File name: Pandora32s1_GreenbeltMD_20230830_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230901T083057.8Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230830_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: 20230830 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 20230830T115651.2Z 8642.497814 235 1 48.52 2 74.91 90.58 115.07 268.55 0.00 1 0.00 1 0 17 1.254e-01 8.470e-03 5.805e-02 3.331e-03 4.440120e-01 1.717671e-03 5.114683e-03 -6.000000e+00 7.273340e-02 230.50 -2.00 3.47 -2.00 319.60 0.00e+00 1.650535e-03 5.033366e-04 5.951680e-04 -6.000000e+00 3.267552e-03 289.89 -2.00 20.00 -2.00 318.80 0.00e+00 3.766 0.001 302.00 328.00 3 3.9044e+00 4.9682e-03 4.3855e-02 -6.0000e+00 1.8145e-01 7.4875e-03 5.9113e-03 2.3222e-02 -6.0000e+00 1.9625e-01 7.7154e-03 4.6495e-03 1.1558e-02 -6.0000e+00 1.1686e-01 -8.6213e-03 2.4370e-03 3.5982e-03 -6.0000e+00 4.9670e-02 1.5444e-04 3.7944e-04 9.5471e-05 3.8184e-05 -6.0000e+00 3.3620e-03 2.4282e-02 2.2342e-04 11 9 0 11 4 0 99.97 26.90 0.56 0.02428 0.02713 24 6 1 5 0 2021.240 31.30 25.00 26.90 28.73 3.3 1015.82 23512 -64714 -8055 -19391 -15292 -55788 900000 55270 -17456 8842 -10536 -26817 -2783 -1397 50360 -4217 -253 -3790 -5808 45699 -22615 -9796 12644 -11650 6767 -8538 37246 751 4893 -13275 19422 -4441 3522 -11400 -12722 19 -11297 1122 -5353 5363 -2062 -125 2952 1766 3516 4282 1221 6873 -872 2085 -2338 4259 5605 2048 1516 -2939 -2057 -914 510 901 1991 2190 820 442 -400 -826 368 531 929 -84 -739 -581 -1063 779 -282 -907 -1173 -876 -322 -1034 -601 -1149 -1216 -1290 689 -462 -339 722 442 1146 133 -598 -625 -549 1177 765 713 978 449 -181 -42 -751 -436 -1039 -1374 -898 -611 -299 287 327 44 533 130 490 723 -148 319 -239 374 40 -656 -624 982 454 170 -324 297 595 17 576 -26 -640 -796 280 -323 313 -49 -632 -24 497 102 106 -166 258 -1918 -151 -400 -280 -1421 900000 585 -420 180 -266 -831 -80 -48 1283 -209 -13 -221 -371 1898 -1856 -716 767 -948 501 -773 2242 62 374 -1213 1437 -469 390 -1557 -1714 2 -1551 160 -977 1050 -484 -31 739 459 909 1115 330 1771 -244 584 -730 1372 1923 773 603 -1257 -898 -397 216 375 839 986 411 242 -229 -460 193 276 512 -52 -507 -416 -769 538 -186 -552 -659 -478 -184 -669 -436 -925 -1051 -1165 646 -461 -354 771 475 1200 133 -568 -560 -486 1088 779 800 1198 588 -239 -54 -894 -488 -1181 -1654 -1130 -795 -405 405 491 71 871 211 770 1080 -214 456 -354 577 65 -1076 -1011 1539 696 253 -471 415 837 26 924 -44 -1123 -1431 516 -625 624 -99 -1309 -49 1014 202 203 -312 SS 20230830T123326.8Z 8642.523227 254 1 48.57 2 67.82 96.50 121.76 274.33 0.00 1 0.00 1 0 17 1.147e-02 5.318e-03 1.604e-03 4.242e-04 3.203487e-01 2.157838e-04 3.768429e-03 -6.000000e+00 6.610551e-03 230.50 -2.00 3.47 -2.00 317.58 0.00e+00 5.592444e-04 3.417313e-05 1.476714e-04 -6.000000e+00 2.973503e-04 289.89 -2.00 20.00 -2.00 316.71 0.00e+00 2.626 0.000 302.00 328.00 3 1.4005e+00 5.7627e-04 3.0831e-02 -6.0000e+00 1.6496e-02 1.1451e-03 6.4994e-04 1.6557e-02 -6.0000e+00 1.7841e-02 -4.4979e-03 3.9553e-04 8.0230e-03 -6.0000e+00 1.0653e-02 -1.9731e-03 1.9866e-04 2.2295e-03 -6.0000e+00 4.5418e-03 6.6342e-03 6.5179e-05 1.2001e-05 2.4090e-05 -6.0000e+00 3.0595e-04 2.4869e-02 1.4290e-04 11 1 0 11 4 0 99.92 26.96 0.28 0.02487 0.02536 455 107 1 5 0 106.740 31.30 25.00 26.96 29.83 3.3 1022.69 -2040 -2419 -767 -3827 -4194 -5002 -2789 -1672 -1605 -2488 -3698 -2534 -1615 -199 485 -265 220 604 705 1356 349 452 1021 724 333 -58 -368 -1033 -610 -598 808 605 1339 -1071 -2757 -2299 -2487 -890 -365 -406 -719 -446 -396 -370 318 14 -480 -178 -616 -238 639 843 903 1018 705 964 827 136 422 383 1014 1336 1682 1564 390 96 -127 -145 831 714 316 186 46 149 -115 -304 -735 -1007 -791 -922 -1187 -1285 -1828 -1512 -700 -522 -58 160 294 438 450 496 8 445 416 177 371 540 109 -334 -499 -931 -459 34 -849 -1012 -612 -625 72 427 313 309 322 247 137 389 270 194 84 -113 -323 71 192 243 514 265 221 918 368 242 107 -169 -146 196 -2 -119 63 103 -72 -173 -148 -403 -392 -165 -223 -73 -365 -360 -404 -229 -153 -167 -281 -425 -294 -208 -27 77 -48 42 122 149 298 80 103 235 177 81 -15 -95 -258 -154 -148 209 160 388 -336 -843 -670 -772 -317 -146 -192 -356 -234 -215 -204 174 8 -265 -97 -331 -128 360 483 554 661 479 671 556 93 298 267 717 951 1309 1246 322 75 -98 -108 647 597 279 173 43 136 -103 -247 -573 -744 -605 -753 -1049 -1268 -1862 -1615 -753 -603 -67 193 356 515 517 547 8 456 428 193 432 669 146 -451 -638 -1140 -547 41 -1067 -1300 -820 -842 102 620 486 474 502 363 193 535 367 263 122 -169 -496 107 282 359 721 370 294 1206 520 358 162 -264 -234 313 -3 -206 108 181 -128 -301 -257 -670 -658 SS 20230830T124342.6Z 8642.530354 257 1 48.62 2 65.84 98.23 123.63 276.03 0.00 1 0.00 1 0 17 1.293e-02 5.072e-03 6.643e-03 1.416e-03 2.958649e-01 7.184581e-04 3.464935e-03 -6.000000e+00 7.449300e-03 230.50 -2.00 3.47 -2.00 318.10 0.00e+00 4.525253e-04 1.296997e-04 1.613418e-04 -6.000000e+00 3.350591e-04 289.89 -2.00 20.00 -2.00 317.22 0.00e+00 2.426 0.000 302.00 328.00 3 3.6093e+00 1.9424e-03 2.8493e-02 -6.0000e+00 1.8589e-02 -2.7037e-03 2.2059e-03 1.5317e-02 -6.0000e+00 2.0102e-02 2.0052e-02 1.3884e-03 7.4342e-03 -6.0000e+00 1.2004e-02 -1.3936e-02 7.0942e-04 2.0758e-03 -6.0000e+00 5.1192e-03 9.0965e-04 4.3475e-04 4.0862e-05 2.1938e-05 -6.0000e+00 3.4462e-04 2.4290e-02 2.0193e-04 11 1 0 11 12 0 100.00 27.00 0.33 0.02429 0.02756 241 57 1 5 0 201.730 31.41 25.01 27.00 30.66 3.3 1027.36 3225 -5280 -1369 -5388 -3876 -491 3222 1393 -1331 -1967 -3447 -3577 460 102 689 -644 -153 -448 -98 3596 -1454 813 510 -742 1166 -457 794 202 -382 -704 1637 81 3521 -909 -2295 -1321 -2485 -1791 -1103 -241 -1022 -664 -2461 -585 26 272 -445 788 -1513 -960 127 998 1455 943 790 478 800 161 326 727 1193 1656 1547 1145 363 -439 -168 158 942 636 380 304 22 318 -24 1 -118 -749 -647 -761 -1050 -1372 -1997 -1160 -366 -445 -216 14 378 546 399 228 84 583 460 305 508 427 56 -380 -361 -852 -611 153 -852 -883 -585 -564 129 344 254 346 180 178 215 227 89 1 274 -91 -351 31 240 152 226 305 -31 845 274 279 107 -240 -94 81 -24 -20 113 50 94 -115 -48 -318 -422 202 -402 -105 -417 -269 -31 205 101 -111 -176 -315 -332 45 12 90 -95 -24 -73 -17 618 -270 148 94 -146 240 -100 174 43 -76 -138 331 18 833 -234 -577 -317 -637 -525 -380 -96 -449 -306 -1190 -282 12 131 -215 371 -718 -455 63 520 801 547 475 294 503 102 203 448 746 1094 1101 870 282 -328 -117 107 663 497 323 270 20 277 -20 1 -83 -508 -449 -584 -894 -1272 -1975 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