File name: Pandora32s1_GreenbeltMD_20230825_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230826T124513.0Z 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_20230825_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: 20230825 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 20230825T133410.8Z 8637.565403 142 1 48.45 2 55.42 105.52 155.82 67.54 0.00 1 0.00 1 0 17 1.559e-02 6.455e-03 5.638e-03 2.195e-03 2.238147e-01 1.117610e-03 2.658017e-03 -6.000000e+00 8.997309e-03 230.88 -2.00 3.47 -2.00 316.85 0.00e+00 5.828091e-04 1.454451e-04 6.386965e-05 -6.000000e+00 4.047341e-04 290.24 -2.00 20.00 -2.00 315.99 0.00e+00 1.756 0.000 302.00 328.00 3 5.3313e+00 2.9485e-03 2.0931e-02 -6.0000e+00 2.2470e-02 2.3762e-03 3.3041e-03 1.1587e-02 -6.0000e+00 2.4291e-02 1.7019e-02 1.9303e-03 5.6156e-03 -6.0000e+00 1.4504e-02 -1.2442e-02 9.2516e-04 1.5941e-03 -6.0000e+00 6.1824e-03 3.4709e-04 4.8318e-04 6.2683e-05 1.7687e-05 -6.0000e+00 4.1567e-04 2.5167e-02 2.3753e-04 11 9 0 11 4 0 99.96 27.02 0.10 0.02517 0.02880 46 11 1 5 0 1053.180 31.41 25.00 27.02 30.79 3.2 1027.58 72 -3394 -683 -3046 -152 -7091 7800 5507 789 666 -5155 -2705 296 1219 2567 522 -1164 86 113 3784 -252 -212 1517 -641 623 120 1956 -268 767 -184 2727 -2901 3222 -1534 -1856 -1219 -3573 -1589 -1538 1090 -1872 -266 -1410 -387 41 -356 -100 1039 -1197 -1029 -241 1491 677 1008 855 647 241 -428 528 696 1246 1646 1454 1341 -553 -769 593 616 1121 548 -135 -305 35 -108 53 -361 -261 -618 -1203 -807 -1195 -1255 -1526 -1384 400 -527 -92 174 274 962 574 -113 -482 543 1076 321 285 793 -68 -367 -71 -886 -665 -175 -943 -863 -694 -417 250 400 225 516 232 82 516 104 167 38 22 -70 -446 -176 442 -25 404 -194 519 759 75 411 -21 -371 -387 454 28 226 -43 -354 292 -165 302 -508 -382 10 -539 -110 -480 -21 -971 959 765 128 115 -931 -477 55 254 595 135 -319 24 33 1091 -77 -65 459 -206 208 42 675 -90 240 -56 835 -995 1125 -578 -672 -421 -1325 -657 -743 590 -1127 -165 -905 -249 26 -229 -63 639 -734 -625 -150 970 464 717 626 482 183 -327 396 517 940 1301 1226 1190 -502 -664 472 473 887 478 -128 -300 35 -105 49 -312 -207 -466 -923 -672 -1093 -1236 -1586 -1486 444 -621 -113 219 346 1186 677 -125 -499 538 1092 350 335 995 -90 -488 -90 -1069 -768 -206 -1175 -1125 -933 -577 355 590 344 797 352 119 702 135 215 50 30 -102 -668 -263 647 -35 557 -260 665 965 99 571 -30 -546 -575 686 44 369 -72 -600 498 -279 499 -824 -608 SS 20230825T141112.2Z 8637.591113 164 1 48.92 2 48.63 113.22 149.36 77.21 0.00 1 0.00 1 0 17 8.830e-03 5.630e-03 2.596e-03 1.472e-03 1.975337e-01 7.559471e-04 2.357275e-03 -6.000000e+00 5.094905e-03 230.88 -2.00 3.47 -2.00 315.69 0.00e+00 4.821699e-04 7.609074e-05 3.779729e-05 -6.000000e+00 2.291999e-04 290.24 -2.00 20.00 -2.00 314.92 0.00e+00 1.510 0.000 302.00 328.00 3 5.0826e+00 1.9636e-03 1.8135e-02 -6.0000e+00 1.2724e-02 2.5622e-02 2.1850e-03 1.0176e-02 -6.0000e+00 1.3756e-02 3.2702e-03 1.2513e-03 4.9342e-03 -6.0000e+00 8.2135e-03 -5.7707e-03 5.6868e-04 1.3847e-03 -6.0000e+00 3.5004e-03 5.8975e-04 2.4208e-04 4.1356e-05 1.6603e-05 -6.0000e+00 2.3545e-04 2.5616e-02 2.0087e-04 11 1 0 11 4 0 99.95 27.16 0.63 0.02562 0.02743 25 6 1 5 0 1956.560 31.52 25.01 27.16 31.98 3.2 1033.96 941 -1960 -885 -2359 -1477 -2726 1041 1928 -3 -244 -1779 -1544 -115 -164 1124 352 -565 1074 165 2682 -343 216 1859 -399 1095 309 941 -224 557 -782 1243 544 2583 -1754 -2401 -875 -2846 -778 -986 -457 -1255 -569 -508 -385 -44 262 -191 197 -607 -315 319 771 1168 1076 448 738 310 251 266 349 1016 959 1053 908 -53 -355 -99 -102 670 466 -101 12 -126 466 33 -335 -451 -763 -577 -958 -1021 -994 -1803 -1219 -251 -175 142 305 11 344 474 9 -69 173 933 243 347 639 159 -505 -290 -875 -443 -81 -612 -1061 -528 -579 269 425 228 452 117 290 285 362 327 194 218 -232 -146 -75 375 178 495 105 207 694 217 105 211 -624 -256 267 -60 57 -21 -269 271 -50 146 -380 -547 220 -512 -235 -609 -342 -593 224 452 -1 -68 -495 -425 -33 -53 395 134 -224 429 68 1113 -149 93 790 -178 504 148 448 -103 240 -329 524 243 1202 -867 -1144 -396 -1365 -410 -594 -307 -907 -424 -385 -294 -33 199 -144 144 -437 -224 231 583 914 870 371 617 264 214 224 291 858 844 976 877 -51 -331 -86 -86 578 436 -101 13 -131 475 32 -310 -388 -627 -477 -850 -978 -1012 -1929 -1335 -284 -207 174 383 14 426 562 10 -73 176 965 267 405 790 205 -654 -362 -1043 -508 -94 -750 -1356 -690 -777 368 601 332 663 169 400 373 454 406 247 289 -322 -207 -107 522 242 654 134 256 852 276 139 287 -865 -357 378 -89 86 -32 -420 425 -78 223 -571 -811 SS 20230825T141631.8Z 8637.594813 167 1 27.85 2 47.69 114.44 148.41 78.37 0.00 1 0.00 1 0 17 1.335e-02 6.619e-03 4.760e-03 2.528e-03 1.934216e-01 1.294756e-03 2.319059e-03 -6.000000e+00 7.702643e-03 230.88 -2.00 3.47 -2.00 315.93 0.00e+00 4.694586e-04 1.368594e-04 2.765331e-05 -6.000000e+00 3.465073e-04 290.24 -2.00 20.00 -2.00 315.13 0.00e+00 1.483 0.000 302.00 328.00 3 5.4611e+00 3.3728e-03 1.7813e-02 -6.0000e+00 1.9237e-02 1.5030e-02 3.7576e-03 1.0013e-02 -6.0000e+00 2.0796e-02 8.0948e-03 2.1562e-03 4.8567e-03 -6.0000e+00 1.2417e-02 -7.7344e-03 9.8899e-04 1.3740e-03 -6.0000e+00 5.2923e-03 4.1923e-04 3.0168e-04 7.1358e-05 1.6327e-05 -6.0000e+00 3.5593e-04 2.5527e-02 2.1543e-04 12 9 1 12 5 1 99.99 27.18 0.55 0.02553 0.02779 15 7 1 5 0 1730.160 31.52 25.01 27.18 32.15 3.2 1034.94 776 -4681 1495 -4234 1044 -3522 5623 1871 -2342 1830 -3200 -1262 1030 1449 1977 -224 34 656 1110 4270 -284 -796 1698 2 1113 -480 1829 -1150 319 -520 3610 -178 2072 -1281 -4142 -862 -3636 -1833 -1262 -764 -1277 -462 -711 -849 82 431 -576 951 -1103 326 -727 490 1285 727 713 128 772 -130 793 514 1655 1276 1365 898 -56 -552 122 -251 691 442 149 -213 -365 43 49 28 -482 -467 -904 -477 -1246 -1094 -1552 -1189 169 -451 -20 314 -99 431 325 395 81 429 1163 262 732 622 343 -481 -487 -890 -470 66 -843 -698 -581 -387 -227 251 272 681 195 604 307 82 124 38 -62 -196 -349 -187 278 -68 171 -49 158 784 7 665 7 -423 -531 418 -154 388 -23 -100 167 146 -159 -78 -581 166 -1149 357 -1020 216 -705 1060 401 -579 460 -831 -320 273 426 642 -80 13 246 426 1638 -116 -324 679 1 483 -218 817 -504 130 -205 1402 -75 912 -596 -1891 -367 -1657 -924 -730 -497 -896 -334 -525 -634 61 318 -423 672 -773 223 -515 361 979 575 577 105 642 -108 651 420 1364 1103 1246 858 -54 -509 105 -208 585 407 148 -219 -378 44 48 26 -407 -374 -733 -415 -1181 -1107 -1649 -1297 191 -536 -25 396 -126 537 387 443 85 432 1192 287 852 772 446 -628 -613 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