File name: Pandora159s1_Wakkerstroom_20200716_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T160829.9Z 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_20200716_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: 20200716 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 20200716T051458.7Z 7502.218735 7 1 49.43 2 85.41 63.16 47.96 19.62 0.00 1 0.00 1 0 17 7.420e-01 4.227e-02 4.754e-01 3.187e-02 1.023755e+00 1.967606e-02 9.823422e-03 -6.000000e+00 4.391500e-01 225.54 -2.00 3.06 -2.00 322.54 0.00e+00 -1.962489e-04 1.057686e-02 6.871903e-03 -6.000000e+00 2.272259e-02 276.77 -2.00 20.00 -2.00 322.14 0.00e+00 10.501 0.007 302.00 328.00 3 3.3125e-01 7.6002e-02 1.0522e-01 -6.0000e+00 1.0919e+00 1.6770e+00 8.9294e-02 6.7207e-02 -6.0000e+00 1.1959e+00 -2.1477e+00 6.4914e-02 2.6304e-02 -6.0000e+00 7.0367e-01 8.2619e-01 3.4567e-02 8.6916e-03 -6.0000e+00 2.9861e-01 2.5255e-05 -7.9080e-04 9.0149e-04 1.4332e-04 -6.0000e+00 2.1779e-02 -4.1116e-03 0.0000e+00 12 9 8 11 4 0 72.28 12.10 0.24 -0.00411 -0.01005 39 8 4 8 0 1267.260 15.18 12.10 -8.79 15.86 15.97 11.7 773.91 39988 241737 900000 -64034 900000 -77232 900000 -31523 900000 -2350 900000 34719 48565 900000 -23229 900000 -10738 900000 -39931 900000 125780 900000 61432 60509 900000 7941 900000 -59456 900000 -91669 900000 -25145 428564 5204 900000 118861 -1010 900000 22410 140994 24999 900000 19755 900000 6398 900000 76690 218709 -18949 21841 149892 -30679 85467 12460 217488 32189 277642 -17584 900000 18319 24945 37376 63563 41601 -1947 152270 -12810 94780 -7616 157278 10345 111488 9941 20869 57697 -20426 81651 -15227 35516 -19070 23474 -7493 24081 4141 21712 5533 -2674 11670 10897 2330 -1386 13799 -19656 34261 -1508 14359 -212 2504 1496 -5070 -1627 -4806 4967 -10482 -7848 -10326 6077 -11969 -1388 -4447 -758 -771 -2622 1490 -4968 3646 13 1812 -5210 2983 -1222 5251 -626 1867 7576 888 2334 -740 4710 -1524 5040 -167 1273 -473 -299 -2035 690 892 -828 978 -148 1196 -3685 1360 7481 900000 -4984 900000 -4665 900000 -1179 900000 -73 900000 1074 1503 900000 -1335 900000 -650 900000 -3215 900000 3893 900000 1901 1873 900000 314 900000 -3731 900000 -7369 900000 -1488 13264 266 900000 3679 -46 900000 1060 4364 1432 900000 1223 900000 414 900000 2431 6769 -1588 1323 4639 -3703 3701 1153 6731 2644 8593 -2241 900000 1425 1771 2506 3774 3468 -265 4830 -1946 5482 -1277 6289 1816 7714 1751 3032 5238 -3411 4843 -2335 3876 -4214 4141 -2071 5499 1221 5687 1775 -964 3755 3495 780 -452 3689 -7184 8026 -577 5663 -114 1551 1052 -3914 -1154 -3137 2618 -6183 -4789 -6850 3656 -9317 -1102 -4255 -819 -926 -3382 1859 -6452 4251 16 2279 -7406 4053 -1687 6414 -774 2195 8249 1008 2561 -882 6281 -2563 9121 -349 2839 -1164 -791 -5812 1957 2547 -2392 2658 -375 2739 -8329 SS 20200716T052913.4Z 7502.228628 10 1 50.84 2 82.61 61.37 47.06 15.28 0.00 1 0.00 1 0 25 6.647e-01 8.757e-03 2.890e-01 3.777e-03 8.239173e-01 2.126598e-03 7.958806e-03 -6.000000e+00 3.779632e-01 225.54 -2.00 3.06 -2.00 321.92 0.00e+00 5.753374e-03 1.167721e-03 4.714147e-03 -6.000000e+00 1.678649e-02 276.77 -2.00 20.00 -2.00 321.47 0.00e+00 7.211 0.002 302.00 328.00 3 2.7038e-01 7.8509e-03 7.6646e-02 -6.0000e+00 9.3765e-01 1.4000e-01 1.2773e-02 5.9133e-02 -6.0000e+00 1.0214e+00 -1.4547e-01 1.4868e-02 2.5385e-02 -6.0000e+00 6.0888e-01 4.9418e-02 6.7395e-03 9.2600e-03 -6.0000e+00 2.6074e-01 5.0020e-04 -1.3130e-03 1.0426e-04 9.6912e-05 -6.0000e+00 1.8044e-02 -9.8573e-04 0.0000e+00 11 9 0 11 8 0 84.38 15.20 0.23 -0.00099 -0.01085 229 49 2 8 0 215.410 14.98 15.20 -5.84 18.41 18.41 11.0 787.21 -338572 900000 -300690 900000 -280375 -139220 -248512 -206454 -123886 65019 -87890 -205013 -42152 -166134 900000 -130763 900000 -102390 -14997 -73425 -86489 -52909 -64647 -2885 -82531 -8975 -79781 10560 -93546 36024 -44158 -12134 -21528 -4562 736 -32520 16080 -15965 -2537 -21902 2932 -9008 10775 -3242 8204 7946 -160 2791 -7384 14800 1550 7313 2422 7193 1658 8852 207 7090 4086 4752 4658 1002 10697 2155 6927 2426 5482 3464 6198 1704 3422 1186 -1288 805 971 2195 490 4274 -233 2971 94 724 -1808 -1642 -1724 -1503 -505 -1029 373 -1654 834 -771 1088 -359 804 -701 1293 171 -876 129 -155 619 540 892 -2036 -593 -1599 -807 -838 -342 -532 -799 270 100 894 727 1399 147 347 -1033 -358 -237 200 -287 336 386 790 2378 253 334 53 348 -49 450 -426 -662 -95 99 -385 -189 123 -319 611 -3172 900000 -2716 900000 -1970 -512 -1330 -829 -456 239 -323 -1303 -155 -1334 900000 -1269 900000 -1028 -77 -663 -926 -448 -642 -17 -1077 -66 -1121 66 -1534 199 -621 -158 -375 -75 11 -686 249 -369 -64 -813 98 -374 393 -142 329 332 -8 137 -435 768 104 533 208 652 171 897 24 761 439 495 497 123 1385 325 1094 406 893 603 1169 392 865 323 -357 206 225 448 95 894 -53 799 31 279 -800 -775 -867 -803 -281 -595 213 -932 429 -379 509 -177 447 -469 1002 156 -903 135 -154 544 422 676 -1691 -516 -1480 -797 -917 -427 -756 -1242 428 155 1323 1033 1972 219 546 -1710 -580 -365 292 -407 458 508 1000 3067 382 586 106 743 -111 1091 -1034 -1703 -247 263 -1025 -483 316 -761 1375 SS 20200716T053534.0Z 7502.233033 13 1 52.09 2 81.37 60.55 46.74 13.31 0.00 1 0.00 1 0 25 4.311e-01 6.496e-03 2.115e-01 2.053e-03 7.408267e-01 1.118631e-03 7.279387e-03 -6.000000e+00 2.435320e-01 225.54 -2.00 3.06 -2.00 321.54 0.00e+00 3.620259e-03 5.614688e-04 3.161063e-03 -6.000000e+00 1.059127e-02 276.77 -2.00 20.00 -2.00 321.06 0.00e+00 6.304 0.001 302.00 328.00 3 1.4263e-01 3.8655e-03 6.4712e-02 -6.0000e+00 6.0335e-01 7.7671e-02 5.8109e-03 4.4601e-02 -6.0000e+00 6.5646e-01 -5.2906e-02 6.6301e-03 2.0275e-02 -6.0000e+00 3.9038e-01 8.7967e-03 3.1043e-03 7.5666e-03 -6.0000e+00 1.6635e-01 1.2395e-03 -1.0107e-03 5.6524e-05 7.7985e-05 -6.0000e+00 1.1509e-02 -6.6740e-06 0.0000e+00 11 8 0 10 0 0 86.12 15.99 0.27 -0.00001 -0.00760 364 78 2 8 0 135.640 14.87 15.99 -4.55 19.04 19.12 11.1 795.00 -110012 -129913 -137110 -141611 -153197 -188697 -173253 -40874 -179808 -48382 -118868 -42826 -96450 -47599 -87334 -56116 -22306 -46241 -16779 -56967 -24543 -62840 -26238 -53244 -13245 -36114 -16820 -41999 -30834 -29108 -19134 -11651 -12106 -5753 -21571 8818 -6770 -3029 -7805 -156 -2544 -1686 -5273 -1446 -1796 -4809 2644 -619 3385 2352 6438 761 5074 5033 2550 4037 1756 1055 -1184 1632 1105 3910 2694 2688 413 3413 3041 1940 3042 370 581 -657 -66 -724 -104 367 695 -159 1202 -330 -410 -670 -2217 -686 -1314 -936 -1018 -526 -761 -54 391 1487 1120 1694 1273 624 927 162 -271 -465 35 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