File name: Pandora53s1_Potchefstroom-METSI_20230504_L2Fit_fout2c2d20230223p1-8.txt File generation date: 20240824T144639.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Stuart Piketh Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 53 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora53_OF_v5d20210210.txt Instrument calibration file used: Pandora53s1_CF_v2d20230223.txt Level 1 file used: Pandora53s1_Potchefstroom-METSI_20230504_L1_smca1c2d20230223p1-8.txt Full location name: Gerhard Minnebron Mooi River Ecosystem Trails for Scientific Investigations Short location name: Potchefstroom-METSI Country of location: South Africa Location latitude [deg]: -26.4907 Location longitude [deg]: 27.1322 Location altitude [m]: 1440 Local noon date: 20230504 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: Modification of session 103 "redoing cal analysis" First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0454 305.1861 305.3267 305.4673 305.6079 305.7485 305.8891 306.0297 306.1702 306.3108 306.4513 306.5919 306.7324 306.8729 307.0134 307.1539 307.2943 307.4348 307.5752 307.7157 307.8561 307.9965 308.1369 308.2773 308.4177 308.5581 308.6984 308.8388 308.9791 309.1194 309.2597 309.4000 309.5403 309.6806 309.8209 309.9611 310.1014 310.2416 310.3818 310.5220 310.6622 310.8024 310.9426 311.0827 311.2229 311.3630 311.5031 311.6433 311.7834 311.9234 312.0635 312.2036 312.3437 312.4837 312.6237 312.7638 312.9038 313.0438 313.1837 313.3237 313.4637 313.6036 313.7436 313.8835 314.0234 314.1633 314.3032 314.4431 314.5830 314.7228 314.8627 315.0025 315.1424 315.2822 315.4220 315.5618 315.7015 315.8413 315.9811 316.1208 316.2605 316.4002 316.5400 316.6797 316.8193 316.9590 317.0987 317.2383 317.3780 317.5176 317.6572 317.7968 317.9364 318.0760 318.2155 318.3551 318.4946 318.6342 318.7737 318.9132 319.0527 319.1922 319.3317 319.4711 319.6106 319.7500 319.8894 320.0288 320.1683 320.3076 320.4470 320.5864 320.7257 320.8651 321.0044 321.1437 321.2831 321.4224 321.5616 321.7009 321.8402 321.9794 322.1187 322.2579 322.3971 322.5363 322.6755 322.8147 322.9538 323.0930 323.2321 323.3713 323.5104 323.6495 323.7886 323.9277 324.0668 324.2058 324.3449 324.4839 324.6229 324.7620 324.9010 --------------------------------------------------------------------------------------- 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: Azimuth motor temperature [°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 20230504T052422.2Z 8524.225257 188 1 48.80 2 80.90 67.06 118.08 243.15 0.00 1 0.00 1 0 25 9.013e-01 1.354e-01 2.722e-01 7.165e-03 7.370980e-01 4.076957e-03 1.558673e-02 -6.000000e+00 5.457058e-01 225.62 -2.00 3.06 -2.00 320.72 0.00e+00 -1.201803e-01 1.738595e-03 3.669867e-03 -6.000000e+00 2.628498e-02 281.66 -2.00 20.00 -2.00 320.09 0.00e+00 6.006 0.001 302.00 328.00 3 4.3413e+00 1.3259e-02 9.5105e-02 -6.0000e+00 1.3504e+00 -1.5240e-01 1.7396e-02 1.2714e-01 -6.0000e+00 1.4677e+00 1.4651e-01 1.6463e-02 1.3888e-01 -6.0000e+00 8.6461e-01 -1.5123e-01 7.9565e-03 1.4961e-01 -6.0000e+00 3.6462e-01 2.9982e-05 -3.7038e-03 2.2309e-04 1.6760e-03 -6.0000e+00 2.8585e-02 1.5968e-02 0.0000e+00 12 8 8 10 0 0 95.23 17.21 0.41 0.01597 -0.01186 13 2 1 5 0 3752.880 20.35 15.02 17.21 18.45 45.10 14.4 865.46 -199377 -305601 -301619 900000 -119154 900000 900000 900000 33793 410184 900000 70591 900000 900000 900000 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1685 1719 1463 808 2018 1954 3224 6700 7964 12509 16626 19433 18061 14946 10013 8242 5386 4576 3968 3965 3952 5070 6240 9299 7052 10828 14100 -128336 16517 13828 11621 -2512 4653 4954 1184 4153 5499 7703 10645 11703 12688 12988 10867 12325 10054 12903 12496 11265 14274 8228 2580 648 -3669 -1311 -2914 -1764 875 315 2739 1337 1325 -974 -1780 -3243 -1990 675 6768 9589 11262 8238 4609 -1648 -2418 -4661 -3848 -5271 -4055 -1387 486 1187 -870 -1535 -9106 -9649 -10768 -8323 -8681 -7699 -7360 1397 3037 3658 5464 4864 5761 5541 5154 SS 20230504T053527.6Z 8524.232958 193 1 50.32 2 78.63 65.64 120.17 241.30 0.00 1 0.00 1 0 25 2.882e-01 9.366e-03 1.548e-01 3.443e-03 5.339109e-01 1.823705e-03 5.384187e-03 -6.000000e+00 1.705557e-01 225.62 -2.00 3.06 -2.00 320.09 0.00e+00 -1.210068e-03 6.305123e-04 3.157599e-04 -6.000000e+00 7.709638e-03 281.65 -2.00 20.00 -2.00 319.46 0.00e+00 4.905 0.001 302.00 328.00 3 3.9098e+00 5.3981e-03 4.7689e-02 -6.0000e+00 4.2132e-01 -4.0688e-02 6.6113e-03 2.4330e-02 -6.0000e+00 4.5715e-01 -2.0902e-02 5.8253e-03 1.2220e-02 -6.0000e+00 2.7276e-01 3.2522e-03 2.9768e-03 3.5995e-03 -6.0000e+00 1.1560e-01 9.9165e-05 -1.3406e-04 1.0554e-04 4.6816e-05 -6.0000e+00 8.8497e-03 1.9505e-02 0.0000e+00 12 8 8 10 0 0 96.48 17.24 0.37 0.01950 0.01850 27 5 1 5 0 1863.150 20.46 15.00 17.24 19.18 43.60 14.5 870.63 -32698 -110296 -75341 900000 -80719 -51714 166008 789 -22495 -30665 103434 -42168 186297 -6650 24909 -52220 -8118 -10242 3876 -2798 2202 35402 4935 -15562 -13955 5645 -23450 5722 27008 9154 7673 20655 -5579 -5787 -8605 -9417 -827 -8866 1096 -5998 -1967 482 -726 3784 -4250 4197 776 -2704 2053 2121 1755 -911 1813 4994 463 2843 2619 5040 1190 1874 -2530 3806 1845 646 2382 557 2797 726 127 1473 -1476 -866 -665 251 835 -958 208 -9201 -1047 965 -797 -856 -1337 -1084 -939 -187 -713 -36 -162 1303 -162 1516 626 467 2420 -579 722 1164 28 480 -263 -902 -629 -500 -995 -681 -903 -817 -950 -12 145 -194 301 147 526 64 334 -145 601 -265 -340 -111 -429 62 761 1060 -78 1269 1012 865 393 -110 -439 -451 139 -177 -169 -486 5 -193 -172 220 -6 -307 -2497 -1272 900000 -1332 -659 557 7 -307 -497 484 -894 625 -145 494 -2464 -283 -387 141 -111 89 1046 209 -862 -830 293 -1611 294 1132 467 449 1223 -471 -519 -785 -877 -78 -1046 143 -972 -346 89 -142 726 -893 821 159 -584 437 478 423 -250 529 1490 154 964 917 1730 417 647 -918 1406 774 294 1109 259 1247 337 63 817 -908 -545 -418 153 479 -508 104 -4887 -556 565 -537 -639 -1076 -912 -843 -174 -691 -35 -161 1264 -149 1313 532 402 2168 -582 787 1396 35 608 -326 -1051 -694 -561 -1167 -832 -1146 -1083 -1340 -18 230 -314 493 231 808 95 496 -221 944 -433 -562 -179 -684 95 1129 1534 -113 1815 1552 1423 684 -201 -819 -872 280 -371 -361 -1047 11 -410 -354 443 -13 SS 20230504T054217.2Z 8524.237699 196 1 50.63 2 77.24 64.74 121.44 240.12 0.00 1 0.00 1 0 25 9.790e-02 6.846e-03 4.661e-02 2.492e-03 4.887959e-01 1.303505e-03 4.989974e-03 -6.000000e+00 5.791628e-02 225.62 -2.00 3.06 -2.00 319.62 0.00e+00 -6.554069e-04 3.887104e-04 4.547451e-04 -6.000000e+00 2.575952e-03 281.65 -2.00 20.00 -2.00 318.97 0.00e+00 4.410 0.000 302.00 328.00 3 3.8038e+00 3.7194e-03 4.3084e-02 -6.0000e+00 1.4309e-01 -5.2003e-02 4.4253e-03 2.2257e-02 -6.0000e+00 1.5525e-01 7.5138e-03 3.6325e-03 1.1052e-02 -6.0000e+00 9.2610e-02 -1.0216e-02 1.8911e-03 3.1574e-03 -6.0000e+00 3.9171e-02 1.7141e-04 -5.3207e-05 7.6265e-05 4.0133e-05 -6.0000e+00 2.9716e-03 1.9527e-02 0.0000e+00 11 9 0 11 8 0 96.38 17.27 0.16 0.01953 0.01913 37 7 1 5 0 1368.030 20.46 14.99 17.27 19.67 43.90 14.4 873.34 -34283 -56329 -44774 9532 -15884 -23164 2836 -23504 -25186 -21656 23007 -15471 41641 3107 -186 -29718 -8750 -4179 -880 -226 4767 1182 3639 -5827 -8178 -1123 -4537 8936 5182 -3674 2775 10187 465 -5582 -2831 -7631 -3538 -5295 -1259 -2806 -845 -1441 -572 847 -2495 1337 -673 -290 141 269 1361 53 1674 3163 1063 405 2224 2869 780 -378 47 2470 1395 1733 1460 118 858 290 559 1121 -413 -997 -658 585 428 425 -221 -4726 -889 308 -834 -1003 -1235 -1291 -1082 -667 -666 -2 220 1429 227 840 -49 620 1869 608 330 715 173 215 -259 -982 -134 -341 -757 -928 -529 -862 -526 53 -135 -91 459 68 141 263 257 -151 75 -83 -49 -721 -355 103 527 576 575 1160 631 759 567 187 -116 -51 -508 -50 -76 -395 61 -67 -158 -182 -50 -541 -1224 -942 117 -238 -372 38 -457 -564 -510 381 -404 754 94 -7 -1688 -447 -221 -48 -13 269 71 223 -415 -648 -88 -372 641 377 -295 233 910 50 -670 -326 -931 -456 -799 -222 -579 -192 -355 -142 212 -653 341 -176 -77 38 76 415 18 595 1164 423 169 938 1206 330 -161 21 1111 687 927 792 65 455 157 319 701 -283 -705 -475 400 277 256 -127 -2738 -534 205 -616 -819 -1082 -1183 -1037 -667 -688 -2 233 1477 227 794 -44 558 1789 638 380 888 225 281 -328 -1175 -155 -394 -916 -1174 -691 -1159 -746 79 -215 -149 744 109 214 386 374 -228 116 -133 -80 -1156 -560 158 786 838 823 1650 961 1231 966 328 -209 -96 -986 -100 -156 -814 125 -137 -313 -349 -94 SS 20230504T054842.2Z 8524.242155 199 1 50.40 2 75.95 63.88 122.61 238.98 0.00 1 0.00 1 0 25 5.895e-02 5.773e-03 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