File name: Pandora32s1_GreenbeltMD_20240512_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240515T023003.7Z 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_20240512_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: 20240512 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 20240512T111425.8Z 8898.468354 76 1 4.98 2 76.57 77.14 107.82 30.03 0.00 1 0.00 1 0 17 5.184e-01 1.411e-02 2.651e-01 7.552e-03 7.582463e-01 4.094029e-03 8.588141e-03 -6.000000e+00 2.999235e-01 230.97 -2.00 3.47 -2.00 320.81 0.00e+00 5.938730e-03 1.769850e-03 1.679691e-03 -6.000000e+00 1.394599e-02 284.15 -2.00 20.00 -2.00 320.22 0.00e+00 4.202 0.001 302.00 328.00 3 2.3698e+00 1.3027e-02 5.8126e-02 -6.0000e+00 7.5253e-01 1.8817e-01 1.7325e-02 4.0294e-02 -6.0000e+00 8.1510e-01 -2.4259e-01 1.7148e-02 2.2756e-02 -6.0000e+00 4.8316e-01 9.8049e-02 8.3783e-03 9.5893e-03 -6.0000e+00 2.0761e-01 3.0470e-04 -7.5383e-04 1.9298e-04 1.0562e-04 -6.0000e+00 1.3957e-02 1.0253e-02 -3.5171e-05 12 9 9 12 1 1 68.78 21.26 0.25 0.01025 0.00459 5 14 1 5 0 828.830 25.90 19.99 21.26 14.54 4.5 953.02 900000 -231577 900000 -210912 -157468 -119277 -206356 32040 -186621 900000 -162912 -100391 900000 -100034 66434 -96392 31400 -57567 16530 179761 -81309 49721 -20744 7932 -28723 -25885 136676 -50660 24809 -48676 -16064 768 -7545 26592 -24371 25753 -23283 -21703 22315 -4248 23685 -9731 7061 5826 6178 28006 -1133 14711 -8320 939 1683 6320 11676 4797 11648 2802 6580 5567 -3729 10943 2284 10454 -311 8367 5551 -1301 7332 398 4993 1343 560 1663 -1382 3707 -1227 -1060 71 -150 -1682 -538 -1425 -1572 -1522 -1729 -1022 -149 -665 434 -1045 1241 -203 -1993 -1068 -1230 582 -2162 -602 644 275 66 -1674 1074 -860 -1337 -266 -2362 220 -1980 455 201 7 456 -181 937 -330 298 840 -505 924 -551 275 42 578 500 536 801 75 2199 -10 526 307 181 108 -194 -119 -967 137 322 -316 162 -399 284 -853 900000 -5096 900000 -4345 -1834 -915 -3734 236 -3496 900000 -2797 -1061 900000 -1759 489 -2628 302 -1433 227 1323 -3065 551 -453 142 -779 -725 1006 -1816 438 -1821 -528 27 -336 957 -1397 895 -1347 -1430 1184 -346 1695 -1031 678 588 635 2411 -132 1545 -1143 127 250 1012 1964 935 2277 619 1451 1241 -883 2210 507 2329 -87 2443 1802 -452 2331 138 1796 566 263 809 -691 1697 -543 -425 26 -56 -692 -256 -793 -989 -1047 -1258 -777 -118 -552 367 -895 1023 -161 -1523 -781 -915 466 -1994 -618 730 338 84 -2062 1198 -895 -1371 -282 -2672 253 -2429 586 283 11 732 -297 1505 -518 452 1261 -787 1479 -917 453 67 897 758 794 1152 106 3102 -15 893 561 347 214 -401 -257 -2172 310 734 -724 363 -859 581 -1704 SS 20240512T112412.8Z 8898.475148 79 1 48.64 2 74.72 78.57 106.89 31.99 0.00 1 0.00 1 0 17 3.571e-01 7.611e-03 1.647e-02 6.462e-04 6.776916e-01 3.405212e-04 7.668893e-03 -6.000000e+00 2.062304e-01 230.97 -2.00 3.47 -2.00 320.31 0.00e+00 2.771444e-03 1.252366e-04 8.953724e-04 -6.000000e+00 9.034936e-03 284.16 -2.00 20.00 -2.00 319.68 0.00e+00 3.722 0.001 302.00 328.00 3 5.7373e-01 1.0229e-03 5.1542e-02 -6.0000e+00 5.1627e-01 7.6084e-02 1.2984e-03 3.5589e-02 -6.0000e+00 5.5850e-01 -9.8714e-02 1.2131e-03 1.8535e-02 -6.0000e+00 3.3219e-01 3.4082e-02 6.1137e-04 6.3008e-03 -6.0000e+00 1.4091e-01 3.2440e-03 -6.5822e-04 1.6863e-05 6.6125e-05 -6.0000e+00 9.5181e-03 9.4630e-03 -1.3125e-04 11 8 0 10 0 0 79.29 21.28 0.30 0.00946 0.00452 569 133 1 5 0 85.470 25.90 19.99 21.28 15.31 4.6 960.05 -129101 -128028 -99253 -119985 -114698 -133011 -129687 -105967 -106127 -96985 -103516 -89777 -69364 -66622 -35355 -36982 -26442 -28235 -18920 -16682 -18762 -15837 -23208 -17490 -14942 -16643 -12773 -18573 -16681 -21044 -11267 -7104 -3580 -1134 -8254 -5650 -8723 -4761 -604 833 2020 1161 1553 1295 2523 3426 1888 3607 1564 1749 3563 3601 3758 3471 3430 2619 2082 1027 805 1377 1236 2433 2704 3206 2143 1216 1156 536 1165 1294 825 700 269 276 -628 -942 -1562 -1849 -1718 -1197 -953 -1169 -1600 -1871 -1070 -699 -260 239 242 650 390 569 -106 -100 2 -177 189 416 93 -343 -476 -745 -713 -141 -862 -1375 -749 -613 19 323 338 299 254 360 133 382 373 296 -10 -137 -259 215 450 333 422 380 126 927 322 60 139 -83 -70 -37 -126 -216 -131 158 -29 -130 -36 -138 -321 -1391 -1678 -1088 -1641 -1381 -1836 -1831 -1349 -1558 -1436 -1735 -1448 -1137 -1390 -695 -911 -680 -827 -557 -513 -615 -507 -823 -638 -585 -710 -541 -821 -709 -981 -509 -376 -217 -74 -576 -372 -631 -390 -59 97 268 170 239 190 405 511 293 570 265 315 698 796 920 931 986 796 660 331 254 420 383 809 942 1264 924 527 488 232 545 649 466 419 162 158 -333 -483 -739 -870 -884 -673 -632 -834 -1273 -1592 -900 -625 -244 231 235 609 343 497 -88 -84 2 -179 207 494 123 -466 -613 -864 -788 -152 -996 -1702 -914 -794 25 478 530 479 413 597 208 568 550 454 -16 -223 -420 351 703 502 644 558 178 1318 488 98 252 -154 -136 -73 -267 -463 -288 350 -64 -282 -77 -273 -635 SS 20240512T113443.3Z 8898.482446 82 1 40.06 2 72.71 80.12 105.84 34.04 0.00 1 0.00 1 0 17 2.256e-01 6.524e-03 1.431e-02 7.149e-04 6.140006e-01 3.721350e-04 6.994885e-03 -6.000000e+00 1.303441e-01 230.97 -2.00 3.47 -2.00 319.82 0.00e+00 1.920730e-03 1.170845e-04 6.357729e-04 -6.000000e+00 5.710078e-03 284.16 -2.00 20.00 -2.00 319.15 0.00e+00 3.315 0.001 302.00 328.00 3 1.1002e+00 1.0739e-03 4.6238e-02 -6.0000e+00 3.2630e-01 5.3160e-02 1.3029e-03 3.2007e-02 -6.0000e+00 3.5297e-01 -6.1853e-02 1.1350e-03 1.6182e-02 -6.0000e+00 2.0994e-01 1.8469e-02 5.8903e-04 5.0803e-03 -6.0000e+00 8.9067e-02 3.0197e-03 -5.0082e-04 1.8867e-05 5.1362e-05 -6.0000e+00 6.0143e-03 9.2396e-03 -9.2232e-05 12 9 1 12 1 1 99.76 21.31 0.30 0.00924 0.00548 293 84 1 5 0 136.250 25.90 19.99 21.31 16.30 4.5 963.90 -94422 -68524 -74347 -67273 -83087 -90160 -75135 -76948 -65403 -62899 -54058 -51399 -42127 -30247 -26567 -15740 -16304 -11028 -6846 -8674 -8415 -12457 -7508 -8442 -7900 -7199 -9215 -9861 -10990 -8460 -3887 -2695 -585 -2805 -3954 -5090 -4467 -2071 -1166 889 -50 553 214 756 1629 1462 1070 1165 926 732 2102 2331 2259 2656 1805 1748 1371 365 446 264 1130 1580 2540 2663 1575 933 514 410 708 1071 654 489 114 92 -179 -610 -1013 -1301 -1434 -950 -1051 -1230 -1666 -1819 -982 -739 -173 -6 195 585 373 740 -5 225 166 28 292 436 162 -420 -361 -798 -595 -91 -802 -1168 -792 -511 -46 357 315 251 293 393 300 443 317 259 -25 -99 -304 147 352 232 314 282 152 894 437 116 112 -150 -135 17 -35 -199 -141 52 -49 -125 -6 -128 -324 -1382 -941 -1197 -1018 -1361 -1509 -1142 -1363 -1190 -1232 -1021 -1028 -937 -766 -821 -530 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