File name: Pandora32s1_GreenbeltMD_20240426_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240429T095059.3Z 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_20240426_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: 20240426 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 20240426T110757.3Z 8882.463858 214 1 48.62 2 80.85 79.66 87.78 233.80 0.00 1 0.00 1 0 17 4.713e-01 2.375e-02 2.520e-01 9.158e-03 1.022474e+00 5.236292e-03 1.122805e-02 -6.000000e+00 2.730775e-01 229.71 -2.00 3.47 -2.00 322.10 0.00e+00 6.365813e-03 2.918764e-03 1.840332e-03 -6.000000e+00 1.212911e-02 282.45 -2.00 20.00 -2.00 321.64 0.00e+00 5.971 0.004 302.00 328.00 3 2.2864e+00 1.9933e-02 8.1377e-02 -6.0000e+00 6.8356e-01 1.1142e+00 2.6824e-02 5.6504e-02 -6.0000e+00 7.4178e-01 -1.5280e+00 2.3516e-02 2.9951e-02 -6.0000e+00 4.3909e-01 6.2475e-01 1.0981e-02 1.1713e-02 -6.0000e+00 1.8534e-01 4.2727e-05 -1.8696e-03 2.2342e-04 1.6637e-04 -6.0000e+00 1.2836e-02 1.1147e-02 -1.3683e-04 12 8 8 10 0 0 99.35 20.86 0.79 0.01115 -0.00290 54 13 1 5 0 900.290 25.47 20.00 20.86 10.04 4.4 927.22 -103086 -102627 -79163 -86611 -86340 -136886 10730 900000 -132516 15468 -103443 -171711 900000 -90333 900000 9198 -65627 65546 208552 900000 -71810 -46148 40782 -63178 63962 -64225 22298 -53640 -69429 -90540 23090 -5767 41394 49604 32563 13027 16015 -13394 48 98015 66000 41891 2925 126012 46802 88758 35063 68361 21244 14172 38404 45347 43407 55992 42783 19739 42486 28906 32154 20254 30132 21898 27963 26491 18398 16587 23856 17947 10075 25884 9938 15169 18559 14451 -1428 7406 99 -7485 150 -228 1486 3318 645 4434 4512 2073 4058 2489 2864 1158 438 3663 -2494 -7786 -6904 -5037 -1506 -1544 -1886 -3701 -2378 -3070 -4413 -3786 -3528 -3908 -2145 -2611 -3180 -1662 -2535 429 -12 -1397 177 -108 611 34 751 -145 1555 2717 2039 3473 1631 1057 1621 1715 -449 2246 1321 -389 -157 203 1053 191 -293 -412 38 -135 -198 -1221 -1560 -2530 -2900 -1825 -1997 -1669 -3767 96 900000 -3449 138 -2182 -7023 900000 -2687 900000 172 -2684 851 1861 900000 -3364 -1685 596 -2665 778 -2814 398 -1915 -2760 -4701 468 -197 1041 1248 925 412 494 -619 2 2067 2142 1835 195 2454 1974 2448 1678 2440 1293 1000 2368 2943 3169 3907 3610 1982 3757 2861 2896 1923 2542 2150 2972 3054 2559 2405 3229 2696 1806 4562 2284 3452 4003 2998 -308 1278 17 -1419 30 -57 441 1138 257 1823 1956 970 1943 1244 1419 562 201 1531 -1087 -3781 -3845 -3067 -1064 -1290 -1797 -3750 -2269 -2620 -3336 -2695 -2628 -3112 -1771 -2343 -3224 -1944 -3485 595 -18 -2091 254 -150 911 50 1144 -231 2367 4135 2942 4782 2223 1404 2077 2292 -714 3842 2617 -864 -375 487 2694 522 -819 -1157 104 -358 -484 -2923 -3497 SS 20240426T111637.7Z 8882.469880 219 1 10.93 2 79.19 80.97 89.12 235.14 0.00 1 0.00 1 0 17 5.514e-01 1.874e-02 3.586e-01 1.106e-02 8.937629e-01 6.146548e-03 1.050919e-02 -6.000000e+00 3.188458e-01 229.71 -2.00 3.47 -2.00 321.54 0.00e+00 7.824991e-03 3.206217e-03 6.381513e-03 -6.000000e+00 1.400440e-02 282.45 -2.00 20.00 -2.00 321.05 0.00e+00 5.135 0.002 302.00 328.00 3 2.5623e+00 2.1739e-02 7.4618e-02 -6.0000e+00 7.9779e-01 5.3580e-01 3.0439e-02 5.7321e-02 -6.0000e+00 8.6492e-01 -7.2042e-01 3.0385e-02 3.1789e-02 -6.0000e+00 5.1199e-01 2.9863e-01 1.4194e-02 1.0792e-02 -6.0000e+00 2.1875e-01 8.6601e-05 -5.9552e-04 2.7491e-04 2.0589e-04 -6.0000e+00 1.4964e-02 1.0181e-02 2.0289e-05 12 9 9 12 1 1 99.79 20.86 0.52 0.01018 0.00571 7 8 1 5 0 1365.610 25.47 20.01 20.86 10.22 4.4 928.64 900000 -187189 -212128 -118275 -100422 -230083 -84722 -238821 900000 -169501 -61288 -155993 8028 -39798 -1811 -37671 -117660 -67680 92977 83795 15355 -74350 -37165 -105210 -89768 -19082 -62914 106282 -89615 -58787 900000 -48257 41585 -7363 -22822 -41709 -17312 42070 -19526 62563 30847 69324 -7181 54034 55043 29667 4229 60391 28886 21384 1329 44636 6257 29096 10782 17450 13180 15481 11840 2071 15149 12920 10266 9729 7070 10600 15021 12940 2591 12788 4022 4427 7243 414 5106 2285 -4075 2409 -2543 779 -2353 623 -2050 -575 -557 217 659 -1710 -2103 1229 -618 2516 -2096 -5058 -2202 -2479 -1412 673 469 -1785 -992 -981 -4008 -1035 -2629 -839 -3696 -1708 -807 -338 782 555 992 -514 -62 -165 -1247 762 76 410 546 1616 2293 1796 1663 589 -264 1463 104 -101 739 363 -275 -226 8 -608 498 359 72 504 -1017 -703 -1103 900000 -2960 -4727 -1275 -1083 -4962 -914 -6009 900000 -2437 -661 -2243 87 -429 -20 -487 -3975 -1557 1003 904 189 -2031 -695 -4084 -3162 -343 -1764 1146 -3157 -1648 900000 -1908 865 -259 -919 -1919 -647 1069 -1039 1879 1353 2243 -527 2214 2255 1599 304 2605 1827 1583 135 3337 717 3096 1381 2176 1759 2003 1524 282 1938 1839 1626 1803 1491 2200 2976 2721 665 3430 1317 1519 2392 137 1452 591 -1038 586 -737 266 -940 282 -1073 -318 -326 134 423 -1161 -1431 783 -376 1392 -1176 -3041 -1465 -1859 -1245 681 507 -2045 -1073 -996 -3705 -891 -2425 -809 -3863 -1882 -927 -445 1109 867 1600 -836 -96 -248 -1882 1175 124 693 907 2515 3355 2554 2409 833 -363 2049 160 -174 1431 734 -596 -524 19 -1535 1271 925 185 1237 -2347 -1549 -2303 SS 20240426T112123.6Z 8882.473189 222 1 48.52 2 78.28 81.69 89.86 235.87 0.00 1 0.00 1 0 17 7.019e-01 1.224e-02 4.992e-02 1.552e-03 8.467720e-01 8.398292e-04 9.440722e-03 -6.000000e+00 4.033677e-01 229.71 -2.00 3.47 -2.00 321.23 0.00e+00 5.521177e-03 4.085699e-04 2.168327e-03 -6.000000e+00 1.763016e-02 282.45 -2.00 20.00 -2.00 320.71 0.00e+00 4.765 0.002 302.00 328.00 3 9.6226e-01 2.8341e-03 6.5602e-02 -6.0000e+00 1.0073e+00 2.5779e-01 4.0148e-03 4.5928e-02 -6.0000e+00 1.0911e+00 -3.4941e-01 4.1517e-03 2.6322e-02 -6.0000e+00 6.4898e-01 1.3953e-01 1.9567e-03 1.0388e-02 -6.0000e+00 2.7550e-01 6.7521e-04 -9.7716e-04 3.8122e-05 1.2656e-04 -6.0000e+00 1.8704e-02 1.0575e-02 -1.4747e-04 12 8 8 10 0 0 91.68 20.87 0.43 0.01058 0.00323 224 53 1 5 0 216.600 25.58 20.00 20.87 10.40 4.5 931.28 -235623 -243803 -216175 -216020 -211017 -223294 -234810 -205312 -213666 -199258 -200810 -211020 -156399 -141480 -70415 -94988 -67482 -50407 -56942 -41555 -78576 -49823 -48568 -49497 -47578 -49266 -26623 -54914 -41910 -41683 -30182 -19901 -8113 -4430 -15494 -17569 -4172 -4539 -4511 4409 11587 4757 3664 10524 8237 10225 5529 11531 6567 2458 8179 12297 11920 10125 11908 8026 7035 6293 4007 5300 5227 4644 8013 7673 6292 4926 5686 2755 4078 4663 3680 2749 1671 1183 137 -401 -979 -2587 -1679 -1311 -769 -868 -1816 -1598 -1198 -871 -470 129 -70 240 -18 348 -787 -1590 -1010 -1069 -515 148 -269 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