File name: Pandora53s1_Potchefstroom-METSI_20230619_L2Fit_fout2c2d20230223p1-8.txt File generation date: 20240824T145426.3Z 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_20230619_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: 20230619 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 20230619T061250.7Z 8570.258920 101 1 50.61 2 76.49 54.80 89.98 58.11 0.00 1 0.00 1 0 25 1.929e-01 8.870e-03 9.290e-02 3.620e-03 4.670678e-01 1.883545e-03 4.767562e-03 -6.000000e+00 1.139351e-01 225.00 -2.00 3.06 -2.00 319.44 0.00e+00 9.784670e-05 5.209841e-04 1.950432e-04 -6.000000e+00 5.029770e-03 279.51 -2.00 20.00 -2.00 318.81 0.00e+00 4.182 0.000 302.00 328.00 3 4.6656e+00 5.2919e-03 4.0878e-02 -6.0000e+00 2.8133e-01 3.5898e-04 6.2115e-03 2.1018e-02 -6.0000e+00 3.0537e-01 -2.8299e-02 4.9353e-03 1.0488e-02 -6.0000e+00 1.8200e-01 4.2987e-03 2.5864e-03 3.0652e-03 -6.0000e+00 7.7018e-02 8.6688e-05 1.2406e-04 1.1106e-04 3.8307e-05 -6.0000e+00 5.8513e-03 1.1925e-02 0.0000e+00 11 9 0 11 32 0 92.63 16.21 0.27 0.01193 0.01286 15 3 1 5 0 3373.310 19.54 15.01 16.21 15.68 39.60 14.3 847.54 41758 -67880 -54045 149581 -27250 9201 37943 6012 -35325 -12449 22304 -21785 103062 29898 -336 -36718 12824 -1701 11992 -8542 4092 6616 6047 -5215 -2537 1288 -13508 11026 7736 7063 -2514 3122 -2824 -8706 3052 -9406 206 -4063 71 1863 -8044 543 -2305 4261 -3025 2807 -3377 1226 1484 173 1414 1626 1151 4808 244 1039 2890 4539 -414 2228 -1782 3085 1572 1847 819 72 -735 1182 -249 791 1377 -2198 -1539 1106 145 -345 -1177 894 -1303 1732 -1131 -996 -1202 -1884 -1679 -38 -247 10 -193 143 -179 1097 36 -131 921 -10 818 995 80 560 -290 -1290 -348 -358 -318 -1288 -684 -1117 -540 530 72 -135 599 360 574 -198 -59 -109 339 -255 346 -319 -157 -51 645 978 5 1255 296 926 532 321 -356 -271 -834 153 -199 -301 -25 232 -164 -89 -265 451 -2286 -1665 656 -601 143 488 117 -1136 -344 472 -765 1295 891 -16 -2773 668 -108 725 -648 281 450 432 -449 -229 118 -1412 898 634 600 -261 347 -362 -1247 383 -1338 29 -684 14 411 -2147 146 -651 1151 -887 783 -1008 352 434 54 467 573 442 1911 105 459 1286 1991 -188 976 -836 1454 831 1037 481 41 -412 655 -147 509 970 -1653 -1152 790 98 -216 -699 509 -792 1139 -860 -834 -1059 -1779 -1658 -38 -261 11 -211 151 -181 1039 33 -120 878 -10 939 1236 104 734 -370 -1560 -403 -414 -383 -1638 -895 -1532 -764 795 114 -220 963 565 871 -292 -86 -161 522 -408 560 -511 -249 -78 963 1419 8 1773 440 1478 895 554 -634 -498 -1589 301 -400 -617 -52 464 -323 -170 -500 SS 20230619T061959.4Z 8570.263882 104 1 50.40 2 75.19 53.77 88.68 57.32 0.00 1 0.00 1 0 17 1.423e-01 9.267e-03 4.657e-02 3.172e-03 4.330320e-01 1.644110e-03 4.467819e-03 -6.000000e+00 8.405230e-02 225.00 -2.00 3.06 -2.00 319.10 0.00e+00 -4.932799e-04 4.113467e-04 2.304259e-04 -6.000000e+00 3.710478e-03 279.51 -2.00 20.00 -2.00 318.47 0.00e+00 3.838 0.000 302.00 328.00 3 4.7648e+00 4.5470e-03 3.7640e-02 -6.0000e+00 2.0754e-01 -2.4546e-02 5.2744e-03 1.9509e-02 -6.0000e+00 2.2528e-01 1.2769e-02 4.0143e-03 9.6987e-03 -6.0000e+00 1.3427e-01 -1.5916e-02 2.1171e-03 2.7829e-03 -6.0000e+00 5.6819e-02 1.0825e-04 1.4675e-05 9.7835e-05 3.4837e-05 -6.0000e+00 4.3165e-03 1.1770e-02 0.0000e+00 11 9 0 11 32 0 98.31 16.29 0.27 0.01177 0.01188 16 3 1 5 0 3149.430 19.64 15.00 16.29 16.24 43.60 14.4 851.41 3709 -31133 -25796 40445 -18804 -67806 65328 -4065 19591 1309 75625 -8258 82022 13598 -2893 -22002 -209 10351 4315 4044 7811 9620 18342 -7985 2024 -2781 -2634 10904 13512 6266 -1990 11658 -2142 -1395 -2831 -2775 -296 -3155 -2139 -4622 -5638 -1684 -1752 866 -323 2206 -2112 -1449 -1285 1345 650 978 -281 3131 510 -352 2666 2644 2144 1087 136 645 1408 1182 318 -32 65 1303 -152 2490 -1303 -965 -1211 854 1008 -921 53 -6913 -330 232 -669 -261 -1453 -713 -1495 320 -519 554 324 -179 104 905 1275 87 2440 366 599 1207 -5 882 -990 -558 -12 -395 -780 -806 -798 -841 -202 -304 357 10 220 85 108 226 -149 145 68 18 -15 -354 -758 -235 960 493 463 781 765 826 604 90 -215 -359 -1206 263 -387 16 54 136 -17 -265 146 74 -945 -779 646 -495 -2799 831 -111 490 41 1263 -329 1631 591 -176 -1803 -15 724 341 336 644 793 1446 -861 213 -323 -309 1111 1299 662 -244 1406 -321 -218 -441 -433 -49 -632 -500 -1277 -1725 -531 -576 283 -108 722 -724 -495 -445 471 241 395 -121 1403 242 -175 1318 1311 1052 535 69 345 807 736 201 -20 39 779 -97 1699 -997 -760 -960 650 727 -627 34 -4567 -217 165 -527 -225 -1359 -692 -1533 338 -574 616 362 -198 109 892 1199 82 2386 394 691 1498 -7 1172 -1274 -681 -14 -466 -949 -1025 -1052 -1156 -291 -460 561 16 353 132 162 326 -216 214 103 28 -24 -562 -1193 -360 1412 708 651 1104 1124 1286 987 153 -372 -641 -2242 501 -758 31 107 266 -32 -490 265 SS 20230619T063309.5Z 8570.273027 107 1 50.27 2 72.85 51.79 86.30 55.82 0.00 1 0.00 1 0 17 4.198e-02 6.693e-03 1.750e-02 2.446e-03 3.786112e-01 1.262705e-03 3.932403e-03 -6.000000e+00 2.480236e-02 225.00 -2.00 3.06 -2.00 318.43 0.00e+00 3.148117e-04 2.555774e-04 1.169220e-04 -6.000000e+00 1.094706e-03 279.51 -2.00 20.00 -2.00 317.78 0.00e+00 3.342 0.000 302.00 328.00 3 4.7881e+00 3.4033e-03 3.2776e-02 -6.0000e+00 6.1242e-02 -2.2484e-02 3.8766e-03 1.6933e-02 -6.0000e+00 6.6473e-02 2.4711e-03 2.6386e-03 8.3927e-03 -6.0000e+00 3.9618e-02 -8.1906e-03 1.3785e-03 2.4493e-03 -6.0000e+00 1.6769e-02 1.6904e-04 1.9660e-04 7.5514e-05 3.0189e-05 -6.0000e+00 1.2735e-03 1.0506e-02 0.0000e+00 11 8 0 10 0 0 95.19 16.42 0.23 0.01051 0.01198 19 4 1 5 0 2645.340 19.75 15.00 16.42 17.34 42.30 14.4 858.54 914 -19275 -10805 6275 -6796 -342 24040 332 -897 -1603 14065 -2742 24401 4486 -17 -11953 1325 733 2074 -1444 2969 6298 3060 -2771 -2749 403 -3122 3543 4538 3726 1802 2019 -1187 -2385 -2601 -3875 -858 -3290 -1720 -2920 -3394 -745 -981 1180 -1854 -438 -1476 -1969 -234 -995 409 203 1079 2499 1049 1159 1325 1777 1172 758 -502 2196 1358 1301 1006 246 246 399 293 1133 -590 809 -332 985 -45 -720 38 -1334 -1432 696 -770 -310 -999 -1492 -1566 -837 -246 211 40 -5 59 462 440 76 986 287 608 595 -104 658 -464 -851 -424 -69 -580 -851 -475 -1139 -265 64 350 74 429 -84 -152 132 -95 -133 402 -36 -45 -195 -88 -108 817 599 280 1047 413 863 502 468 -289 -217 -451 -161 -52 -170 203 -178 -193 -270 -220 36 -1011 -542 263 -301 -14 834 16 -47 -91 729 -176 1406 354 -2 -1436 151 90 264 -199 401 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