File name: Pandora32s1_GreenbeltMD_20240626_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240627T051701.0Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240626_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: 20240626 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 20240626T103039.4Z 8943.437956 188 1 49.58 2 82.76 65.75 56.58 203.91 0.00 1 0.00 1 0 25 5.972e-01 3.573e-02 2.956e-01 1.757e-02 8.739239e-01 1.002233e-02 1.008110e-02 -6.000000e+00 3.557172e-01 232.76 -2.00 3.47 -2.00 321.98 0.00e+00 5.138085e-03 4.666134e-03 6.292330e-03 -6.000000e+00 1.620663e-02 288.51 -2.00 20.00 -2.00 321.43 0.00e+00 7.305 0.007 302.00 328.00 3 2.2495e+00 3.6404e-02 9.1515e-02 -6.0000e+00 8.9196e-01 1.3798e+00 4.3258e-02 5.8826e-02 -6.0000e+00 9.6364e-01 -1.8740e+00 2.6121e-02 2.3964e-02 -6.0000e+00 5.7143e-01 7.4416e-01 1.3811e-02 6.5511e-03 -6.0000e+00 2.4105e-01 1.5324e-05 -4.9524e-04 4.7384e-04 1.3234e-04 -6.0000e+00 1.6394e-02 1.1514e-02 9.5211e-06 12 8 8 10 0 0 76.97 22.56 1.36 0.01151 0.00779 17 4 1 5 0 2916.430 26.94 20.00 22.56 29.43 4.7 1035.17 64388 55079 -31611 208210 -3641 -68905 900000 900000 20205 -32611 -20507 -72910 83615 48509 26411 210666 21716 20005 38337 900000 47289 -30371 361120 -3918 131964 -20204 900000 47891 81296 -69024 37829 14984 -9159 31162 123529 29107 -23293 10513 -31793 93362 64795 78346 190219 145441 51795 12899 171642 900000 85886 72070 58683 78786 37173 44185 40909 21032 27730 28579 68212 22400 91900 30581 5303 16626 3483 10960 7551 35516 21946 -30331 8834 6579 45445 10265 14898 -23069 -14806 -11987 -9749 11645 -1414 29307 12478 -2265 8666 5225 -7099 2380 -16705 -472 -1801 13468 -6650 780 859 1087 -955 1 -3693 -930 -1018 -4892 -4778 -8314 -6401 1273 1868 -8255 -2815 1184 -822 2388 182 1095 2587 106 1279 -2457 -1721 1382 61 372 4423 3684 1986 34 1378 858 1468 286 1083 -2097 -483 1801 518 1562 -566 -2775 -92 -454 942 -80 -652 2732 2776 -3614 3565 -229 -6768 900000 900000 756 -1977 -1044 -6225 1785 1790 1439 3607 1506 1449 2333 900000 2394 -2957 6182 -274 2424 -1616 900000 1689 1899 -7048 1558 914 -797 1915 2844 1530 -2024 725 -3819 3801 3797 4164 3379 3960 3424 1216 3384 900000 4090 4109 4128 5005 3810 4498 4476 2834 3514 3482 5347 2565 5275 3372 840 2670 685 1997 1393 5134 3924 -10141 2241 1768 8277 2441 3043 -6002 -3266 -2601 -2304 2693 -438 7829 4361 -966 3527 2314 -3706 1168 -9798 -231 -838 5128 -2970 337 420 625 -657 1 -3378 -858 -902 -4061 -3555 -6236 -4992 987 1519 -7921 -2851 1318 -1059 3264 264 1571 3543 144 1731 -3601 -2645 2159 95 559 6146 5017 2690 45 1779 1155 2230 506 2125 -4568 -1101 4291 1331 4188 -1581 -7949 -260 -1238 2389 -191 -1490 SS 20240626T104139.7Z 8943.445599 191 1 48.66 2 80.79 67.36 57.43 206.85 0.00 1 0.00 1 0 25 5.423e-01 1.678e-02 2.185e-01 6.261e-03 8.035631e-01 3.481992e-03 8.928464e-03 -6.000000e+00 3.173798e-01 232.76 -2.00 3.47 -2.00 321.63 0.00e+00 1.577659e-03 1.882857e-03 2.466362e-03 -6.000000e+00 1.405242e-02 288.51 -2.00 20.00 -2.00 321.06 0.00e+00 5.931 0.004 302.00 328.00 3 2.2901e+00 1.2940e-02 7.3768e-02 -6.0000e+00 7.9664e-01 4.5102e-01 1.8111e-02 4.6034e-02 -6.0000e+00 8.6020e-01 -7.1590e-01 1.6639e-02 2.3807e-02 -6.0000e+00 5.1077e-01 2.9833e-01 7.6664e-03 6.9107e-03 -6.0000e+00 2.1598e-01 6.6620e-05 -8.8299e-04 1.6561e-04 9.4295e-05 -6.0000e+00 1.4555e-02 1.2289e-02 -8.5146e-05 12 8 8 10 0 0 92.42 22.58 0.83 0.01229 0.00565 37 9 1 5 0 1315.070 26.94 20.00 22.58 29.94 4.6 1037.12 -145374 -98180 -144667 -140382 -126941 -186427 900000 -82221 -160252 -183622 -211701 -155538 -101841 -56926 40375 -325 -59191 -21975 -20934 37953 -47226 -56168 75110 -41938 -31624 -41531 283001 -32467 650 -79511 -13813 -29272 16412 -11215 3736 5942 -12767 -8948 -27043 2232 12431 26189 13423 49410 26214 5115 24033 51549 15354 8453 -6745 41466 23043 28521 18240 7111 10464 14813 17458 6141 7532 6110 13152 13867 2574 7016 3576 14613 7827 -1941 9468 7698 4760 6062 2763 1732 -4083 -3815 -4423 -1342 -3041 1986 -1156 -2712 2591 -1762 -568 -423 367 3028 -169 3288 -1001 -1864 -2416 -842 -1444 1170 -2011 -2098 -1551 -2044 -2204 -2208 -2157 -2076 -1692 -893 -779 -323 -181 -288 715 247 148 631 5 -244 -352 408 257 1448 1443 771 1164 255 957 766 383 1155 393 342 -340 428 141 -88 248 -322 -163 -242 95 -512 -1184 -1856 -926 -2328 -2104 -1480 -3621 900000 -703 -3024 -4688 -7402 -3367 -1741 -799 271 -4 -1482 -416 -422 440 -1297 -1646 596 -1152 -850 -1293 1728 -892 12 -3495 -371 -1126 471 -466 130 192 -522 -410 -1816 135 774 1535 934 2443 1632 397 1570 2644 1191 753 -708 3342 2251 2881 2187 999 1469 1990 2199 832 1007 895 2051 2463 559 1464 762 2879 1816 -575 2806 2453 1556 1847 791 446 -1027 -963 -1254 -443 -1222 883 -594 -1519 1465 -1110 -342 -264 227 1933 -105 1845 -565 -1096 -1609 -596 -1211 1112 -2209 -2382 -1669 -1984 -1921 -1877 -1952 -2007 -1720 -967 -930 -438 -257 -447 1133 388 223 910 7 -370 -567 682 427 2280 2169 1132 1647 351 1372 1135 598 2070 796 698 -741 991 352 -217 627 -830 -419 -602 235 -1186 -2622 SS 20240626T105211.7Z 8943.452914 196 1 48.46 2 78.90 68.88 58.33 209.60 0.00 1 0.00 1 0 17 4.816e-01 1.048e-02 7.938e-02 2.596e-03 7.009154e-01 1.408378e-03 7.992943e-03 -6.000000e+00 2.799932e-01 232.76 -2.00 3.47 -2.00 321.08 0.00e+00 3.507733e-03 6.612105e-04 2.522946e-03 -6.000000e+00 1.241192e-02 288.51 -2.00 20.00 -2.00 320.45 0.00e+00 5.006 0.002 302.00 328.00 3 1.8647e+00 4.7643e-03 6.2913e-02 -6.0000e+00 7.0299e-01 1.3848e-01 6.4285e-03 3.9606e-02 -6.0000e+00 7.5888e-01 -2.6048e-01 6.0938e-03 2.0655e-02 -6.0000e+00 4.5188e-01 1.0416e-01 2.9216e-03 6.2930e-03 -6.0000e+00 1.9176e-01 2.7649e-04 -7.5063e-04 6.9965e-05 8.7592e-05 -6.0000e+00 1.2843e-02 1.1545e-02 -6.9494e-05 12 8 8 10 0 0 69.19 22.61 0.62 0.01155 0.00590 97 23 1 5 0 499.470 26.94 20.00 22.61 30.31 4.7 1039.48 -156375 -158604 -156099 -114971 -186933 -155674 -109618 -160106 -152246 -171684 -139934 -162086 -64863 -95355 -54922 -23827 -47984 -1857 -34780 -9737 -49353 -32815 -11963 -46396 -9657 -32184 2573 -28086 -16399 -35764 -28275 -7092 -14123 -4853 -13178 -1765 -18257 -12229 -2030 2494 12728 7429 -5602 11606 6870 5396 10273 11838 4613 -706 9641 7172 7288 7532 7719 5223 3565 5421 1815 4544 4397 3047 5671 4671 4609 1968 2967 3727 3338 1166 2244 972 667 1154 -721 -1301 -1469 -1959 -3008 -1378 -303 -993 -1947 -846 -503 -188 -580 -187 776 925 617 478 -384 -808 -1073 -704 -377 264 -548 -696 -644 -1507 -1586 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