File name: Pandora159s1_Wakkerstroom_20210703_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031204.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210703_L1_smca1c3d20201207p1-8.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: 20210703 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: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20210703T051637.1Z 7854.219874 171 1 49.03 2 85.60 61.32 35.03 351.37 0.00 1 0.00 1 0 25 5.150e-01 3.291e-02 4.767e-01 2.977e-02 1.048043e+00 2.011176e-02 1.350894e-02 -6.000000e+00 3.146920e-01 225.13 -2.00 3.06 -2.00 322.71 0.00e+00 9.582707e-03 1.282265e-02 4.658615e-02 -6.000000e+00 2.583758e-02 276.99 -2.00 20.00 -2.00 322.33 0.00e+00 10.817 0.008 302.00 328.00 3 3.5907e-02 8.4096e-02 2.8533e-01 -6.0000e+00 7.8246e-01 1.5468e+00 1.1463e-01 3.3054e-01 -6.0000e+00 8.6784e-01 -1.9585e+00 1.1278e-01 9.7554e-02 -6.0000e+00 5.0752e-01 7.6563e-01 5.2647e-02 1.4921e-02 -6.0000e+00 2.2242e-01 2.5408e-05 -4.2779e-03 9.1346e-04 6.7767e-04 -6.0000e+00 1.6159e-02 4.3523e-03 12 8 8 10 0 0 39.91 18.58 0.95 0.00435 -0.02779 43 9 4 8 0 1140.120 15.00 18.58 14.65 21.06 21.06 16.8 871.76 900000 900000 900000 900000 -66778 900000 -91783 900000 -96976 900000 900000 900000 900000 900000 37544 900000 900000 -962 900000 6546 900000 900000 900000 900000 900000 900000 900000 900000 900000 -53105 29299 900000 -92746 900000 900000 900000 11209 900000 187241 900000 900000 17691 75121 -7063 900000 900000 60684 123875 900000 27859 900000 159284 900000 46424 45031 231041 -9219 900000 10769 127406 -25118 73576 -37979 152117 -4583 -22759 31399 -18098 41037 57800 22898 -9366 109241 35475 64235 89362 19768 22237 38637 18509 2619 534 5084 18193 -10255 -1922 2061 4208 4074 4404 17924 19584 7753 -1905 5227 4979 -5606 -1560 -1679 -3250 3539 719 6751 3046 -3135 -3732 30476 -3537 -5545 -338 -4908 -5343 -4000 -532 -2091 4592 -222 644 -2582 -975 2360 -2772 2190 -326 3874 -2069 5206 648 -90 3220 1456 2670 -473 773 -1239 -880 451 1385 -255 846 -597 -810 -2402 900000 900000 900000 900000 -1922 900000 -2641 900000 -2791 900000 900000 900000 900000 900000 1080 900000 900000 -28 900000 188 900000 900000 900000 900000 900000 900000 900000 900000 900000 -1528 843 900000 -7037 900000 900000 900000 323 900000 5388 900000 900000 648 2162 -333 900000 900000 1746 3565 900000 1093 900000 4584 900000 2186 2238 6649 -796 900000 676 3667 -2103 2502 -4571 4378 -504 -3037 2464 -2462 3435 4688 2875 -1666 6287 3527 4201 4372 1655 1920 3336 2421 486 119 1210 4046 -3193 -578 620 1266 1215 1256 4173 4253 1886 -553 1668 1941 -2933 -930 -1134 -2296 2204 406 3144 1418 -1648 -2099 12916 -2304 -4207 -288 -5136 -6276 -4876 -631 -2456 4925 -253 766 -3357 -1283 2909 -3365 2401 -358 3973 -2198 5026 701 -116 4836 2560 5134 -1017 1777 -3142 -2350 1209 3703 -687 2146 -1407 -1740 -4934 SS 20210703T053109.5Z 7854.229971 174 1 50.42 2 82.79 59.49 35.72 345.35 0.00 1 0.00 1 0 25 6.271e-01 9.007e-03 2.698e-01 3.401e-03 8.089721e-01 1.887427e-03 7.666245e-03 -6.000000e+00 3.525235e-01 225.13 -2.00 3.06 -2.00 321.89 0.00e+00 5.557966e-03 1.047615e-03 3.576329e-03 -6.000000e+00 1.626382e-02 276.99 -2.00 20.00 -2.00 321.44 0.00e+00 7.366 0.002 302.00 328.00 3 3.2019e-02 6.9642e-03 7.4839e-02 -6.0000e+00 8.7225e-01 1.6334e-01 1.1256e-02 5.2606e-02 -6.0000e+00 9.5100e-01 -1.6771e-01 1.3041e-02 2.3250e-02 -6.0000e+00 5.6646e-01 5.6046e-02 5.9082e-03 8.9994e-03 -6.0000e+00 2.4427e-01 5.7528e-04 -1.1636e-03 9.3740e-05 9.2384e-05 -6.0000e+00 1.6953e-02 3.3329e-03 11 8 0 10 0 0 22.87 18.58 0.25 0.00333 -0.00541 246 53 2 8 0 200.040 15.00 18.58 16.05 21.06 20.96 16.9 880.26 900000 -278135 900000 -234555 -236019 -57594 -282553 74432 -265799 95599 -264961 900000 -172884 900000 -35306 -77963 11915 -56931 26459 -74243 -15503 -81767 50207 -109741 -5097 -61691 -1032 -82802 -36741 -34271 -60132 20544 -33696 592 -34774 12640 -39047 21426 -17529 19004 1379 5347 763 3715 8347 -8376 13493 -2697 15107 -5874 12073 -2350 13563 6432 6969 7891 3192 9762 -455 7145 3637 8061 1990 9607 2000 7804 3836 5113 4186 2051 2150 -836 1953 -493 2945 -1362 2541 -1552 1214 -1320 1012 -1265 -1523 -276 -1320 -156 -1946 157 -1366 989 -232 892 199 1232 284 -252 882 257 -535 -658 591 -805 1528 -513 -1510 -1555 -859 -1203 -559 -218 -594 -153 -547 700 6 1729 624 719 -223 -513 -628 0 116 -382 899 222 1643 1072 769 -53 432 -105 253 138 -538 -350 -86 187 -556 -5 1 215 53 900000 -2263 900000 -1343 -1280 -191 -2639 247 -2723 317 -3193 900000 -1354 900000 -128 -540 43 -429 105 -783 -93 -961 183 -1984 -35 -799 -7 -1347 -387 -403 -1160 223 -751 10 -828 187 -1071 387 -581 527 52 211 34 165 362 -447 606 -152 769 -407 797 -205 1124 577 666 785 343 976 -49 760 382 908 278 1436 347 1280 660 918 856 497 575 -240 534 -129 672 -290 495 -330 291 -394 352 -520 -695 -132 -682 -85 -1129 92 -804 546 -121 434 96 621 167 -176 716 243 -561 -696 575 -703 1175 -402 -1281 -1397 -810 -1230 -633 -283 -872 -240 -876 1081 9 2429 895 1081 -359 -850 -1017 0 170 -544 1221 294 2077 1444 1202 -97 871 -230 539 315 -1329 -907 -225 496 -1482 -12 3 508 120 SS 20210703T053724.9Z 7854.234316 177 1 51.42 2 81.60 58.67 36.12 342.83 0.00 1 0.00 1 0 25 3.893e-01 6.143e-03 1.983e-01 1.974e-03 7.323488e-01 1.069539e-03 7.124989e-03 -6.000000e+00 2.187817e-01 225.13 -2.00 3.06 -2.00 321.56 0.00e+00 2.994633e-03 5.487316e-04 3.391049e-03 -6.000000e+00 9.568285e-03 276.99 -2.00 20.00 -2.00 321.08 0.00e+00 6.452 0.002 302.00 328.00 3 -6.5452e-04 3.7289e-03 6.5503e-02 -6.0000e+00 5.4143e-01 8.0617e-02 5.5883e-03 4.4539e-02 -6.0000e+00 5.9006e-01 -5.9003e-02 6.3444e-03 1.9871e-02 -6.0000e+00 3.5101e-01 1.1440e-02 2.9642e-03 7.2427e-03 -6.0000e+00 1.4908e-01 1.3046e-03 -1.0290e-03 5.5055e-05 7.3491e-05 -6.0000e+00 1.0404e-02 3.0761e-03 10 0 0 10 0 0 18.82 18.57 0.30 0.00308 -0.00466 382 82 2 8 0 128.850 15.00 18.57 16.76 21.06 20.96 17.1 883.84 -85599 42503 -168183 -123287 -135637 -155686 -119953 -147237 -112162 -75548 -112270 -56973 -55328 -88412 -73757 -53038 -59702 -54172 -26654 -51827 -26250 -64460 -29231 -21855 -26671 -24088 -28080 -28339 -34405 -7388 -20427 -7515 -14994 -7966 -14813 -5174 -7576 -4376 -3956 -3961 -419 -4822 -1323 -137 -537 -4147 549 2056 2061 5684 2646 3437 4345 3600 2455 2595 654 523 -443 3477 3534 3438 3311 1969 1846 2222 2071 2456 2767 717 348 -574 468 -875 -353 478 348 -214 718 -206 -17 -968 -2016 -963 -1483 -865 -963 -1048 -248 273 780 381 988 1241 980 277 707 254 -372 -321 307 375 1160 329 -1727 -1398 1203 -679 -211 -221 -599 -329 -32 367 527 1195 851 485 -255 -909 -780 -250 -217 -342 366 132 1145 1394 134 103 51 0 5 296 -276 -311 82 56 -636 42 111 108 285 -165 82 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