File name: Pandora32s1_GreenbeltMD_20230626_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230627T183713.7Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230626_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: 20230626 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 20230626T112224.7Z 8577.473897 88 1 48.46 2 73.30 73.17 142.01 2.24 0.00 1 0.00 1 0 17 8.835e-02 6.720e-03 2.274e-02 1.682e-03 4.459879e-01 8.709668e-04 5.154322e-03 -6.000000e+00 5.145487e-02 232.77 -2.00 3.47 -2.00 319.45 0.00e+00 1.330809e-03 2.385941e-04 7.964906e-04 -6.000000e+00 2.277683e-03 288.42 -2.00 20.00 -2.00 318.66 0.00e+00 3.425 0.001 302.00 328.00 3 2.9488e+00 2.4935e-03 4.1402e-02 -6.0000e+00 1.2920e-01 -1.0274e-02 2.9336e-03 2.3670e-02 -6.0000e+00 1.3940e-01 -1.0245e-02 2.2504e-03 1.1649e-02 -6.0000e+00 8.3004e-02 -6.7463e-04 1.1799e-03 3.3278e-03 -6.0000e+00 3.5280e-02 5.5502e-04 -1.2288e-04 4.7756e-05 3.5878e-05 -6.0000e+00 2.3555e-03 2.0025e-03 -1.9019e-05 11 8 0 10 0 0 99.62 22.42 0.31 0.00200 0.00108 101 24 1 5 0 479.800 26.73 20.00 22.42 28.36 3.0 1017.83 -18549 -32325 -19249 -9038 -14311 -81241 -11909 -5185 -80 -20825 -16093 -19331 -13821 -16192 -4188 -656 4393 -1884 -39 1034 -3371 1420 5248 -282 280 -1758 534 -2292 -1943 -5936 -882 175 2717 -346 -4222 -4061 -4698 -2649 -845 -69 -1329 295 -1558 1405 -68 55 534 1150 -57 -1439 468 1154 1600 1682 1518 614 732 168 323 -102 604 2094 2046 3037 1473 417 -229 -303 73 1508 496 332 570 258 100 -542 -1293 -1648 -1943 -1486 -1101 -1236 -1704 -1795 -738 -627 211 766 556 1165 788 784 -528 -346 -111 -341 238 601 119 -107 -429 -1293 -1375 -443 -1065 -945 -648 -604 -70 448 713 794 595 392 -109 12 -93 -56 31 361 -155 278 579 193 315 88 -402 380 106 194 299 -226 -485 -190 13 6 131 222 210 29 -3 -254 -622 -346 -820 -465 -197 -301 -3126 -238 -110 -2 -649 -494 -640 -501 -734 -205 -36 258 -116 -3 70 -250 101 366 -22 24 -162 50 -213 -171 -544 -84 19 326 -47 -578 -532 -654 -421 -161 -16 -323 76 -429 386 -19 16 153 327 -17 -436 149 402 605 683 653 276 340 79 149 -47 278 1019 1029 1673 868 241 -125 -163 42 964 336 239 414 182 71 -348 -758 -925 -1145 -998 -795 -1012 -1537 -1610 -698 -636 226 848 623 1267 807 741 -500 -318 -108 -350 260 739 153 -140 -567 -1571 -1536 -518 -1267 -1203 -863 -800 -99 682 1115 1304 975 614 -169 18 -134 -84 46 572 -253 445 894 305 476 128 -558 521 158 302 504 -401 -849 -348 24 11 265 458 437 59 -7 -496 -1175 SS 20230626T112912.0Z 8577.478611 92 1 48.75 2 72.03 74.12 141.96 4.88 0.00 1 0.00 1 0 17 1.221e-01 1.028e-02 3.991e-02 3.431e-03 4.171200e-01 1.771793e-03 4.807313e-03 -6.000000e+00 7.110931e-02 232.77 -2.00 3.47 -2.00 319.33 0.00e+00 2.079106e-03 4.653130e-04 6.382542e-04 -6.000000e+00 3.147623e-03 288.42 -2.00 20.00 -2.00 318.54 0.00e+00 3.198 0.001 302.00 328.00 3 4.4987e+00 5.0308e-03 3.8614e-02 -6.0000e+00 1.7855e-01 6.3470e-03 5.8775e-03 2.1915e-02 -6.0000e+00 1.9264e-01 -1.7298e-02 4.3570e-03 1.0906e-02 -6.0000e+00 1.1471e-01 3.3485e-03 2.2828e-03 3.4477e-03 -6.0000e+00 4.8757e-02 1.4970e-04 -1.2670e-04 9.8101e-05 3.5906e-05 -6.0000e+00 3.2552e-03 1.4945e-03 -2.9231e-05 12 8 8 10 0 0 92.17 22.43 0.45 0.00149 0.00054 22 5 1 5 0 2215.720 26.83 20.00 22.43 28.72 3.0 1020.04 -8155 -16427 12610 -18476 -33904 -120109 1419 15562 -6133 -17574 -18396 -30784 5118 -22012 -343 5668 -692 7489 7234 16123 -5948 2630 8988 1116 3622 -2349 17739 1935 982 -13833 -276 -1936 12651 -1431 -1563 -1407 -10477 -430 -2336 1676 -517 597 1196 1362 515 2915 1060 3990 1513 1011 715 3009 2805 2593 1990 1677 706 -475 -132 869 412 1374 2588 2471 -287 -383 16 -63 -425 744 110 -153 -383 159 359 -1832 -2070 -2800 -2124 -2099 -1480 -452 -856 -2335 -1182 -928 623 888 -406 1288 715 189 -773 -541 91 -128 359 1118 729 225 -207 -1379 -725 -746 -850 -722 2 -360 -90 164 537 415 504 273 336 -256 -399 -237 12 236 462 397 781 661 389 -126 -144 26 -266 406 -102 -531 -637 246 238 -71 -107 -362 489 274 -61 -335 -423 -178 -452 285 -556 -1086 -8042 32 338 -185 -640 -693 -1347 182 -1217 -18 334 -48 511 529 1139 -538 221 719 102 345 -251 1605 198 97 -1562 -30 -239 1533 -213 -228 -197 -1676 -72 -477 390 -138 169 350 409 157 883 329 1203 470 322 242 1084 1090 1072 867 755 329 -225 -62 396 192 675 1376 1428 -177 -230 9 -35 -249 480 79 -115 -292 117 251 -1203 -1252 -1638 -1275 -1408 -1110 -371 -757 -2186 -1153 -955 664 974 -453 1398 742 186 -718 -490 86 -132 405 1371 960 301 -269 -1686 -829 -854 -1026 -917 3 -491 -128 246 851 680 824 432 505 -370 -571 -348 19 377 751 640 1230 1017 581 -183 -203 37 -394 638 -170 -917 -1122 443 448 -140 -214 -736 997 552 -119 -640 -788 SS 20230626T114344.6Z 8577.488711 101 1 47.83 2 69.30 76.15 141.65 10.51 0.00 1 0.00 1 0 17 6.621e-02 8.523e-03 3.267e-02 3.875e-03 3.694008e-01 1.992784e-03 4.241258e-03 -6.000000e+00 3.857757e-02 232.77 -2.00 3.47 -2.00 318.84 0.00e+00 2.838874e-04 4.495534e-04 2.985777e-04 -6.000000e+00 1.706772e-03 288.42 -2.00 20.00 -2.00 318.02 0.00e+00 2.801 0.000 302.00 328.00 3 5.1325e+00 5.5306e-03 3.3904e-02 -6.0000e+00 9.6864e-02 6.1084e-03 6.3648e-03 1.9311e-02 -6.0000e+00 1.0449e-01 1.0973e-02 4.4281e-03 9.3642e-03 -6.0000e+00 6.2225e-02 -1.1469e-02 2.3157e-03 2.5908e-03 -6.0000e+00 2.6460e-02 1.2297e-04 5.5920e-04 1.1129e-04 2.6413e-05 -6.0000e+00 1.7650e-03 7.0649e-04 6.2242e-05 11 8 0 10 0 0 99.91 22.47 0.32 0.00071 0.00491 15 4 1 5 0 3188.060 26.83 20.01 22.47 29.17 3.0 1022.31 9808 -8095 -18300 18807 -23410 -29685 11558 6720 -5441 -12596 -31410 -21218 17667 -13588 10951 8660 -4134 983 5358 15467 -2888 -6539 2834 -3312 384 -3071 17553 2366 -3592 -9635 891 -2899 12766 -2030 -4663 -5166 -6391 472 -6070 1561 -903 1956 1420 809 1247 238 740 2157 1929 561 -777 1293 1699 1181 866 -888 490 -761 785 -145 811 715 2075 2367 -179 287 -2424 23 -1048 1692 368 -224 -220 -438 1232 -1413 -551 -2365 -2590 -1056 -1771 -1565 -645 -1810 -964 -604 600 284 689 1304 1377 999 55 -239 290 -85 270 803 1174 322 -365 -1294 -1225 -331 -1216 -669 -1122 159 136 704 297 765 284 380 346 -545 -663 -449 153 532 95 44 595 178 76 -468 -304 348 -230 -324 34 -743 -467 647 324 409 -93 -149 256 185 -318 -29 -310 279 -314 -833 600 -1016 -1277 351 240 -248 -666 -2028 -1277 827 -1004 755 696 -407 98 542 1491 -344 -810 326 -428 52 -452 2173 328 -498 -1387 123 -463 1962 -383 -879 -937 -1233 98 -1605 455 -300 677 512 299 463 90 278 794 711 211 -312 552 773 571 439 -470 264 -416 418 -77 432 403 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