File name: Pandora32s1_GreenbeltMD_20250210_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250211T052709.6Z 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 v1.8.70 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250210_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: 20250210 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 20250210T131017.2Z 9172.548811 271 1 48.47 2 79.03 118.52 107.11 323.24 0.00 1 0.00 1 0 17 3.493e-01 1.061e-02 1.186e-01 3.252e-03 6.230894e-01 1.681436e-03 7.012015e-03 -6.000000e+00 1.971264e-01 224.80 -2.00 3.47 -2.00 320.75 0.00e+00 3.393788e-03 6.740861e-04 9.113989e-04 -6.000000e+00 8.555433e-03 276.35 -2.00 20.00 -2.00 320.24 0.00e+00 5.067 0.002 302.00 328.00 3 2.3642e+00 5.1723e-03 5.9201e-02 -6.0000e+00 4.8766e-01 1.2634e-01 6.6925e-03 3.2422e-02 -6.0000e+00 5.3061e-01 -1.8058e-01 6.6530e-03 1.7763e-02 -6.0000e+00 3.1568e-01 7.1485e-02 3.3201e-03 6.7544e-03 -6.0000e+00 1.3472e-01 1.7518e-04 -8.0207e-04 8.9038e-05 7.4980e-05 -6.0000e+00 9.2943e-03 6.6073e-03 -1.7358e-04 12 8 8 10 0 0 99.88 19.60 0.67 0.00661 0.00058 60 14 1 5 0 807.730 24.86 19.50 19.60 5.99 5.4 899.89 -9338 -132489 -57236 -158207 -46051 -176848 -71481 -112130 -109114 21165 -150479 -98511 -79829 -85078 2480 -38858 -175 -52047 -7836 5483 -15416 -12495 -10716 -21898 -25968 -10051 -8384 -10424 -3229 -26489 11352 -11568 45230 290 -11249 -1606 -13729 5980 -5994 6992 8677 9831 318 -2364 10194 4794 6790 8660 -1022 1898 -989 9169 8284 8039 4533 5096 6095 -105 1438 433 1283 3117 124 4845 835 4061 1904 501 1229 1075 2576 875 720 1185 -2001 -1917 -2431 -2261 -3159 -1321 -1185 -1102 -1540 -3040 -1303 -619 798 545 -263 363 69 1869 108 -1145 -263 -381 144 492 538 -176 -1025 -943 -1234 -218 -1010 -1340 -524 -966 -362 253 123 257 87 261 -229 135 -4 361 359 -294 114 543 1025 358 744 641 -209 761 163 401 257 -136 71 -121 2 -280 76 -172 143 12 -109 100 -927 -38 -2269 -508 -3512 -336 -4078 -657 -1742 -1868 107 -4034 -1874 -1544 -2239 35 -998 -4 -1931 -204 132 -474 -372 -319 -785 -1054 -370 -311 -387 -109 -1168 396 -613 1592 18 -687 -94 -875 402 -506 627 876 1066 40 -316 1220 618 877 1128 -153 291 -171 1610 1619 1713 1066 1244 1523 -28 369 109 327 845 39 1659 294 1498 695 187 453 457 1209 442 366 572 -919 -789 -1005 -920 -1293 -625 -661 -706 -1098 -2165 -970 -489 659 468 -229 306 55 1466 82 -879 -203 -339 148 536 649 -219 -1226 -1094 -1299 -223 -1114 -1586 -600 -1183 -478 372 187 419 144 420 -349 209 -5 535 565 -490 190 875 1578 576 1149 953 -301 1100 263 684 484 -257 140 -253 4 -627 175 -403 334 28 -234 213 -1922 SS 20250210T131623.0Z 9172.553044 274 1 50.25 2 77.99 119.60 107.79 324.43 0.00 1 0.00 1 0 25 3.803e-01 2.649e-02 1.812e-01 1.003e-02 5.604617e-01 5.224366e-03 7.901569e-03 -6.000000e+00 2.173601e-01 224.80 -2.00 3.47 -2.00 320.62 0.00e+00 9.288116e-03 1.965829e-03 6.328425e-03 -6.000000e+00 9.462928e-03 276.35 -2.00 20.00 -2.00 320.12 0.00e+00 4.663 0.002 302.00 328.00 3 4.5150e+00 1.5901e-02 5.8307e-02 -6.0000e+00 5.3797e-01 2.5460e-01 1.9489e-02 3.7340e-02 -6.0000e+00 5.8570e-01 -3.1609e-01 1.7125e-02 2.3655e-02 -6.0000e+00 3.4649e-01 1.3911e-01 8.6481e-03 1.0619e-02 -6.0000e+00 1.4874e-01 3.0036e-05 3.9244e-03 2.8750e-04 1.9694e-04 -6.0000e+00 1.0213e-02 3.1430e-03 9.1098e-04 12 8 8 10 0 0 99.99 19.62 0.52 0.00314 0.03263 15 4 1 5 0 3349.560 24.86 20.20 19.62 6.18 5.3 901.16 900000 -106028 -55895 -149929 -60834 -175259 900000 -80516 -62505 -12479 -94340 -99606 -93465 -23116 168330 8638 -14012 -20592 28098 40746 6464 -35740 96726 31185 105908 8264 -18438 49260 15419 -47531 80738 -707 900000 33884 1414 -15225 16654 44544 -13919 55484 20300 17806 53019 9321 21127 20693 31101 19189 18375 25013 -2532 17148 7685 28929 4769 8214 8043 -6330 9915 -8582 12219 1627 2017 3350 -3652 10452 6809 9253 4415 6577 -1208 -2856 2804 -3238 -2932 -5168 951 970 -12345 -3174 -5891 296 -1241 -928 1548 -2496 7456 -3047 -2607 -2164 -2287 2801 -2685 -5706 2988 -2928 1659 -1414 3128 -1444 23 -904 -5031 -724 -2616 -571 -1189 -2280 741 -1444 753 883 672 -478 22 767 -669 80 1198 -498 2328 1147 4329 -71 1122 1051 266 704 -858 2430 78 1457 -997 -639 1181 -614 -1105 -2217 942 632 -935 482 -808 900000 -3609 -1304 -8346 -1359 -10283 900000 -2048 -1453 -190 -3110 -3600 -3791 -622 1645 260 -586 -995 930 1253 280 -2251 1760 1069 1876 373 -1077 1511 633 -3614 2115 -46 900000 2027 112 -1336 1122 2617 -1661 4069 2308 2220 4996 1367 2835 2844 3972 2791 2768 3671 -516 3202 1702 5617 1218 2082 2080 -1867 2458 -2477 2972 471 652 1195 -1485 3688 2383 3147 1668 2755 -604 -1524 1428 -1671 -1403 -2291 365 365 -5612 -1537 -3389 182 -846 -665 1146 -2036 5865 -2727 -2339 -1894 -1896 2074 -1968 -4272 2231 -2611 1616 -1593 3703 -1819 27 -992 -5256 -721 -2805 -639 -1398 -2853 967 -2094 1168 1439 1105 -769 34 1108 -972 120 1866 -824 3801 1851 6588 -110 1651 1495 367 979 -1315 4000 141 2739 -1975 -1315 2527 -1392 -2569 -5260 2191 1443 -2070 1005 -1646 SS 20250210T134411.5Z 9172.572355 286 1 9.19 2 73.41 124.70 110.65 330.06 0.00 1 0.00 1 0 17 9.247e-02 6.834e-03 6.057e-02 4.454e-03 4.425528e-01 2.230801e-03 5.167696e-03 -6.000000e+00 5.221739e-02 224.80 -2.00 3.47 -2.00 319.06 0.00e+00 6.211781e-04 5.346275e-04 1.761031e-04 -6.000000e+00 2.265763e-03 276.35 -2.00 20.00 -2.00 318.48 0.00e+00 3.448 0.001 302.00 328.00 3 3.2447e+00 6.1182e-03 4.0659e-02 -6.0000e+00 1.2918e-01 3.8810e-02 7.0832e-03 2.2454e-02 -6.0000e+00 1.4053e-01 -2.0258e-02 5.4613e-03 1.1258e-02 -6.0000e+00 8.3607e-02 1.2838e-03 2.9162e-03 3.3519e-03 -6.0000e+00 3.5699e-02 4.0502e-04 -4.2004e-04 1.2414e-04 3.5328e-05 -6.0000e+00 2.4602e-03 4.3914e-03 -1.0922e-04 12 9 1 12 1 1 99.23 19.77 0.44 0.00439 0.00124 7 10 1 5 0 1148.110 24.96 20.43 19.77 6.96 5.3 905.57 55426 -43252 -29261 -9589 -16478 45635 -19545 37999 -528 -7756 -12758 -20999 247 -11890 -135 -2289 -3369 14344 -2371 12325 -4254 -4093 -2518 -4959 5565 -2122 9017 -3657 -4074 -5435 1335 1035 2796 2562 -3222 -3090 -1664 -1296 1680 -2129 932 -749 -3421 968 1402 1651 -1063 1234 395 -2276 -52 882 2585 -138 1833 -212 1395 -851 129 422 979 1449 1191 -269 613 -202 1020 -1026 -97 1732 667 243 48 524 -114 -956 -1235 -1723 385 -1309 -522 -1485 -951 -1292 -455 29 -365 80 495 779 492 1807 187 -552 551 256 553 502 699 -125 -55 -1276 -512 -175 -312 -1437 -972 -931 -332 568 -16 34 -232 711 -171 215 528 253 145 -568 -642 535 209 227 449 332 405 503 915 357 527 -204 -636 -669 4 332 -253 425 -46 -271 111 -45 -506 681 -1573 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