File name: Pandora53s1_Potchefstroom-METSI_20231214_L2Fit_fout2c0d20220413p1-8.txt File generation date: 20240131T170445.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c0p1-8 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_v103d20220413.txt Level 1 file used: Pandora53s1_Potchefstroom-METSI_20231214_L1_smca1c0d20220413p1-8.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: 20231214 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: None First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0881 305.2288 305.3695 305.5101 305.6508 305.7914 305.9321 306.0727 306.2133 306.3539 306.4945 306.6351 306.7757 306.9162 307.0568 307.1973 307.3378 307.4784 307.6189 307.7593 307.8998 308.0403 308.1807 308.3212 308.4616 308.6020 308.7424 308.8828 309.0232 309.1636 309.3040 309.4443 309.5847 309.7250 309.8653 310.0056 310.1459 310.2862 310.4264 310.5667 310.7069 310.8472 310.9874 311.1276 311.2678 311.4080 311.5482 311.6883 311.8285 311.9686 312.1088 312.2489 312.3890 312.5291 312.6692 312.8092 312.9493 313.0893 313.2294 313.3694 313.5094 313.6494 313.7894 313.9294 314.0694 314.2093 314.3493 314.4892 314.6291 314.7690 314.9089 315.0488 315.1887 315.3285 315.4684 315.6082 315.7480 315.8878 316.0276 316.1674 316.3072 316.4470 316.5867 316.7265 316.8662 317.0059 317.1456 317.2853 317.4250 317.5647 317.7044 317.8440 317.9836 318.1233 318.2629 318.4025 318.5421 318.6816 318.8212 318.9608 319.1003 319.2398 319.3794 319.5189 319.6584 319.7978 319.9373 320.0768 320.2162 320.3556 320.4951 320.6345 320.7739 320.9133 321.0526 321.1920 321.3314 321.4707 321.6100 321.7493 321.8887 322.0279 322.1672 322.3065 322.4458 322.5850 322.7242 322.8635 323.0027 323.1419 323.2810 323.4202 323.5594 323.6985 323.8377 323.9768 324.1159 324.2550 324.3941 324.5332 324.6722 324.8113 324.9503 --------------------------------------------------------------------------------------- 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 20231214T052405.4Z 8748.225062 140 1 1.11 2 63.20 103.96 77.63 114.98 0.00 1 0.00 1 0 25 1.878e-02 1.054e-02 1.411e-02 6.400e-03 2.736663e-01 3.412477e-03 2.897243e-03 -6.000000e+00 1.138578e-02 227.95 -2.00 3.06 -2.00 316.34 0.00e+00 -5.140002e-04 3.959605e-04 4.586605e-05 -6.000000e+00 5.067640e-04 283.22 -2.00 20.00 -2.00 315.65 0.00e+00 2.206 0.000 302.00 328.00 3 3.9605e+00 8.8656e-03 2.2283e-02 -6.0000e+00 2.8260e-02 -4.7800e-03 9.8926e-03 1.2287e-02 -6.0000e+00 3.0588e-02 6.5512e-03 5.7211e-03 6.0261e-03 -6.0000e+00 1.8238e-02 3.0029e-04 2.6429e-03 1.7094e-03 -6.0000e+00 7.6521e-03 1.1201e-03 4.9645e-05 2.0354e-04 2.4174e-05 -6.0000e+00 5.9294e-04 -3.3815e-02 -1.9211e-04 12 9 9 12 5 5 999.00 18.16 0.19 -0.03382 -0.03344 1 17 1 5 0 552.550 21.17 15.01 18.16 24.62 47.60 15.7 895.80 5716 -6290 -4180 -826 2253 -1403 -6853 6918 971 2251 -919 -1796 1652 775 5050 -4958 1745 -5258 -13 -2962 3030 937 1952 1066 -4023 -2421 -349 1851 -478 1828 -10 3402 560 -2548 1516 -1586 268 -393 1599 -598 -1841 -533 -876 -765 -717 -1616 54 -825 -1461 1542 1816 1351 1421 278 1154 1721 1224 1777 -767 104 1488 2726 1113 317 -643 961 -139 -483 1727 710 -599 -1401 -463 487 202 -551 1089 2279 1035 718 -1186 -1241 -1519 -854 -1952 -1384 -1063 -1576 -941 -878 270 1107 1083 648 1186 1536 -263 898 -946 -216 -1027 -1737 1307 -227 -61 -643 -792 305 -429 -55 -984 203 -315 170 486 1519 1102 583 654 -854 6 -1046 -98 -909 1525 426 2043 1908 450 794 550 816 251 107 -204 -909 336 -388 -863 -109 153 -242 -1215 897 -1157 -764 -142 356 -222 -1180 1178 189 446 -192 -387 381 197 1387 -1554 551 -1791 -4 -1039 1040 331 700 398 -1614 -988 -138 711 -179 670 -4 1332 237 -1116 633 -681 120 -195 879 -364 -1198 -357 -597 -527 -493 -1116 37 -553 -973 1022 1239 961 1045 214 903 1357 986 1421 -614 84 1195 2274 980 289 -587 850 -119 -409 1490 653 -587 -1420 -467 481 192 -496 924 1872 867 642 -1142 -1262 -1613 -935 -2232 -1630 -1292 -1951 -1170 -1067 316 1228 1146 682 1264 1726 -314 1120 -1239 -281 -1302 -2122 1532 -271 -75 -823 -1038 410 -597 -79 -1446 300 -460 241 658 1984 1424 775 896 -1215 9 -1504 -139 -1268 2050 562 2610 2430 593 1083 774 1164 364 159 -310 -1428 535 -625 -1395 -175 240 -373 -1868 SS 20231214T053640.9Z 8748.233807 149 1 50.63 2 60.46 102.90 75.16 113.92 0.00 1 0.00 1 0 17 1.172e-02 6.489e-03 4.553e-03 1.414e-03 2.567216e-01 7.484968e-04 2.719773e-03 -6.000000e+00 7.104077e-03 227.95 -2.00 3.06 -2.00 317.37 0.00e+00 -2.414654e-04 1.114060e-04 1.157640e-04 -6.000000e+00 3.161884e-04 283.22 -2.00 20.00 -2.00 316.62 0.00e+00 2.019 0.000 302.00 328.00 3 4.9470e+00 1.9793e-03 2.0616e-02 -6.0000e+00 1.7633e-02 3.1291e-03 2.2221e-03 1.1617e-02 -6.0000e+00 1.9085e-02 2.6472e-02 1.3309e-03 5.7059e-03 -6.0000e+00 1.1380e-02 -1.5824e-02 6.4467e-04 1.5975e-03 -6.0000e+00 4.7744e-03 4.9568e-04 2.1340e-04 4.6106e-05 2.1856e-05 -6.0000e+00 3.6995e-04 -3.3313e-02 -1.7216e-04 12 9 1 12 4 4 99.99 18.16 0.20 -0.03331 -0.03171 520 96 1 5 0 97.350 21.17 14.98 18.16 25.28 49.40 15.8 900.37 -210 -4803 -2926 -2187 659 602 3347 3186 2479 1898 3675 1949 1473 1901 -266 -1491 -1058 -755 -289 -568 -183 959 751 719 235 -382 -951 990 1540 2790 2077 2634 1061 -566 240 69 207 -170 190 -1473 -1875 -1326 -1971 -1433 -1557 -1340 -1552 -1023 -682 442 384 -150 1108 604 742 749 542 576 1020 798 1163 1319 871 489 -117 385 131 740 1207 797 -338 -496 -254 -229 336 316 1075 741 948 725 -158 -833 -1427 -965 -1206 -844 -509 -549 -653 -162 423 548 862 1533 1612 1243 623 67 -405 -193 -363 -433 518 379 -507 -594 -720 -774 -298 -255 -265 -586 -333 -85 144 697 763 560 248 -292 -377 -594 -318 -98 711 502 1164 1262 705 738 233 223 -41 386 -60 -154 32 -320 -510 -232 -215 -296 173 -22 -564 -342 -242 70 62 353 348 300 243 472 266 222 324 -52 -324 -242 -168 -66 -135 -44 232 186 187 65 -109 -272 265 416 732 571 726 316 -175 72 21 67 -63 84 -715 -1004 -745 -1148 -839 -913 -779 -889 -571 -373 242 219 -92 709 407 517 534 393 418 727 570 851 969 690 409 -98 305 97 568 916 671 -313 -482 -247 -216 294 252 821 541 713 568 -139 -814 -1427 -1016 -1355 -1008 -639 -676 -806 -203 492 584 893 1525 1662 1327 740 83 -536 -254 -454 -531 600 447 -640 -757 -965 -1086 -438 -377 -410 -925 -511 -128 200 908 978 742 350 -439 -584 -920 -480 -142 972 654 1520 1638 964 1020 341 337 -64 588 -96 -260 56 -573 -920 -411 -369 -490 280 SS 20231214T054924.2Z 8748.242641 158 1 50.90 2 57.68 101.85 72.65 112.89 0.00 1 0.00 1 0 17 1.726e-02 7.685e-03 6.824e-03 2.708e-03 2.425069e-01 1.434799e-03 2.582138e-03 -6.000000e+00 1.046880e-02 227.95 -2.00 3.06 -2.00 316.73 0.00e+00 8.401708e-05 1.830070e-04 5.291659e-05 -6.000000e+00 4.658807e-04 283.22 -2.00 20.00 -2.00 316.02 0.00e+00 1.864 0.000 302.00 328.00 3 6.6088e+00 3.7532e-03 1.9176e-02 -6.0000e+00 2.5984e-02 4.6688e-02 4.2000e-03 1.0960e-02 -6.0000e+00 2.8124e-02 1.0253e-02 2.4475e-03 5.3803e-03 -6.0000e+00 1.6769e-02 -1.1697e-02 1.1489e-03 1.5111e-03 -6.0000e+00 7.0365e-03 1.0797e-04 2.9785e-04 8.7223e-05 2.1101e-05 -6.0000e+00 5.4508e-04 -3.3557e-02 -1.4456e-04 12 9 1 12 12 4 100.00 18.16 0.59 -0.03356 -0.03132 48 9 1 5 0 1060.200 21.17 15.02 18.16 25.59 50.40 15.8 901.86 -3120 -5174 -8682 -404 -2853 -689 6108 3389 26 -219 5135 -2085 5597 1210 1003 -4643 -1806 600 1104 2140 1493 2237 1277 -362 888 -648 404 -525 4172 2310 1676 4073 314 -2324 -1607 -323 -1709 -1849 833 -1827 -1985 -1139 -1577 -725 -1407 -411 -1101 -638 -1359 422 883 654 941 1011 365 1226 961 1446 1124 801 706 1698 769 656 -85 578 869 348 849 1197 -699 -816 -783 -514 450 -407 916 -2808 573 690 -201 -1199 -1091 -815 -943 -763 -413 -382 -751 119 379 331 990 778 2209 485 805 403 -171 29 -186 -396 117 188 -1080 -823 -635 -731 -229 240 224 -558 -250 -113 20 166 430 903 52 -229 -585 -295 -403 169 1073 583 928 1505 501 910 463 98 -13 -57 -476 -83 230 -234 -538 -110 -314 -365 -8 -454 -829 -1458 -59 -408 -93 801 504 4 -38 848 -384 1047 267 242 -1291 -513 173 328 647 450 691 406 -119 303 -231 141 -176 1301 720 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