File name: Pandora32s1_GreenbeltMD_20240204_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T215214.8Z 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_20240204_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: 20240204 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 20240204T170803.5Z 8800.713930 369 1 49.27 2 55.30 176.15 93.32 239.31 0.00 1 0.00 1 0 17 1.252e-02 5.730e-03 5.070e-03 1.903e-03 2.751499e-01 9.502349e-04 3.309601e-03 -6.000000e+00 7.063539e-03 224.60 -2.00 3.47 -2.00 316.82 0.00e+00 7.460412e-04 1.203399e-04 5.422739e-05 -6.000000e+00 3.067399e-04 276.38 -2.00 20.00 -2.00 316.23 0.00e+00 1.752 0.000 302.00 328.00 3 5.2599e+00 2.4719e-03 2.2154e-02 -6.0000e+00 1.7466e-02 3.3803e-02 2.7743e-03 1.3780e-02 -6.0000e+00 1.9003e-02 -9.0757e-03 1.6488e-03 6.8674e-03 -6.0000e+00 1.1308e-02 -1.2126e-03 8.0528e-04 2.0391e-03 -6.0000e+00 4.8307e-03 3.3999e-04 -2.6056e-04 5.3469e-05 2.2696e-05 -6.0000e+00 3.3298e-04 4.9207e-03 -6.4121e-05 10 0 0 10 0 0 90.96 21.33 0.23 0.00492 0.00296 14 3 1 5 0 3518.770 25.90 19.99 21.33 18.67 3.6 959.04 -1208 -1923 -2977 -1602 -4759 -3864 -520 894 -2485 -2244 -5127 -5272 1234 -1803 2431 801 -1691 561 906 2751 739 -137 1503 516 1690 305 -36 73 -226 -293 2501 638 1102 53 -3449 -1287 -1945 -1007 -387 315 -562 -423 340 -495 29 -112 -1448 161 -244 81 251 648 779 1342 1010 664 637 3 46 287 991 1138 1035 1454 -151 114 191 134 448 785 -107 -307 75 248 42 -498 -428 -1049 -1347 -953 -1324 -1022 -1792 -1874 -243 -564 263 36 22 384 93 480 133 -21 865 488 347 635 645 -78 -204 -798 -429 -44 -612 -969 -506 -656 135 418 199 108 59 228 370 38 32 93 151 165 -218 -137 671 59 566 608 49 738 496 85 29 -49 -305 49 -119 -185 -42 -113 349 -133 -214 -207 -494 -153 -276 -449 -232 -644 -479 -64 120 -384 -369 -867 -894 215 -368 542 200 -456 153 257 792 222 -41 448 161 550 104 -13 24 -72 -90 775 216 400 20 -1315 -462 -728 -419 -185 170 -332 -261 214 -317 19 -72 -929 100 -151 50 158 430 541 965 748 501 488 2 35 216 751 899 869 1281 -137 99 157 107 365 692 -102 -303 74 242 39 -439 -350 -823 -1069 -814 -1234 -1019 -1887 -2035 -271 -659 318 44 27 471 110 535 139 -21 897 539 410 799 852 -103 -263 -981 -503 -52 -756 -1252 -671 -894 188 605 299 166 88 332 511 51 42 124 209 239 -323 -203 970 84 779 812 64 945 658 118 42 -73 -455 75 -187 -300 -69 -190 586 -222 -351 -331 -778 SS 20240204T171808.3Z 8800.720929 372 1 48.40 2 55.22 179.09 94.96 240.77 0.00 1 0.00 1 0 17 9.364e-03 5.389e-03 2.456e-03 9.995e-04 2.725313e-01 4.996789e-04 3.280943e-03 -6.000000e+00 5.283841e-03 224.60 -2.00 3.47 -2.00 316.62 0.00e+00 4.377065e-04 6.015145e-05 5.423903e-05 -6.000000e+00 2.294729e-04 276.38 -2.00 20.00 -2.00 316.03 0.00e+00 1.748 0.000 302.00 328.00 3 4.0633e+00 1.2961e-03 2.2028e-02 -6.0000e+00 1.3065e-02 1.2221e-02 1.4524e-03 1.3613e-02 -6.0000e+00 1.4215e-02 -6.4038e-03 8.5635e-04 6.7888e-03 -6.0000e+00 8.4589e-03 -1.4020e-03 4.1357e-04 1.9684e-03 -6.0000e+00 3.6132e-03 1.1464e-03 -2.5727e-04 2.8000e-05 2.2549e-05 -6.0000e+00 2.4912e-04 5.7051e-03 -6.3925e-05 10 0 0 10 0 0 28.65 21.35 0.24 0.00571 0.00377 51 12 1 5 0 948.990 25.90 20.01 21.35 18.00 3.7 957.27 -923 -2357 -1341 -2840 -3736 -3168 -441 248 -390 -1233 -2537 -2090 -464 -1186 1176 -12 -398 645 398 1786 295 781 1658 1119 757 180 -94 -416 -331 -161 1264 1080 1163 -85 -2741 -1377 -1936 -488 -63 -73 -572 -420 -904 -732 -337 -141 -628 -327 -826 -417 563 968 1095 1283 958 1012 877 181 391 358 1035 1181 1370 1115 342 -310 106 -6 480 900 103 -126 -166 96 -132 -277 -304 -738 -437 -570 -1111 -1116 -1945 -1815 -615 -568 -172 -32 71 248 218 563 115 585 699 308 296 389 172 -350 -301 -481 -494 106 -464 -1029 -550 -547 -76 329 170 205 166 301 156 312 409 168 169 -9 -277 37 203 260 372 581 244 931 403 325 69 -191 -117 258 -23 -100 -157 19 -113 -160 -99 -300 -503 -129 -379 -223 -464 -551 -426 -59 37 -66 -225 -471 -386 -92 -258 289 -3 -118 196 120 549 95 248 524 372 269 67 -36 -151 -112 -52 419 391 459 -34 -1078 -533 -790 -214 -31 -41 -345 -268 -598 -491 -225 -94 -415 -210 -523 -261 364 670 771 951 739 766 678 141 299 269 785 952 1154 1014 309 -277 89 -5 401 811 100 -125 -166 93 -125 -247 -253 -601 -345 -502 -1031 -1108 -2027 -1982 -680 -674 -208 -39 88 306 261 634 122 589 729 341 353 481 223 -460 -387 -585 -578 124 -571 -1317 -733 -738 -108 477 255 307 249 438 215 411 527 224 232 -13 -401 55 291 371 505 773 319 1186 529 446 98 -279 -174 384 -35 -162 -257 31 -189 -265 -158 -474 -793 SS 20240204T172355.8Z 8800.724952 376 1 48.25 2 55.22 180.78 95.92 241.60 0.00 1 0.00 1 0 17 9.371e-03 5.472e-03 2.209e-03 9.089e-04 2.725377e-01 4.552546e-04 3.284954e-03 -6.000000e+00 5.287365e-03 224.60 -2.00 3.47 -2.00 316.56 0.00e+00 4.162536e-04 5.391471e-05 5.705523e-05 -6.000000e+00 2.296345e-04 276.38 -2.00 20.00 -2.00 315.96 0.00e+00 1.748 0.000 302.00 328.00 3 3.8783e+00 1.1805e-03 2.2027e-02 -6.0000e+00 1.3074e-02 1.4269e-02 1.3229e-03 1.3615e-02 -6.0000e+00 1.4225e-02 -6.5206e-03 7.7935e-04 6.7911e-03 -6.0000e+00 8.4647e-03 -1.2091e-03 3.7542e-04 1.9616e-03 -6.0000e+00 3.6155e-03 1.3782e-03 -3.7218e-04 2.5558e-05 2.2982e-05 -6.0000e+00 2.4931e-04 5.7052e-03 -8.1510e-05 11 1 0 11 8 0 17.01 21.35 0.30 0.00571 0.00291 62 15 1 5 0 778.120 25.90 20.01 21.35 18.21 3.8 960.32 -325 -1690 -1295 -3834 -4079 -2922 -971 -544 578 -1030 -2574 -1865 -749 -580 1036 540 11 661 486 1301 1350 639 1696 315 523 101 -444 -476 -661 -106 1177 1104 1227 -82 -2296 -1196 -1571 -892 18 -392 -936 -529 -846 -433 -192 35 -784 -169 -808 -316 527 694 866 1267 712 895 923 289 399 575 1226 1350 1312 1149 -17 -495 -24 -73 558 1060 127 152 -229 135 -125 -305 -367 -603 -684 -513 -1188 -1225 -1679 -1605 -875 -663 -156 -66 100 224 201 628 238 777 712 424 332 648 193 -469 -363 -584 -530 120 -526 -966 -613 -565 -124 340 101 308 129 334 156 478 482 235 183 -28 -404 5 331 165 489 474 229 928 426 95 137 -266 -158 87 58 -130 -129 94 -103 -264 -40 -311 -370 -45 -267 -214 -627 -598 -424 -141 -80 96 -186 -473 -340 -148 -132 268 145 3 195 150 413 441 209 551 109 191 39 -174 -178 -230 -35 401 410 497 -33 -906 -475 -609 -396 9 -230 -578 -344 -570 -296 -131 23 -529 -110 -521 -202 347 490 613 942 553 709 705 223 319 452 972 1073 1137 1019 -15 -431 -20 -58 460 929 125 150 -229 130 -120 -266 -303 -491 -566 -446 -1118 -1217 -1809 -1726 -991 -769 -192 -80 123 279 234 698 254 781 742 464 386 798 257 -610 -466 -718 -634 144 -653 -1232 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