File name: Pandora53s1_Potchefstroom-METSI_20231220_L2Fit_fwvt1c2d20230223p1-8.txt File generation date: 20240824T160047.7Z Data description: Level 2 spectral fitting results file Data file version: fwvt1c2p1-8 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_20231220_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: 20231220 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: 1684 1833 Nominal wavelengths inside fitting window [nm]: 492.0989 492.2196 492.3403 492.4609 492.5815 492.7021 492.8227 492.9432 493.0638 493.1843 493.3048 493.4253 493.5458 493.6663 493.7867 493.9072 494.0276 494.1480 494.2684 494.3888 494.5091 494.6294 494.7498 494.8701 494.9903 495.1106 495.2309 495.3511 495.4713 495.5915 495.7117 495.8319 495.9520 496.0722 496.1923 496.3124 496.4325 496.5525 496.6726 496.7926 496.9127 497.0327 497.1526 497.2726 497.3926 497.5125 497.6324 497.7523 497.8722 497.9921 498.1119 498.2318 498.3516 498.4714 498.5912 498.7109 498.8307 498.9504 499.0702 499.1899 499.3095 499.4292 499.5489 499.6685 499.7881 499.9077 500.0273 500.1469 500.2664 500.3859 500.5055 500.6250 500.7444 500.8639 500.9834 501.1028 501.2222 501.3416 501.4610 501.5803 501.6997 501.8190 501.9383 502.0576 502.1769 502.2962 502.4154 502.5346 502.6538 502.7730 502.8922 503.0114 503.1305 503.2496 503.3687 503.4878 503.6069 503.7260 503.8450 503.9640 504.0830 504.2020 504.3210 504.4399 504.5589 504.6778 504.7967 504.9156 505.0344 505.1533 505.2721 505.3909 505.5097 505.6285 505.7473 505.8660 505.9848 506.1035 506.2222 506.3408 506.4595 506.5781 506.6968 506.8154 506.9339 507.0525 507.1711 507.2896 507.4081 507.5266 507.6451 507.7636 507.8820 508.0005 508.1189 508.2373 508.3557 508.4740 508.5924 508.7107 508.8290 508.9473 509.0656 509.1838 509.3020 509.4203 509.5385 509.6567 509.7748 509.8930 --------------------------------------------------------------------------------------- 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: Water vapor slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor 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: Water vapor effective temperature [K] Column 28: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for water vapor [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Nitrogen dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen 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: Nitrogen dioxide effective temperature [K] Column 39: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for nitrogen dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 45: 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 46: 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 47: 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 48: 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 49: Ozone effective temperature [K] Column 50: 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 51: 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 52: 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 53: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 54: 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 55: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 56: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 57: Lower limit used for wavelength scaling [nm] Column 58: Upper limit used for wavelength scaling [nm] Column 59: Order of smoothing polynomial Column 60: Smoothing polynomial coefficient, order 0 Column 61: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 62: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 63: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 64: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 65: Smoothing polynomial coefficient, order 1 Column 66: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 67: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 68: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 69: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 70: Mean value of measured data inside fitting window [same units as measurements] Column 71: Wavelength change polynomial coefficient, order 0 Column 72: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 76: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 77: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 78: 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 79: 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 80: 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 81: 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 82: 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 83: 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 84: Atmospheric variability [%], 999=no atmospheric variability was determined Column 85: Wavelength effective temperature [°C], 999=no effective temperature given Column 86: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 87: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 88: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 89: Number of bright count cycles Column 90: Number of dark count cycles Column 91: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 92: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 93: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 94: Integration time [ms] Column 95: Temperature at electronics board [°C], 999=no temperature signal Column 96: Spectrometer control temperature [°C], 999=no temperature signal Column 97: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 98: Temperature in head sensor [°C], 999=no temperature signal Column 99: Azimuth motor temperature [°C], 999=no temperature signal Column 100: Humidity in head sensor [%], -9=no humidity signal Column 101: Pressure in head sensor [hPa], -9=no pressure signal Columns 102-251: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 252-401: 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 --------------------------------------------------------------------------------------- SQ 20231220T032407.7Z 8754.141756 81 1 16.78 2 88.95 115.79 149.14 213.16 0.00 1 0.00 1 0 22 1.006e-02 9.867e-03 1.062e-03 1.058e-03 2.554699e+04 7.889958e+01 1.665089e+03 -6.000000e+00 5.483564e+02 283.46 -2.00 20.00 -2.00 505.44 0.00e+00 4.119513e-03 2.926572e-05 2.510068e-04 -6.000000e+00 2.804248e-04 283.46 -2.00 20.00 -2.00 500.99 0.00e+00 1.073566e+00 2.037871e-02 1.517689e-01 -6.000000e+00 1.984344e-01 227.87 -2.00 3.06 -2.00 502.50 0.00e+00 18.661 0.037 489.00 513.00 1 4.6212e+00 1.5548e-03 2.7103e-02 -6.0000e+00 1.5174e-02 -7.5611e-02 3.9371e-04 4.0488e-03 -6.0000e+00 4.0036e-03 1.7076e-03 1.2417e-03 8.2686e-05 2.0425e-04 -6.0000e+00 9.5114e-04 3.3782e-02 -3.3048e-04 12 9 9 12 1 1 44.76 18.19 5.94 0.03378 0.04239 11 7 1 4 0 1398.040 21.17 15.00 18.19 24.06 49.40 16.0 892.94 -1910 -1008 -67 957 1666 1825 2371 2068 1755 1304 669 -95 -409 -968 -827 -651 -349 268 535 825 415 727 602 720 916 876 707 102 -586 -1565 -2008 -1571 -897 -293 346 460 -22 -219 -508 -452 -211 -149 367 870 917 709 466 178 -565 -962 -1800 -2135 -1884 -1540 -1172 -282 431 639 795 710 782 934 991 893 534 174 109 -317 -652 -915 -1137 -1079 -669 -276 -223 -403 -520 -1146 -1277 -1068 -1067 -985 -691 -866 -729 -694 -883 -636 -456 -78 334 905 1106 1401 1336 983 708 -443 -1616 -2264 -2315 -2018 -1330 -553 -314 -216 -264 -517 -700 -823 -479 -195 307 1061 1416 2206 2280 1986 1155 393 39 -22 141 729 1011 1189 827 591 442 -4 -147 -332 -715 -783 -832 -777 -189 335 755 655 710 444 638 645 768 791 317 -673 -1229 -1301 -1701 -893 -61 878 1561 1711 2253 1987 1687 1243 633 -89 -382 -899 -766 -608 -331 255 520 792 401 703 586 706 905 869 701 100 -567 -1514 -1929 -1517 -866 -287 347 463 -22 -218 -505 -448 -210 -148 368 881 923 718 473 179 -563 -959 -1760 -2093 -1831 -1514 -1163 -281 439 656 816 730 807 952 1016 918 547 176 111 -321 -655 -911 -1128 -1075 -671 -280 -224 -410 -521 -1132 -1247 -1055 -1054 -960 -677 -861 -721 -694 -883 -629 -454 -77 331 904 1113 1389 1303 936 659 -403 -1461 -2035 -2086 -1864 -1261 -534 -314 -217 -267 -522 -705 -838 -495 -200 315 1078 1436 2241 2365 2080 1232 419 40 -23 144 741 1037 1229 849 611 458 -4 -152 -340 -740 -796 -854 -814 -199 357 800 708 767 487 705 714 847 868 345 -729 -1324 -1402 SQ 20231220T032701.0Z 8754.143762 85 1 51.28 2 88.37 115.47 149.48 211.99 0.00 1 0.00 1 0 22 8.359e-03 8.203e-03 1.049e-03 1.045e-03 2.498595e+04 7.801977e+01 1.605599e+03 -6.000000e+00 4.556481e+02 283.46 -2.00 20.00 -2.00 505.44 0.00e+00 3.843847e-03 2.893380e-05 2.406144e-04 -6.000000e+00 2.329654e-04 283.46 -2.00 20.00 -2.00 500.98 0.00e+00 1.080297e+00 2.017794e-02 1.538301e-01 -6.000000e+00 1.647446e-01 227.87 -2.00 3.06 -2.00 502.49 0.00e+00 17.149 0.029 489.00 513.00 1 5.9096e+00 1.5404e-03 2.5422e-02 -6.0000e+00 1.2600e-02 -7.4776e-02 3.8946e-04 4.0088e-03 -6.0000e+00 3.3203e-03 5.6691e-04 -3.5221e-04 8.2040e-05 1.9327e-04 -6.0000e+00 7.8999e-04 9.1012e-03 -1.0706e-04 12 8 8 10 0 0 99.83 18.20 4.27 0.00910 0.00666 30 6 1 4 0 1708.980 21.17 15.00 18.20 24.24 49.60 16.0 893.38 -1396 -725 -263 985 1257 1457 1829 1632 1569 1143 447 211 -612 -598 -590 -432 13 42 517 536 372 322 536 442 635 758 491 33 -414 -1271 -1878 -1427 -1041 -361 455 395 220 -166 -185 -446 -246 -92 422 594 698 565 395 164 -313 -976 -1585 -1731 -1410 -1490 -986 -342 239 515 651 880 774 724 980 826 586 -38 20 -242 -667 -679 -949 -1105 -465 -361 -313 -258 -402 -811 -899 -946 -770 -666 -465 -646 -868 -757 -741 -588 -439 0 300 833 1011 1160 1051 873 431 -536 -1279 -1746 -2083 -1355 -1050 -579 -218 -292 -78 -400 -535 -626 -576 -45 47 879 1482 1648 1958 1496 981 158 -155 -70 287 402 890 1038 727 681 388 -114 -288 -255 -733 -888 -609 -734 89 215 567 501 531 350 533 781 554 632 48 -365 -1072 -810 -1226 -648 -236 908 1188 1368 1744 1573 1508 1090 423 198 -571 -552 -544 -402 12 41 497 521 363 316 527 439 635 741 480 33 -404 -1212 -1781 -1359 -1015 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0.000 489.00 513.00 1 7.3782e+00 2.0936e-03 3.4291e-03 -6.0000e+00 4.0900e-03 5.0074e-04 5.4863e-04 7.0499e-04 -6.0000e+00 1.0783e-03 9.9199e-04 -7.0932e-04 1.2717e-04 3.3798e-05 -6.0000e+00 2.5639e-04 1.3970e-02 -1.6594e-04 12 1 1 12 1 1 95.69 18.17 1.80 0.01397 0.00905 4 2 1 4 0 3780.410 21.17 15.00 18.17 26.92 49.10 15.9 909.94 330 -73 -122 471 131 314 348 207 303 296 169 160 -46 -213 -220 162 184 31 -244 108 119 2 7 -50 101 71 -171 -260 473 29 117 68 -41 -480 339 -79 152 110 -101 250 -138 159 148 166 173 -248 -196 -132 -401 -430 -367 -333 -159 -379 -512 -20 -19 11 127 126 91 265 -1204 257 287 71 238 -147 -114 -95 54 -53 -2 -177 -64 228 22 94 69 -160 -334 -199 -196 -327 -128 -417 -565 -436 -651 -36 -254 9 -15 283 -98 8 -510 -144 -311 -252 -25 39 -36 -471 -383 -320 -81 16 -76 -83 -24 231 -67 291 472 576 387 272 161 419 228 667 457 254 267 292 23 254 -27 -89 103 266 15 71 259 -201 129 160 54 213 336 -12 268 176 -299 -265 -210 -217 -240 -135 317 -72 -123 477 134 328 363 218 317 305 175 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