File name: Pandora32s1_GreenbeltMD_20240809_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240821T144556.4Z 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_20240809_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: 20240809 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 20240809T112510.7Z 8987.475818 69 1 47.76 2 77.89 79.59 130.48 58.96 0.00 1 0.00 1 0 25 6.270e-01 3.686e-02 3.277e-01 1.942e-02 5.447847e-01 1.106407e-02 7.127930e-03 -6.000000e+00 3.819254e-01 231.81 -2.00 3.47 -2.00 320.91 0.00e+00 1.661542e-02 4.740163e-03 3.672848e-03 -6.000000e+00 1.979698e-02 290.80 -2.00 20.00 -2.00 320.21 0.00e+00 4.623 0.002 302.00 328.00 3 5.2284e+00 3.6649e-02 5.4532e-02 -6.0000e+00 9.6996e-01 2.9958e-01 4.5808e-02 2.9096e-02 -6.0000e+00 1.0616e+00 -4.3856e-01 3.7951e-02 2.1733e-02 -6.0000e+00 6.1565e-01 2.0171e-01 1.8969e-02 1.4239e-02 -6.0000e+00 2.5769e-01 1.4710e-05 -2.0802e-04 5.9749e-04 1.8681e-04 -6.0000e+00 1.7968e-02 7.5020e-03 1.6254e-04 12 8 8 10 0 0 99.99 21.81 1.73 0.00750 0.00594 18 4 1 5 0 2652.920 25.90 20.00 21.81 30.43 5.0 1037.39 900000 105628 175797 900000 -178778 -55251 900000 900000 900000 4188 900000 48673 900000 900000 -34074 900000 229068 900000 900000 900000 142200 900000 900000 37522 140268 -66335 900000 30936 419830 174068 -943 900000 900000 32770 68466 900000 131599 -49999 -1827 -14816 24279 60429 60851 103261 19369 -6347 34749 148053 -8787 29013 19766 33164 14492 6472 32189 -9148 -11630 10673 15722 42169 12451 39371 17083 16242 -1346 -3007 -4676 17353 -6120 7408 -6462 -2319 -408 -1799 1547 -471 -12122 2485 8315 761 6792 3529 7505 -5002 1911 -2668 -9154 -756 -2795 6578 -537 8336 -7136 304 -2836 -148 -7684 271 -3123 -1399 2349 -1265 2398 -1375 -4614 -4205 -2001 2453 421 1278 725 324 1813 -851 2600 -388 571 -2842 -1053 1961 -2352 -525 3228 3641 615 -199 -754 1419 1230 620 1581 -2107 239 1510 3879 1610 -627 -3919 -617 105 1383 -588 -1823 900000 1993 3317 900000 -15337 -1324 900000 900000 900000 79 900000 918 900000 900000 -1375 900000 4323 900000 900000 900000 2683 900000 900000 1203 2647 -5620 900000 1034 7922 3285 -51 900000 900000 1926 2798 900000 2846 -6646 -180 -1898 2383 4511 4753 5662 2392 -1024 3939 5942 -1563 3749 2975 4820 2701 1381 5619 -2378 -3121 2302 3172 6577 2647 7082 4251 4554 -474 -1063 -1604 4791 -2226 2678 -2951 -1070 -185 -796 617 -174 -4573 799 2713 310 3041 1842 4136 -3267 1240 -1921 -7393 -588 -2238 4738 -390 5210 -4825 190 -1965 -114 -7261 271 -3545 -1605 2493 -1268 2125 -1248 -4583 -4443 -2176 2713 509 1685 1051 498 2773 -1290 3616 -528 765 -4083 -1577 3016 -3813 -821 4725 5146 862 -270 -991 1841 1739 980 2692 -3905 449 2939 7823 3481 -1418 -9255 -1426 236 2938 -1206 -3636 SS 20240809T212937.2Z 8987.895569 474 1 48.53 2 60.40 266.30 48.08 191.48 0.00 1 0.00 1 0 17 3.733e-02 9.842e-03 2.213e-02 5.237e-03 2.638260e-01 2.671315e-03 3.087351e-03 -6.000000e+00 2.167442e-02 231.79 -2.00 3.47 -2.00 317.90 0.00e+00 5.416634e-04 4.558717e-04 1.115471e-04 -6.000000e+00 9.720754e-04 290.81 -2.00 20.00 -2.00 317.01 0.00e+00 2.015 0.000 302.00 328.00 3 6.0885e+00 7.1985e-03 2.4286e-02 -6.0000e+00 5.4244e-02 2.6651e-02 8.1451e-03 1.3713e-02 -6.0000e+00 5.8536e-02 4.3244e-02 5.0315e-03 6.6429e-03 -6.0000e+00 3.4939e-02 -2.7190e-02 2.5460e-03 1.8848e-03 -6.0000e+00 1.4922e-02 1.1535e-04 8.0141e-04 1.5182e-04 1.9968e-05 -6.0000e+00 9.9490e-04 3.0087e-03 1.3504e-04 12 8 8 10 0 0 99.99 21.85 0.13 0.00301 0.00903 58 14 1 5 0 836.570 25.90 20.00 21.85 32.22 4.9 1047.29 15225 -9885 8481 -3846 -9258 17741 -591 11581 -4945 9985 2794 -5081 15209 -2584 469 -535 2605 6261 216 7181 -4374 5083 1210 358 -39 -1975 9081 -5388 5542 -4510 -456 1170 -2566 2662 -3607 495 -5169 229 -2699 -3179 2640 -1697 -2470 -22 -1385 -1036 -1458 2293 -4119 -1425 -3401 2254 1510 900 2371 -2831 1534 -475 1509 774 -536 3350 1772 2344 463 -2042 107 -1448 1596 2065 375 -988 -176 1170 -368 1269 -2284 -56 -1031 -704 914 -1644 199 -2370 522 -217 -786 1460 -532 1091 467 1748 -522 -924 713 -1127 591 160 760 87 -438 213 -1701 338 -1303 -702 -522 -657 629 185 500 532 420 932 -447 177 -983 -135 -619 -93 -37 -344 472 -369 476 239 -412 -74 19 720 -698 -634 -241 288 1317 -262 543 -285 -221 66 -36 305 -495 1021 -934 713 -354 -814 1139 -46 890 -496 940 283 -554 1499 -342 69 -88 444 1070 41 1320 -925 987 245 76 -9 -479 2018 -1319 1153 -995 -100 274 -676 704 -977 123 -1414 68 -979 -1354 1182 -836 -1265 -11 -716 -535 -750 1116 -2088 -702 -1768 1192 853 537 1449 -1848 985 -312 960 489 -349 2229 1290 1818 373 -1602 76 -1000 1109 1588 322 -902 -162 1039 -315 984 -1657 -37 -701 -526 752 -1516 193 -2450 555 -247 -948 1790 -668 1327 540 1857 -520 -880 690 -1200 679 201 1017 118 -571 257 -1964 387 -1612 -916 -706 -923 908 283 799 869 673 1415 -641 238 -1307 -184 -891 -142 -58 -540 720 -550 677 327 -542 -96 26 1031 -1060 -988 -379 464 2204 -465 982 -528 -414 122 -65 529 -845 SS 20240809T213739.4Z 8987.901150 480 1 49.57 2 61.96 267.61 48.45 194.06 0.00 1 0.00 1 0 17 3.056e-02 9.240e-03 2.044e-02 4.924e-03 2.786678e-01 2.514989e-03 3.267912e-03 -6.000000e+00 1.774801e-02 231.79 -2.00 3.47 -2.00 317.84 0.00e+00 -3.192841e-04 4.235641e-04 2.386475e-04 -6.000000e+00 7.957760e-04 290.81 -2.00 20.00 -2.00 316.96 0.00e+00 2.116 0.000 302.00 328.00 3 6.1460e+00 6.7658e-03 2.5560e-02 -6.0000e+00 4.4418e-02 4.2567e-02 7.6521e-03 1.4529e-02 -6.0000e+00 4.7929e-02 2.1603e-02 4.7230e-03 6.9949e-03 -6.0000e+00 2.8608e-02 -1.3790e-02 2.3878e-03 1.9375e-03 -6.0000e+00 1.2221e-02 9.6549e-05 8.9913e-04 1.4193e-04 2.0706e-05 -6.0000e+00 8.1448e-04 2.1365e-03 1.5500e-04 11 8 0 10 0 0 99.99 21.86 0.24 0.00214 0.00889 22 5 1 5 0 2252.800 25.90 20.00 21.86 32.53 4.9 1048.45 4331 1613 4572 7385 -12969 -12992 9717 10217 148 -6591 -4313 -6956 5140 4785 -6293 3574 1375 4314 3090 3407 -794 -2502 6623 -2423 -3830 2108 6302 -1929 1053 -5458 1749 912 639 -3124 -2538 -1522 -8385 -3895 -2333 -630 49 -2425 -359 1004 1862 -1622 -81 2750 -887 935 -2189 2449 243 1061 1920 -711 1232 -1664 1409 1096 1506 1206 1527 2951 371 -1474 -861 -619 -1622 1372 336 -116 630 121 1776 21 -2774 -2411 -1732 284 -736 -787 109 -1509 -15 -508 -1098 719 -28 934 642 1678 -1260 515 165 411 -541 1219 219 -525 -267 -790 -1625 -549 -1260 -933 -35 337 -813 290 916 744 686 511 -294 12 45 -871 -261 616 -519 -31 204 599 843 -460 -258 344 -159 525 -150 -933 -371 298 788 436 165 -761 639 239 203 -173 -1153 314 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