File name: Pandora159s1_Wakkerstroom_20200818_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T163131.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v6d20191220.txt Level 1 file used: Pandora159s1_Wakkerstroom_20200818_L1_smca1c6d20191220p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20200818 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Update session 4 based on session2 for SO2 First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0490 305.1898 305.3306 305.4713 305.6121 305.7529 305.8936 306.0343 306.1750 306.3157 306.4564 306.5971 306.7378 306.8785 307.0191 307.1597 307.3004 307.4410 307.5816 307.7222 307.8628 308.0033 308.1439 308.2845 308.4250 308.5655 308.7060 308.8465 308.9870 309.1275 309.2680 309.4084 309.5489 309.6893 309.8297 309.9701 310.1105 310.2509 310.3913 310.5317 310.6720 310.8124 310.9527 311.0930 311.2333 311.3736 311.5139 311.6542 311.7944 311.9347 312.0749 312.2152 312.3554 312.4956 312.6358 312.7760 312.9161 313.0563 313.1964 313.3366 313.4767 313.6168 313.7569 313.8970 314.0371 314.1771 314.3172 314.4572 314.5973 314.7373 314.8773 315.0173 315.1573 315.2973 315.4372 315.5772 315.7171 315.8570 315.9969 316.1369 316.2767 316.4166 316.5565 316.6964 316.8362 316.9760 317.1159 317.2557 317.3955 317.5352 317.6750 317.8148 317.9545 318.0943 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0721 319.2118 319.3514 319.4910 319.6307 319.7703 319.9098 320.0494 320.1890 320.3285 320.4681 320.6076 320.7471 320.8866 321.0261 321.1656 321.3051 321.4445 321.5840 321.7234 321.8628 322.0023 322.1417 322.2810 322.4204 322.5598 322.6991 322.8385 322.9778 323.1171 323.2564 323.3957 323.5350 323.6743 323.8135 323.9528 324.0920 324.2312 324.3704 324.5096 324.6488 324.7880 324.9272 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20200818T045317.0Z 7535.203669 38 1 48.01 2 85.15 72.72 81.14 60.96 0.00 1 0.00 1 0 61 9.579e-01 4.087e-01 6.960e-01 3.706e-01 8.887266e-01 2.307307e-01 9.723179e-03 -6.000000e+00 6.155684e-01 226.48 -2.00 3.06 -2.00 317.10 0.00e+00 -6.025971e-03 2.347844e-02 1.014689e-03 -6.000000e+00 3.030142e-02 276.70 -2.00 20.00 -2.00 315.93 0.00e+00 10.104 0.006 302.00 328.00 3 2.5491e+00 5.9727e-01 9.0886e-02 -6.0000e+00 1.5597e+00 2.9235e+00 6.9219e-01 4.0789e-02 -6.0000e+00 1.7377e+00 -1.4717e+00 3.9120e-01 1.9497e-02 -6.0000e+00 1.0103e+00 1.2526e-01 1.7140e-01 6.0571e-03 -6.0000e+00 4.1332e-01 1.4643e-06 -7.7567e-03 1.0141e-02 1.0750e-04 -6.0000e+00 3.0260e-02 -1.5143e-02 0.0000e+00 12 8 8 10 0 0 -89.15 18.11 6.79 -0.01514 -0.07343 12 3 2 8 0 4000.000 15.00 18.11 13.00 20.67 20.56 11.0 884.66 -37324 198440 900000 900000 900000 -53423 11266 456705 217710 900000 -26314 -13724 900000 900000 900000 900000 -66304 900000 900000 900000 900000 -96670 900000 900000 30159 -77102 21864 900000 -15991 900000 -106998 900000 50447 900000 900000 900000 900000 83536 5299 -1278 -67434 76142 34022 900000 -7356 9320 215803 900000 900000 900000 -34836 900000 900000 -18012 900000 68110 145080 33404 193496 900000 900000 -17777 900000 192832 24528 -6770 900000 900000 14584 900000 33995 900000 47999 128675 21613 61601 15983 28250 900000 -53475 225053 150620 49277 48012 281969 115956 900000 -11960 59735 112173 7846 -33208 -30435 900000 33091 -11367 8853 38632 11651 -7668 -26436 5708 -7171 2266 371819 -10669 900000 91947 -18179 35264 660 23339 -13970 13864 44298 -10959 49646 8309 -32083 -36846 -9138 -5892 927 -15162 3810 -14957 -6153 24644 -30238 19403 -6697 10402 14484 -8453 5594 9391 4284 5109 335 9334 58854 6756 -20006 -13358 71018 900000 900000 900000 -19119 4032 163447 77915 900000 -9417 -4912 900000 900000 900000 900000 -40705 900000 900000 900000 900000 -74872 900000 900000 10793 -54548 7825 900000 -5723 900000 -81205 900000 18054 900000 900000 900000 900000 29896 2044 -613 -67350 27250 13729 900000 -3986 4060 77232 900000 900000 900000 -23332 900000 900000 -12581 900000 24375 51922 14943 69249 900000 900000 -9990 900000 69012 11717 -4327 900000 900000 7468 900000 17482 900000 21837 46051 10324 22046 6065 10110 900000 -43710 80543 53905 22177 23082 100912 41499 900000 -11012 27394 40145 5162 -29266 -24530 900000 15566 -9217 6793 25456 11003 -9053 -35811 5124 -6307 1664 133068 -9407 900000 33353 -19875 25951 760 23921 -21311 16210 37310 -14782 36699 9226 -54431 -67966 -12902 -7685 1067 -19557 3973 -18057 -6559 19543 -44346 20682 -10454 15225 21886 -17003 10558 18427 9179 11055 766 19392 72255 12695 -45648 SS 20200818T051713.3Z 7535.220293 41 1 50.65 2 80.12 69.76 76.70 57.80 0.00 1 0.00 1 0 25 3.710e-01 1.906e-02 3.760e-01 1.518e-02 6.294203e-01 8.305726e-03 6.255152e-03 -6.000000e+00 2.149125e-01 226.48 -2.00 3.06 -2.00 321.29 0.00e+00 -1.330970e-03 3.763663e-03 1.952344e-03 -6.000000e+00 9.899992e-03 276.70 -2.00 20.00 -2.00 320.79 0.00e+00 5.580 0.001 302.00 328.00 3 3.9453e+00 2.7312e-02 5.4301e-02 -6.0000e+00 5.3355e-01 1.0442e-01 3.7281e-02 3.1518e-02 -6.0000e+00 5.8211e-01 -1.2359e-01 3.8183e-02 1.7023e-02 -6.0000e+00 3.4057e-01 3.4523e-02 1.8372e-02 5.3351e-03 -6.0000e+00 1.4569e-01 5.5253e-05 -8.1087e-04 4.4900e-04 7.2003e-05 -6.0000e+00 1.0242e-02 3.8428e-03 0.0000e+00 12 8 8 10 0 0 99.97 18.11 0.83 0.00384 -0.00225 19 4 4 8 0 2647.900 15.00 18.11 13.32 20.67 20.67 11.0 887.08 900000 -44890 900000 -135613 900000 900000 900000 -143148 900000 -58759 -144363 12412 -157193 -122744 -67780 57602 104686 33973 -42626 6226 -42517 -53251 10780 -9388 57944 -97470 -54697 62910 -50611 -4769 72616 -36622 -11384 23262 -68831 54275 -37435 25324 40266 -3209 36007 18016 6819 14532 7624 17862 17897 -2778 -11671 32296 11872 15644 21863 10177 8820 7861 12367 5639 -2735 5204 8777 5302 2750 1806 -3762 17075 1396 4914 8382 -496 4379 -6072 3564 3773 -198 2026 -3470 1180 9207 3321 -4416 1942 -3207 -3561 -4802 -5122 -882 940 1292 3498 314 3025 775 -150 776 -500 1426 853 1080 -2934 -2463 -2370 1705 72 -2092 -1153 -303 932 -712 -604 -869 284 -2072 82 501 3716 395 1644 -1133 -574 -1951 1645 683 936 736 -853 1312 760 -181 363 1223 894 412 1737 -1573 -965 -275 574 228 -278 553 -58 -1530 900000 -664 900000 -2006 900000 900000 900000 -2117 900000 -869 -2718 184 -4529 -3193 -1283 852 1548 502 -1002 97 -1096 -1530 175 -205 857 -5948 -2259 931 -1883 -119 1074 -1706 -480 761 -5326 1257 -2281 1003 1707 -249 2170 1399 618 1251 704 1517 1542 -301 -1431 2752 1362 1941 2810 1595 1490 1408 2198 1075 -550 946 1574 1067 640 478 -1111 4049 375 1309 2359 -175 1641 -2645 1411 1421 -71 643 -1072 348 2756 1233 -2068 977 -1865 -2218 -3216 -3677 -640 691 950 2433 212 1855 462 -92 520 -391 1258 862 1190 -3402 -2687 -2344 1478 64 -2010 -1172 -321 1034 -873 -824 -1313 451 -3393 127 731 5016 549 2363 -1769 -931 -3218 2538 1024 1360 1034 -1172 1698 1012 -270 608 2225 1738 839 3694 -3671 -2368 -687 1446 578 -689 1285 -127 -3306 SS 20200818T052514.8Z 7535.225866 45 1 49.69 2 78.45 68.72 75.24 56.68 0.00 1 0.00 1 0 25 3.149e-01 8.526e-03 2.069e-01 5.488e-03 5.584644e-01 2.883195e-03 5.641776e-03 -6.000000e+00 1.783934e-01 226.48 -2.00 3.06 -2.00 320.90 0.00e+00 2.618287e-03 1.191899e-03 1.434869e-03 -6.000000e+00 7.733205e-03 276.70 -2.00 20.00 -2.00 320.37 0.00e+00 4.838 0.001 302.00 328.00 3 3.2606e+00 9.0437e-03 4.7687e-02 -6.0000e+00 4.4292e-01 1.8402e-02 1.1920e-02 2.8771e-02 -6.0000e+00 4.8169e-01 -2.1431e-02 1.2140e-02 1.3621e-02 -6.0000e+00 2.8622e-01 -4.1471e-03 5.9974e-03 4.8894e-03 -6.0000e+00 1.2163e-01 2.1086e-04 -8.3994e-04 1.5896e-04 4.9868e-05 -6.0000e+00 8.4077e-03 3.9027e-03 0.0000e+00 11 8 0 10 0 0 99.19 18.11 0.60 0.00390 -0.00241 45 10 4 8 0 1103.870 15.00 18.11 13.51 20.67 20.67 11.0 888.06 -153978 -73991 -39133 215879 -69537 -78724 -110308 -83837 -83471 -24121 -43290 -33208 -73373 -26818 -47309 -36294 -28551 9803 -26167 10939 14491 25170 34337 1035 28150 -4858 25443 -30987 -2791 5365 -2453 4653 5629 2255 15553 -7554 -3718 -1731 3246 -12539 -6703 -2420 -2022 1666 3904 -2290 2797 -2495 826 -4058 7807 2987 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