File name: Pandora32s1_GreenbeltMD_20241201_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241202T050608.2Z 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 v1.8.60 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241201_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: 20241201 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 20241201T141248.6Z 9101.592229 105 1 12.64 2 71.97 140.25 78.91 140.49 0.00 1 0.00 1 0 25 1.511e-01 8.301e-03 8.966e-02 5.236e-03 4.924748e-01 2.627060e-03 5.810388e-03 -6.000000e+00 8.473743e-02 223.33 -2.00 3.47 -2.00 319.47 0.00e+00 1.835615e-03 7.293972e-04 2.088137e-04 -6.000000e+00 3.749213e-03 279.71 -2.00 20.00 -2.00 318.85 0.00e+00 3.188 0.001 302.00 328.00 3 3.9836e+00 7.3412e-03 4.0153e-02 -6.0000e+00 2.0870e-01 9.8733e-03 8.6769e-03 2.4995e-02 -6.0000e+00 2.2726e-01 -4.1888e-02 7.0659e-03 1.2632e-02 -6.0000e+00 1.3562e-01 1.8606e-02 3.7415e-03 3.9125e-03 -6.0000e+00 5.8186e-02 2.3199e-04 -1.9800e-03 1.4377e-04 4.1942e-05 -6.0000e+00 4.0210e-03 7.5596e-03 -3.8219e-04 12 9 1 12 1 1 97.63 19.61 0.32 0.00756 -0.00732 5 5 1 5 0 2105.640 24.86 18.57 19.61 4.08 5.2 887.01 71940 -46043 -67000 -25222 -45683 -72818 -40220 -38986 -14585 -46908 -24118 -48161 -20744 -25965 2860 -11918 -5632 -3675 -13070 736 -5017 7380 24223 -14075 -3079 -6018 -5334 4457 -3573 2136 -2300 -2734 -2311 787 3506 -10765 -1510 -1356 2559 1457 915 4394 -138 4707 2724 -39 557 3902 2374 1095 1309 1174 694 4666 -357 1130 571 768 923 -884 2315 -337 2886 -195 120 2056 -28 962 600 2050 25 -197 -1115 213 -467 -2436 -566 -1929 -2537 -1228 -2034 -330 -2076 -1263 -1137 -920 743 -310 601 -228 841 929 261 -589 668 229 -61 1128 1072 -316 463 -1517 -936 -107 -636 -765 -444 -627 -503 450 219 601 430 278 337 -119 515 -375 133 15 -348 -284 -196 590 786 233 807 153 847 8 361 -292 -361 110 -245 -163 -300 -212 478 -357 -22 -2 -183 502 -1150 -2200 -557 -1127 -2184 -926 -997 -337 -1597 -685 -1808 -704 -1138 116 -651 -323 -223 -932 48 -362 475 1354 -1202 -256 -546 -492 367 -305 175 -217 -298 -285 102 435 -1469 -199 -206 450 307 217 1086 -37 1243 740 -11 158 1081 679 327 417 409 262 1816 -152 491 256 345 408 -389 1008 -159 1460 -110 71 1175 -16 528 348 1307 18 -145 -836 153 -320 -1564 -332 -1113 -1539 -826 -1545 -272 -1863 -1175 -1105 -938 780 -337 652 -244 856 895 240 -538 637 240 -70 1399 1418 -427 602 -1873 -1081 -122 -765 -964 -577 -845 -711 670 347 981 702 443 515 -175 748 -561 207 25 -567 -457 -308 902 1170 340 1134 216 1258 13 608 -510 -646 201 -469 -323 -603 -430 973 -721 -43 -3 -338 SS 20241201T142257.7Z 9101.599279 108 1 49.04 2 70.74 142.37 77.74 142.37 0.00 1 0.00 1 0 25 8.733e-02 6.304e-03 2.819e-02 2.209e-03 4.683432e-01 1.105287e-03 5.485720e-03 -6.000000e+00 4.906051e-02 223.33 -2.00 3.47 -2.00 319.22 0.00e+00 1.093389e-03 2.851074e-04 3.788760e-04 -6.000000e+00 2.169835e-03 279.70 -2.00 20.00 -2.00 318.60 0.00e+00 2.997 0.000 302.00 328.00 3 4.0132e+00 3.0548e-03 3.7829e-02 -6.0000e+00 1.2083e-01 8.7618e-03 3.5767e-03 2.3559e-02 -6.0000e+00 1.3150e-01 -1.4523e-02 2.8165e-03 1.1986e-02 -6.0000e+00 7.8479e-02 1.1147e-03 1.4993e-03 3.6913e-03 -6.0000e+00 3.3721e-02 2.7670e-04 -9.3501e-05 6.1288e-05 3.9080e-05 -6.0000e+00 2.3229e-03 3.8769e-03 -9.3347e-05 10 0 0 10 0 0 99.93 19.65 0.31 0.00388 0.00317 28 7 1 5 0 1751.170 24.86 19.44 19.65 4.58 5.2 890.29 15544 -26043 -37593 -32519 -26512 -50002 -5959 -27487 -22287 -20065 -23848 -27499 -11247 -14564 -4443 -3246 -8507 -6099 -191 44 -2668 -665 3439 -4144 868 -2693 -2801 -3457 -3153 -4939 988 -1636 6543 -295 -4337 -5726 -3683 -210 -1435 1584 -826 769 313 197 1057 2332 690 251 977 -103 1169 1832 411 2140 466 1865 456 272 -33 -693 1813 686 1436 1913 727 1005 897 96 443 2207 -37 -627 292 222 -553 -620 -914 -1503 -1656 -1019 -1711 -1163 -1349 -1627 -874 -822 415 117 -10 724 270 1053 -89 388 813 84 425 431 396 -253 -181 -1214 -983 -370 -619 -1123 -760 -407 -220 470 264 262 413 438 569 124 555 -83 31 -305 -209 -193 440 150 314 492 -29 645 541 444 321 -164 -271 82 55 -102 -305 -187 -190 -229 124 57 -246 225 -652 -1132 -928 -660 -1462 -121 -764 -674 -648 -825 -1034 -420 -683 -229 -193 -587 -443 -14 3 -219 -54 273 -377 81 -278 -296 -359 -313 -500 104 -201 844 -44 -655 -841 -560 -36 -295 375 -224 220 94 60 325 715 217 79 312 -34 407 691 169 921 213 870 221 133 -16 -329 856 347 788 1137 455 615 525 56 271 1475 -28 -487 227 168 -399 -413 -565 -906 -1041 -711 -1342 -997 -1239 -1559 -871 -859 448 130 -11 790 283 1038 -84 360 789 89 493 542 530 -344 -237 -1500 -1144 -427 -751 -1429 -996 -552 -311 701 418 426 671 692 859 180 799 -123 48 -487 -338 -308 684 229 466 709 -41 901 798 700 533 -282 -476 147 103 -198 -603 -373 -381 -452 238 107 -447 SS 20241201T142939.4Z 9101.603928 112 1 16.32 2 69.96 143.79 76.99 143.64 0.00 1 0.00 1 0 17 1.626e-01 8.798e-03 1.054e-01 5.318e-03 4.560812e-01 2.658878e-03 5.289604e-03 -6.000000e+00 9.146741e-02 223.33 -2.00 3.47 -2.00 319.24 0.00e+00 2.331333e-03 6.903503e-04 3.519266e-04 -6.000000e+00 4.040418e-03 279.70 -2.00 20.00 -2.00 318.62 0.00e+00 2.887 0.000 302.00 328.00 3 4.5273e+00 7.3530e-03 3.6538e-02 -6.0000e+00 2.2529e-01 3.5029e-02 8.6090e-03 2.2869e-02 -6.0000e+00 2.4508e-01 -2.9372e-02 6.7499e-03 1.1859e-02 -6.0000e+00 1.4627e-01 6.3834e-03 3.5901e-03 4.4934e-03 -6.0000e+00 6.2913e-02 1.8346e-04 9.6486e-04 1.4825e-04 4.3463e-05 -6.0000e+00 4.3242e-03 1.4484e-03 1.1931e-04 12 9 1 12 1 1 99.97 19.73 0.38 0.00145 0.00870 7 6 1 5 0 2038.860 24.86 18.72 19.73 5.01 5.2 892.22 143322 -59490 -49523 4470 -53772 -43682 14231 13880 -18364 -23018 -9058 -42597 13658 -11990 10915 7099 -14468 2277 -353 14117 2621 -645 13523 -605 2198 -2394 1760 2407 -5159 -7110 -4592 -3076 2381 2840 985 -5206 -4888 -4520 -1842 -181 659 -1054 -1595 2920 -719 256 601 2785 3678 1011 329 1214 567 2478 1034 662 926 65 2408 -471 1602 -704 1753 2122 651 1001 -788 1772 304 1816 -1675 -17 1114 377 -319 -2717 252 -1926 -2382 -2020 -1905 -472 -2445 -2237 -1498 -551 1200 355 1133 674 242 1912 330 -487 -467 135 529 1257 1065 -74 -242 -1840 -1850 -184 -611 -1293 -357 -813 -85 862 86 298 564 432 587 237 -109 -160 -99 424 -608 381 591 -281 82 6 46 440 883 251 267 -81 -492 -41 -297 108 -19 -205 316 -400 63 -8 -265 743 -2242 -1838 100 -1907 -1320 259 282 -570 -808 -287 -1929 423 -574 509 400 -1105 160 -27 996 213 -54 1008 -55 207 -249 180 239 -527 -744 -512 -386 322 413 143 -765 -751 -795 -378 -43 175 -304 -482 869 -223 80 188 859 1141 329 114 456 230 1054 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