+00 1.900377e-01 227.27 -2.00 3.47 -2.00 320.66 0.00e+00 3.773937e-03 5.628809e-04 9.361262e-04 -6.000000e+00 8.270207e-03 279.24 -2.00 20.00 -2.00 320.11 0.00e+00 4.975 0.002 302.00 328.00 3 2.1083e+00 4.3259e-03 5.9148e-02 -6.0000e+00 4.7233e-01 1.0568e-01 5.6042e-03 3.3285e-02 -6.0000e+00 5.1281e-01 -1.2750e-01 5.5233e-03 1.8157e-02 -6.0000e+00 3.0503e-01 4.7531e-02 2.7485e-03 7.0820e-03 -6.0000e+00 1.2980e-01 2.3710e-04 -7.0538e-04 7.2776e-05 7.5764e-05 -6.0000e+00 8.8845e-03 9.1805e-03 -1.4340e-04 11 8 0 10 0 0 92.72 20.72 0.47 0.00918 0.00388 62 15 1 5 0 777.630 25.39 19.99 20.72 8.93 4.4 922.00 -98600 -114934 -100221 -108148 -118274 -103396 -125084 -84020 -115642 -92580 -100133 -100705 -68227 -63152 -47522 -27236 -22651 -12011 -18526 -3142 -26096 -8165 -8801 -28341 -17533 -14128 -9151 -20535 -9191 -27537 -4767 -13472 17079 -1183 -10010 3158 -6656 -6837 -7729 2013 1747 2155 -4275 2713 5144 3683 1178 7691 2625 -1141 1280 3418 4025 4883 2848 3931 2561 298 362 -1482 1536 3470 3879 2952 1365 1117 2480 1462 1593 2528 1433 531 603 546 -1094 -951 -891 -1634 -3742 -1358 -1238 -1094 -2113 -1723 -841 -448 83 565 668 173 -259 1619 70 -411 83 37 190 486 274 -334 -787 -895 -669 -600 -1024 -1389 -288 -712 33 485 15 172 71 352 459 282 -139 74 473 -337 -76 507 642 -51 223 245 245 923 271 180 161 -335 -306 51 161 -198 -248 -59 315 46 76 -268 -468 -824 -1382 -1152 -1357 -1514 -1081 -1700 -856 -1843 -1282 -1570 -1737 -1052 -1205 -993 -569 -521 -276 -499 -77 -839 -220 -244 -1029 -623 -517 -328 -810 -317 -1195 -192 -653 790 -66 -602 161 -397 -479 -672 192 192 257 -575 353 664 494 166 1047 392 -188 227 666 861 1129 657 938 641 77 91 -371 380 914 1157 1009 511 416 884 533 630 1142 734 290 330 286 -536 -418 -358 -655 -1671 -699 -694 -703 -1520 -1317 -678 -385 70 489 581 147 -223 1276 53 -315 70 33 198 540 339 -425 -954 -1049 -708 -625 -1144 -1662 -335 -884 44 723 23 287 120 575 708 414 -203 113 760 -575 -129 832 1010 -78 328 370 354 1350 417 314 291 -650 -622 104 349 -455 -555 -134 715 102 167 -556 -931 SS 20240326T120813.8Z 8851.505715 237 1 49.00 2 77.69 96.83 97.26 264.85 0.00 1 0.00 1 0 17 2.630e-01 7.319e-03 8.143e-02 2.486e-03 5.892938e-01 1.288435e-03 6.717844e-03 -6.000000e+00 1.497769e-01 227.27 -2.00 3.47 -2.00 320.36 0.00e+00 3.154882e-03 4.695213e-04 8.195814e-04 -6.000000e+00 6.518233e-03 279.25 -2.00 20.00 -2.00 319.80 0.00e+00 4.555 0.002 302.00 328.00 3 2.4545e+00 3.8614e-03 5.4385e-02 -6.0000e+00 3.7227e-01 8.6651e-02 4.8451e-03 3.0773e-02 -6.0000e+00 4.0418e-01 -9.0405e-02 4.5639e-03 1.6398e-02 -6.0000e+00 2.4041e-01 3.0845e-02 2.3139e-03 5.9736e-03 -6.0000e+00 1.0230e-01 2.5966e-04 -8.1463e-04 6.8044e-05 6.4162e-05 -6.0000e+00 7.0026e-03 9.3663e-03 -1.4823e-04 11 8 0 10 0 0 87.84 20.73 0.41 0.00937 0.00324 59 14 1 5 0 830.360 25.39 19.99 20.73 9.21 4.4 923.40 -124169 -80203 -105570 -91909 -67057 -98388 47852 -95503 -46148 -67761 -82195 -81957 -50878 -13253 -28379 -5332 -19392 -13023 -2838 9830 -3543 -25463 -3625 -15365 -12754 -983 -4194 1874 -18905 -14093 -5013 -14555 13530 -10781 1019 -7001 -6695 3727 -3679 2946 677 2665 -4137 667 4994 775 7146 1582 1870 -613 -1230 5786 2243 5999 498 2077 1178 -1312 920 1118 3064 1503 2893 2454 1793 842 778 1839 1456 1299 749 -21 480 149 -889 -745 -1104 -1709 -1450 -658 -1094 -932 -1924 -2015 -150 -1381 351 -47 153 876 -129 1531 -596 115 -61 -145 267 210 307 -817 98 -986 -1058 173 -1173 -1162 -900 -392 268 386 584 61 340 353 221 483 136 230 99 -85 -410 323 364 23 364 290 117 456 474 49 115 -133 -225 -220 159 -184 -69 -139 170 -147 220 -176 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