File name: Pandora32s1_GreenbeltMD_20231213_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T220124.9Z 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_20231213_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: 20231213 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 20231213T130413.5Z 8747.544601 59 1 49.07 2 83.26 127.23 92.72 125.51 0.00 1 0.00 1 0 17 3.919e-01 2.543e-02 1.990e-01 9.421e-03 9.063538e-01 5.137184e-03 1.023840e-02 -6.000000e+00 2.200762e-01 223.15 -2.00 3.47 -2.00 322.04 0.00e+00 6.040313e-03 2.564299e-03 3.446728e-03 -6.000000e+00 9.742279e-03 278.54 -2.00 20.00 -2.00 321.58 0.00e+00 7.773 0.008 302.00 328.00 3 9.2626e-01 1.8458e-02 9.0822e-02 -6.0000e+00 5.4260e-01 1.2393e+00 2.2912e-02 4.9104e-02 -6.0000e+00 5.9161e-01 -1.7202e+00 1.7418e-02 2.6430e-02 -6.0000e+00 3.5250e-01 7.0392e-01 8.7113e-03 9.2498e-03 -6.0000e+00 1.5079e-01 3.8561e-05 -1.8097e-03 2.4174e-04 1.6489e-04 -6.0000e+00 1.0429e-02 1.0984e-02 -1.4418e-04 12 8 8 10 0 0 97.59 20.62 1.31 0.01098 -0.00261 46 11 1 5 0 1066.690 25.39 20.00 20.62 8.74 3.8 906.92 14183 -38906 73418 -44052 18355 -57750 -50965 -56402 -89698 -10905 -86276 -102721 81809 -76669 133918 -17889 17666 20114 10426 900000 -23493 -6317 -16588 -23439 -10384 -35207 173922 -32529 7952 -54783 75014 16328 161014 71025 -11921 11988 3772 140 40135 34713 68254 32268 39643 61935 27630 42161 18294 100253 54965 18417 44149 43415 78683 38450 52139 34228 47681 32887 10475 28082 3495 26247 19234 37648 21573 16220 33141 21397 17236 28742 13417 9424 7886 15972 2897 -431 412 8 3980 -3380 -459 -1738 -4498 1277 1427 2225 2960 1443 -1698 0 2990 -6224 109 -8786 -4271 -469 -1562 -1774 -3821 -3165 -2594 -2700 -3734 -2715 -3753 -6066 -3547 -4046 -1562 -1265 -1574 -100 -908 -86 668 -616 270 -582 1701 -1352 2743 2298 3488 2776 1371 3187 420 3060 249 1040 806 -1245 -91 330 1190 446 96 -255 -767 283 -822 -937 -1442 426 -2209 1349 -2354 429 -2411 -1830 -2120 -4719 -255 -4107 -5919 977 -5122 1476 -956 723 840 488 900000 -1413 -290 -790 -1313 -515 -2199 1598 -1733 263 -3472 1516 720 1923 2218 -799 573 194 8 1843 1945 3010 2134 2476 3072 1878 2440 1344 3315 2979 1523 3082 3390 4698 3673 4550 3647 4468 3474 1299 2734 427 2724 2438 4565 3369 2697 4597 3440 3151 5360 3229 2459 2050 3551 655 -88 77 1 823 -913 -145 -650 -1765 506 597 976 1350 688 -834 0 1398 -3002 48 -4431 -2144 -271 -1089 -1458 -3628 -3111 -2422 -2255 -2784 -1923 -2839 -5025 -3033 -3760 -1585 -1488 -2148 -150 -1311 -123 1004 -907 395 -899 2495 -2129 4459 3565 5082 3965 1934 4290 565 4168 403 1806 1599 -2763 -214 831 3198 1180 262 -701 -2114 742 -2183 -2282 -3322 SS 20231213T131457.1Z 8747.552050 62 1 48.69 2 81.62 129.09 91.11 127.11 0.00 1 0.00 1 0 17 5.747e-01 1.700e-02 7.934e-02 3.226e-03 8.086146e-01 1.715447e-03 9.193826e-03 -6.000000e+00 3.222999e-01 223.15 -2.00 3.47 -2.00 321.57 0.00e+00 8.251204e-03 8.852379e-04 2.895668e-03 -6.000000e+00 1.420239e-02 278.54 -2.00 20.00 -2.00 321.11 0.00e+00 6.454 0.005 302.00 328.00 3 6.7921e-01 6.0131e-03 7.6688e-02 -6.0000e+00 7.9381e-01 4.7465e-01 8.2705e-03 4.3775e-02 -6.0000e+00 8.6446e-01 -6.7970e-01 8.2056e-03 2.6003e-02 -6.0000e+00 5.1561e-01 2.8185e-01 3.8760e-03 1.1293e-02 -6.0000e+00 2.2117e-01 2.0335e-04 -1.3861e-03 8.2770e-05 1.6590e-04 -6.0000e+00 1.5288e-02 9.8157e-03 -1.1827e-04 12 8 8 10 0 0 31.61 20.65 0.70 0.00982 -0.00060 129 30 1 5 0 377.440 25.39 20.00 20.65 10.05 3.8 913.61 -170711 -182312 -136005 -164066 -189305 -204713 -179038 -153090 -198302 -154929 -177513 -168539 -128604 -117528 -77973 -69604 -83678 -49354 -52595 20602 -61294 -42555 -11908 -58290 -15746 -45576 -20963 -44099 -46819 -56752 -27544 -19814 41380 -5562 -12564 -16660 -5908 -2744 1821 20765 21541 13598 5728 21662 10593 21085 17222 24006 25489 14375 16132 16396 23206 25120 20741 19720 13701 14302 6703 7706 9914 6848 15343 13244 14211 10966 10903 9480 8131 9460 6449 7839 4145 3212 3121 329 -496 -2517 -2022 -1794 -307 777 -2303 -971 -1687 -1322 515 -254 388 352 -587 -953 -1741 -3400 -3203 -1803 -1361 -889 -693 -894 -1192 -1916 -1534 -1982 -2409 -2134 -1952 -1577 -754 -202 -337 130 -193 100 259 45 157 20 360 47 618 1493 1499 1287 1191 1131 1186 1266 432 735 861 -247 38 172 299 -42 -120 -158 -224 -193 -151 -679 -1115 -2393 -3494 -1968 -2816 -3736 -4274 -3155 -2216 -4867 -2584 -3798 -3606 -2347 -2588 -1521 -1555 -2501 -1165 -1390 272 -1851 -1031 -210 -1706 -317 -1276 -462 -1193 -1282 -1839 -806 -673 911 -217 -514 -671 -221 -114 87 980 1145 847 407 1356 750 1373 1203 1639 1820 1235 1513 1733 2541 2940 2456 2448 1850 1906 928 1018 1293 1003 2379 2428 2845 2299 2264 2058 1958 2595 2040 2576 1405 1034 912 88 -123 -646 -580 -621 -126 367 -1258 -514 -954 -792 319 -164 250 220 -348 -581 -1032 -1938 -2059 -1353 -1204 -914 -738 -989 -1261 -1980 -1404 -1760 -2275 -2148 -2070 -1791 -868 -265 -505 197 -303 155 414 69 241 32 565 77 999 2464 2356 1968 1766 1624 1644 1809 709 1301 1715 -503 82 397 740 -104 -303 -404 -574 -477 -371 -1549 -2422 SS 20231213T133151.9Z 8747.563795 67 1 48.54 2 79.13 132.11 88.65 129.70 0.00 1 0.00 1 0 17 4.436e-01 9.198e-03 3.223e-02 1.268e-03 6.760805e-01 6.554867e-04 7.652012e-03 -6.000000e+00 2.488392e-01 223.15 -2.00 3.47 -2.00 320.74 0.00e+00 3.700049e-03 2.716001e-04 8.826081e-04 -6.000000e+00 1.096470e-02 278.54 -2.00 20.00 -2.00 320.21 0.00e+00 5.108 0.002 302.00 328.00 3 5.8285e-01 2.0281e-03 6.0937e-02 -6.0000e+00 6.1288e-01 1.1985e-01 2.6726e-03 3.4911e-02 -6.0000e+00 6.6740e-01 -1.7383e-01 2.6801e-03 1.9089e-02 -6.0000e+00 3.9807e-01 6.7479e-02 1.3268e-03 7.3127e-03 -6.0000e+00 1.7078e-01 9.3866e-04 -8.6626e-04 3.3441e-05 7.8552e-05 -6.0000e+00 1.1801e-02 9.1343e-03 -1.0722e-04 11 8 0 10 0 0 98.20 20.73 0.42 0.00913 0.00262 279 65 1 5 0 173.970 25.39 20.01 20.73 12.25 3.8 926.91 -161794 -138274 -135493 -140860 -150678 -160570 -132072 -143305 -131033 -129743 -121352 -122267 -97994 -78308 -58450 -47527 -48985 -32397 -21973 -23357 -23002 -34076 -28550 -29788 -24343 -22697 -24399 -22799 -27212 -26892 -10427 -12859 3180 -5248 -6156 -9036 -8840 -2596 -418 4270 1719 3212 930 4613 3500 4967 5951 7329 3767 2464 4444 5675 6423 5903 5187 4346 3533 2323 2990 1334 3442 3606 4119 4180 2567 2860 2348 1565 1790 2304 1311 1023 495 22 -327 -1270 -1142 -2109 -2172 -1057 -1456 -1483 -2058 -2049 -1101 -1037 -348 -40 266 538 432 547 -541 -335 -506 -433 -84 153 284 -181 -500 -902 -831 -182 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