File name: Pandora32s1_GreenbeltMD_20240507_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240511T132214.2Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240507_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: 20240507 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 20240507T142953.1Z 8893.604087 201 1 48.60 2 40.00 112.19 35.13 120.87 0.00 1 0.00 1 0 17 7.771e-03 5.938e-03 2.789e-04 1.760e-04 1.894645e-01 9.079831e-05 2.260902e-03 -6.000000e+00 4.490798e-03 230.59 -2.00 3.47 -2.00 315.27 0.00e+00 3.671634e-04 8.183993e-06 3.633063e-05 -6.000000e+00 1.962893e-04 283.64 -2.00 20.00 -2.00 314.64 0.00e+00 1.304 0.000 302.00 328.00 3 1.1430e+00 2.3462e-04 1.6242e-02 -6.0000e+00 1.1234e-02 7.0858e-03 2.6025e-04 9.6830e-03 -6.0000e+00 1.2149e-02 9.1171e-04 1.4891e-04 4.7149e-03 -6.0000e+00 7.2268e-03 -4.0427e-03 6.6619e-05 1.3164e-03 -6.0000e+00 3.0726e-03 3.7694e-02 1.9280e-04 4.9092e-06 1.6291e-05 -6.0000e+00 2.0700e-04 6.7034e-04 7.2059e-05 10 0 0 10 0 0 99.97 22.41 0.31 0.00067 0.00212 1997 468 1 5 0 24.330 26.73 20.02 22.41 31.28 4.5 1050.02 393 -158 -185 -1480 -2378 -1833 -1013 290 833 7 -1443 -1158 -341 -118 406 303 76 465 858 922 1187 539 1167 1038 571 450 20 -500 -480 -45 688 833 1245 -254 -2349 -2203 -2237 -1297 -423 -291 -671 -515 -450 -567 -129 -167 -483 -547 -674 -537 338 657 684 1018 744 836 963 314 469 352 903 1216 1530 1560 602 -137 -354 -601 175 666 282 318 302 365 219 -214 -703 -1218 -1214 -945 -1301 -1274 -1681 -1615 -756 -543 -30 317 413 591 348 384 -325 -3 147 6 347 625 516 -27 -187 -753 -828 -196 -625 -915 -587 -468 -69 475 510 562 423 344 1 40 -108 36 47 183 -135 213 314 265 407 334 -16 536 279 126 103 -153 -277 -11 44 13 25 270 156 -86 -86 -438 -745 105 -47 -57 -448 -645 -486 -268 84 248 2 -467 -365 -113 -44 158 130 34 212 401 443 585 266 569 490 286 235 11 -253 -240 -21 323 414 617 -134 -1205 -1135 -1117 -733 -266 -203 -492 -397 -356 -455 -103 -133 -378 -413 -520 -405 259 504 554 860 617 703 824 271 398 295 764 1085 1397 1519 602 -129 -317 -535 150 634 285 323 312 368 220 -206 -608 -1025 -1017 -866 -1274 -1309 -1773 -1781 -836 -645 -37 397 522 729 422 443 -341 -3 153 7 392 777 661 -35 -231 -898 -970 -230 -761 -1145 -765 -608 -93 645 729 819 600 474 1 50 -134 45 61 247 -190 300 432 351 535 417 -20 642 350 162 139 -203 -373 -15 64 19 38 405 238 -130 -132 -646 -1071 SS 20240507T144916.1Z 8893.617547 214 1 34.30 2 36.58 117.23 32.01 126.83 0.00 1 0.00 1 0 17 7.622e-03 5.995e-03 1.881e-04 1.307e-04 1.820612e-01 6.763591e-05 2.178761e-03 -6.000000e+00 4.404582e-03 230.59 -2.00 3.47 -2.00 314.83 0.00e+00 3.444533e-04 5.615565e-06 2.449502e-05 -6.000000e+00 1.925130e-04 283.64 -2.00 20.00 -2.00 314.24 0.00e+00 1.244 0.000 302.00 328.00 3 3.5526e-01 1.7410e-04 1.5539e-02 -6.0000e+00 1.1018e-02 4.5431e-03 1.9263e-04 9.3021e-03 -6.0000e+00 1.1916e-02 -1.1431e-04 1.1037e-04 4.5350e-03 -6.0000e+00 7.0880e-03 -3.4861e-03 4.8635e-05 1.2691e-03 -6.0000e+00 3.0137e-03 8.9260e-02 1.1274e-04 3.6314e-06 1.6108e-05 -6.0000e+00 2.0301e-04 4.7159e-04 7.4202e-05 12 1 1 12 1 1 99.62 22.57 0.33 0.00047 0.00132 1635 544 1 5 0 20.960 26.94 19.99 22.57 31.44 4.3 1044.95 333 -325 -292 -1461 -2263 -1659 -871 331 792 -56 -1327 -1058 -353 -101 456 360 136 579 974 976 1249 581 1197 1166 592 500 54 -420 -392 33 759 891 1282 -220 -2260 -2136 -2126 -1287 -372 -330 -743 -576 -477 -610 -227 -211 -518 -606 -637 -559 331 615 667 1017 732 865 930 327 466 395 851 1215 1500 1491 593 -116 -321 -510 188 660 264 300 292 332 228 -158 -617 -1077 -1122 -886 -1281 -1244 -1685 -1651 -810 -606 -96 238 334 546 309 403 -266 51 199 76 357 587 471 -35 -202 -692 -778 -131 -607 -932 -620 -503 -144 418 448 473 390 357 31 73 -37 94 82 169 -146 194 282 275 448 421 67 644 356 202 148 -86 -222 12 33 -41 -18 211 82 -120 -102 -453 -744 112 -114 -106 -514 -763 -503 -263 109 292 -21 -495 -384 -135 -43 205 178 66 284 491 506 663 309 629 633 321 283 31 -230 -210 16 379 472 723 -124 -1318 -1167 -1204 -779 -253 -239 -572 -466 -396 -514 -190 -176 -424 -480 -509 -436 261 491 562 855 636 763 834 295 414 346 755 1088 1447 1472 599 -110 -300 -447 167 626 269 310 307 341 231 -152 -555 -932 -965 -796 -1244 -1280 -1798 -1774 -915 -709 -114 296 420 669 369 453 -282 52 206 83 410 714 597 -45 -246 -808 -882 -149 -723 -1153 -799 -653 -194 570 622 670 536 472 40 90 -45 116 105 225 -198 263 386 363 579 536 81 780 434 254 196 -113 -295 16 46 -59 -27 309 122 -176 -150 -646 -1067 SS 20240507T145417.6Z 8893.621037 217 1 17.98 2 35.71 118.64 31.24 128.52 0.00 1 0.00 1 0 17 8.595e-03 6.305e-03 2.954e-03 1.906e-03 1.842320e-01 9.840550e-04 2.198497e-03 -6.000000e+00 4.967747e-03 230.59 -2.00 3.47 -2.00 315.15 0.00e+00 2.643763e-04 8.658855e-05 2.968712e-05 -6.000000e+00 2.170719e-04 283.64 -2.00 20.00 -2.00 314.53 0.00e+00 1.231 0.000 302.00 328.00 3 4.8600e+00 2.5413e-03 1.5506e-02 -6.0000e+00 1.2427e-02 3.6327e-02 2.8171e-03 9.4047e-03 -6.0000e+00 1.3438e-02 -3.3644e-03 1.6125e-03 4.5891e-03 -6.0000e+00 7.9940e-03 -2.1775e-03 7.1800e-04 1.2791e-03 -6.0000e+00 3.3994e-03 9.8425e-04 2.2017e-04 5.3138e-05 1.5993e-05 -6.0000e+00 2.2892e-04 3.9168e-04 1.1692e-04 12 1 1 12 1 1 99.98 22.60 0.40 0.00039 0.00205 14 10 1 5 0 1198.310 26.94 20.01 22.60 31.35 4.5 1048.47 518 -427 -71 -2363 -2672 -1549 -260 1306 431 -627 -1914 -1830 -1122 -222 367 574 286 380 1409 1319 1289 803 1039 722 285 717 329 -229 -373 307 1226 652 1687 247 -2477 -2053 -2717 -1390 -583 -85 -753 -482 -597 -436 263 -186 -455 -559 -788 -1143 2 463 858 1218 634 1117 747 524 419 189 884 1182 1542 1456 258 -282 -609 -358 -51 677 570 -6 317 380 139 -215 -698 -807 -1196 -861 -1290 -1048 -1701 -1746 -609 -488 -71 386 503 481 405 599 -454 -317 162 -48 85 633 533 211 59 -875 -1133 -306 -617 -657 -705 -453 3 441 587 428 303 430 -27 222 -167 -319 -21 58 46 38 456 165 616 543 -30 632 240 373 54 -152 -418 71 139 80 72 186 140 -85 -24 -518 -909 148 -135 -23 -755 -781 -412 -69 370 136 -211 -645 -606 -387 -83 150 251 130 175 658 630 628 392 505 360 148 383 177 -120 -184 145 575 320 867 133 -1311 -1034 -1412 -787 -372 -60 -577 -382 -482 -354 212 -150 -365 -437 -603 -865 2 366 702 1024 546 970 658 463 366 164 773 1068 1461 1435 259 -272 -553 -312 -45 637 574 -7 334 396 140 -205 -622 -682 -1006 -768 -1238 -1068 -1820 -1919 -689 -577 -87 483 632 599 486 679 -486 -325 167 -52 98 770 677 271 73 -1042 -1299 -352 -743 -825 -909 -597 4 610 836 616 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