File name: Pandora32s1_GreenbeltMD_20240824_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240825T052043.8Z 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_20240824_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: 20240824 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 20240824T111505.8Z 9002.468818 215 1 48.30 2 82.16 82.38 36.43 239.40 0.00 1 0.00 1 0 17 5.072e-01 2.946e-02 2.646e-01 1.164e-02 8.105884e-01 6.455848e-03 9.332291e-03 -6.000000e+00 2.954984e-01 230.89 -2.00 3.47 -2.00 321.79 0.00e+00 1.799247e-03 3.395758e-03 5.967530e-03 -6.000000e+00 1.326160e-02 290.25 -2.00 20.00 -2.00 321.23 0.00e+00 6.825 0.005 302.00 328.00 3 2.3400e+00 2.4346e-02 8.5997e-02 -6.0000e+00 7.3881e-01 9.0129e-01 3.0816e-02 5.8862e-02 -6.0000e+00 8.0008e-01 -1.3255e+00 2.1897e-02 2.3615e-02 -6.0000e+00 4.7502e-01 5.5948e-01 1.0587e-02 6.4319e-03 -6.0000e+00 2.0140e-01 2.5764e-05 -5.3447e-04 3.0930e-04 1.0012e-04 -6.0000e+00 1.3622e-02 1.1705e-02 -2.0834e-04 12 9 9 12 4 4 -21.32 -62.18 1.38 0.01170 0.00769 17 4 1 5 0 2840.880 26.11 20.06 -62.18 22.51 5.0 993.43 -26147 -1055 -81276 -31552 -110236 -98024 900000 -60989 -45778 -102523 -56527 -109890 -64085 79526 98414 -2548 -6712 21559 55050 266327 83662 -36611 168301 -24905 106533 -9338 97269 120487 -40131 -6484 69001 12201 900000 24195 -3823 3925 -35573 62802 -30549 110123 65081 125611 78755 103952 104591 41934 76695 29545 81702 34217 29239 62480 28048 76751 49528 52632 23533 15710 51696 21847 27366 16484 21471 18861 5278 33441 680 30228 7742 19393 1645 724 17583 7062 4577 -6008 -2998 4163 -8655 7607 -4668 5111 -2627 704 2712 -671 1832 -5015 1245 1380 -5729 10028 -4668 236 -4832 -2113 -3891 -2764 3115 -5273 696 -6571 -4239 -3637 -6109 -1459 -2577 -1351 -2124 -2664 -1251 461 -191 235 1210 -853 -2281 181 993 1759 2054 929 3165 1751 3279 2104 2231 985 820 2473 653 789 -1150 1170 -206 179 816 -1947 640 -549 430 -935 -2181 -782 -27 -4695 -1009 -6481 -4449 900000 -1950 -1322 -5287 -1807 -6234 -2710 984 1218 -100 -298 756 1420 3022 1553 -2115 1910 -1284 1538 -433 1655 1504 -2111 -247 1566 529 900000 1123 -221 194 -2678 2209 -2962 3373 3470 3848 3932 4010 3916 2902 3742 2346 3986 2834 2533 4750 2980 5921 5282 5613 3107 2204 5279 2591 3353 2193 3078 3152 1089 5174 143 4864 1709 4380 492 229 4625 1930 1157 -1493 -665 867 -2294 2056 -1700 1956 -1211 336 1345 -366 1026 -3104 723 774 -3238 4541 -2369 118 -2886 -1450 -3202 -2618 3110 -5404 696 -6344 -3590 -3001 -5520 -1346 -2541 -1418 -2491 -3299 -1739 687 -296 357 1753 -1216 -3309 269 1550 2848 3288 1440 4587 2501 4471 2809 2877 1336 1270 4372 1320 1724 -2514 2675 -513 471 2179 -5407 1728 -1442 1041 -2120 -5154 SS 20240824T113243.1Z 9002.481055 220 1 48.86 2 78.76 85.09 39.33 244.21 0.00 1 0.00 1 0 25 3.977e-01 9.822e-03 5.798e-02 2.313e-03 6.417168e-01 1.224022e-03 7.396064e-03 -6.000000e+00 2.296177e-01 230.89 -2.00 3.47 -2.00 320.73 0.00e+00 2.783686e-03 5.240115e-04 2.241260e-03 -6.000000e+00 1.032418e-02 290.25 -2.00 20.00 -2.00 320.03 0.00e+00 4.948 0.002 302.00 328.00 3 1.8497e+00 3.9938e-03 6.0089e-02 -6.0000e+00 5.7348e-01 9.8175e-02 5.1928e-03 3.5691e-02 -6.0000e+00 6.1981e-01 -1.6810e-01 4.6877e-03 1.8070e-02 -6.0000e+00 3.7006e-01 6.8117e-02 2.3097e-03 5.2319e-03 -6.0000e+00 1.5792e-01 3.1635e-04 -5.6307e-04 6.2529e-05 7.3426e-05 -6.0000e+00 1.0604e-02 1.0146e-02 -1.7356e-04 12 9 9 12 4 4 15.16 -62.18 0.52 0.01015 0.00591 86 20 1 5 0 568.030 26.21 19.85 -62.18 24.03 5.0 1001.95 -145207 -150022 -112895 -156125 -117484 -162586 -119314 -106450 -126182 -95729 -118443 -118715 -38024 -63136 -16165 -36023 -26391 -23584 -8022 -7561 -25874 -24946 -28828 -30706 -8247 -20178 -7484 -28240 -21560 -29683 -10755 -5997 10090 -3914 -10774 -5950 -13564 -2142 -4842 6582 5787 5057 -279 6380 4946 5566 3497 8203 2925 -783 4387 5663 5042 6659 6647 3961 2570 2175 1315 2474 1347 3028 2875 4417 2341 361 2058 5 600 2972 1690 793 1016 1469 -1330 -736 -1693 -2962 -3054 -1584 -810 -681 -1598 -1573 -428 -387 -9 394 664 854 618 884 -1011 -700 -533 -927 -563 161 332 -518 -575 -1288 -1727 -528 -950 -1596 -892 -1231 -396 290 498 424 324 399 -70 294 166 15 525 22 86 422 791 791 561 527 -322 655 714 485 475 -457 -177 -69 -252 -168 -114 85 268 -181 106 -338 -602 -1933 -2539 -1452 -3100 -1458 -3008 -1507 -1345 -2221 -1361 -2218 -2437 -429 -1182 -241 -796 -607 -585 -186 -186 -794 -760 -937 -1101 -259 -760 -255 -1160 -807 -1259 -439 -283 476 -234 -678 -345 -906 -137 -391 575 584 559 -34 760 607 693 455 1048 411 -121 712 1021 1011 1433 1528 980 668 571 340 618 346 832 824 1414 823 128 698 2 229 1277 825 413 530 728 -624 -308 -657 -1153 -1301 -785 -470 -419 -1101 -1156 -331 -320 -8 356 601 750 511 679 -750 -522 -438 -884 -575 187 399 -643 -677 -1477 -1804 -538 -1040 -1880 -1097 -1512 -525 426 762 696 538 643 -107 456 256 23 838 37 145 688 1236 1196 873 789 -467 958 1088 841 855 -887 -359 -139 -548 -386 -256 194 610 -402 234 -704 -1276 SS 20240824T113854.4Z 9002.485351 223 1 48.53 2 77.56 86.05 40.38 245.78 0.00 1 0.00 1 0 25 2.771e-01 7.749e-03 4.120e-02 1.720e-03 5.923812e-01 9.033861e-04 6.770115e-03 -6.000000e+00 1.600065e-01 230.89 -2.00 3.47 -2.00 320.36 0.00e+00 1.453481e-03 3.425468e-04 1.198747e-03 -6.000000e+00 7.193915e-03 290.25 -2.00 20.00 -2.00 319.63 0.00e+00 4.507 0.002 302.00 328.00 3 1.8143e+00 2.7917e-03 5.4525e-02 -6.0000e+00 3.9962e-01 4.1820e-02 3.5250e-03 3.1600e-02 -6.0000e+00 4.3188e-01 -8.3215e-02 3.1079e-03 1.5802e-02 -6.0000e+00 2.5786e-01 3.1764e-02 1.5680e-03 4.5374e-03 -6.0000e+00 1.1006e-01 5.2507e-04 -3.9938e-04 4.6932e-05 5.2584e-05 -6.0000e+00 7.3871e-03 9.9526e-03 -1.3735e-04 12 9 1 12 4 4 95.43 -62.18 0.40 0.00995 0.00695 114 27 1 5 0 425.640 26.32 20.08 -62.18 24.41 5.0 1003.79 -69184 -107560 -91338 -92246 -109177 -92960 -97054 -65275 -89135 -80366 -75409 -90138 -39987 -47491 -31185 -20523 -31727 -10585 -13152 2157 -25043 -8983 -5085 -19737 -4704 -8513 3029 -12518 -13238 -9044 -9200 -1424 2231 539 -9373 -7332 -7788 -6137 -845 -473 3963 2511 -1181 4286 1906 3679 419 1855 31 -2363 3339 3674 4057 2739 2743 2073 2017 756 1003 1414 420 1161 3476 2770 2927 557 1396 -386 869 2006 331 1310 36 854 -387 -706 -1773 -2288 -1390 -1488 -914 -891 -1926 -1752 -947 -384 -225 585 498 781 846 903 -345 -735 86 -8 -339 754 367 -171 -545 -1260 -1518 -493 -615 -1392 -677 -852 -679 392 446 684 366 363 159 -112 158 -23 281 -80 -233 213 487 636 511 564 -169 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