File name: Pandora53s1_Potchefstroom-METSI_20240321_L2Fit_fout2c0d20220413p1-8.txt File generation date: 20240322T012137.9Z 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_20240321_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: 20240321 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 20240321T051004.1Z 8846.215326 175 1 5.86 2 78.70 83.79 146.13 267.15 0.00 1 0.00 1 0 25 2.207e-01 1.085e-02 2.182e-01 7.683e-03 5.636861e-01 4.127596e-03 5.772220e-03 -6.000000e+00 1.334485e-01 227.25 -2.00 3.06 -2.00 319.99 0.00e+00 9.177802e-04 1.405621e-03 1.352034e-03 -6.000000e+00 6.068936e-03 283.83 -2.00 20.00 -2.00 319.32 0.00e+00 4.934 0.001 302.00 328.00 3 3.5942e+00 1.2133e-02 4.9210e-02 -6.0000e+00 3.3035e-01 3.7078e-02 1.4800e-02 2.7534e-02 -6.0000e+00 3.5796e-01 -5.3697e-02 1.2800e-02 1.2817e-02 -6.0000e+00 2.1344e-01 1.2189e-02 6.5403e-03 4.0681e-03 -6.0000e+00 8.9561e-02 1.2177e-04 -8.0888e-04 2.3515e-04 4.8030e-05 -6.0000e+00 7.0104e-03 -2.3183e-02 -2.5836e-04 12 9 9 12 5 5 -8.81 17.96 0.42 -0.02318 -0.02926 4 8 1 5 0 1171.670 20.96 15.00 17.96 24.13 50.40 16.9 879.98 -74079 -77977 -45002 137937 900000 -27585 11452 -45197 -24032 -49279 -33996 -13199 35006 125883 -13095 -4086 -21818 -23157 17810 -10633 39068 -23119 42028 -20391 -22710 -6287 -11529 3580 -17070 -1748 2057 35162 -7219 6077 -8523 -4822 6871 -4959 10160 -5716 573 -4292 408 2381 -1691 211 -3451 4062 -1437 1893 2585 263 -2258 3904 129 -99 1394 426 2050 -2577 1275 5195 -246 4111 -1578 2695 170 2575 2156 904 -938 -1859 1066 -3125 3289 -292 2775 -3212 1231 340 -1439 597 -2443 -397 -2103 -784 -1396 374 -1095 -116 1525 610 2309 192 3807 595 565 -207 -1320 630 -822 927 604 -723 -1046 -1655 343 -817 -808 -216 645 -1352 485 -59 882 428 810 415 -287 -1124 -1061 -874 -169 332 1047 276 1070 1677 1823 -134 309 67 -672 225 -396 626 -527 485 -319 -188 52 -51 -660 -1059 -1328 -582 1033 900000 -282 86 -677 -327 -940 -602 -216 429 943 -392 -131 -858 -1012 606 -465 1171 -1212 1317 -1184 -1460 -361 -705 185 -1087 -101 131 1866 -658 512 -830 -461 643 -619 1319 -945 100 -848 81 473 -356 44 -764 854 -332 451 669 77 -742 1300 44 -35 501 155 722 -946 467 1990 -111 1938 -765 1327 84 1284 1100 526 -608 -1193 706 -2057 1876 -157 1454 -1672 669 215 -1002 459 -1998 -341 -1957 -766 -1364 369 -1094 -118 1431 540 1928 166 3476 602 652 -256 -1689 797 -1052 1071 691 -838 -1216 -2054 441 -1077 -1155 -321 987 -2213 780 -92 1356 634 1191 635 -444 -1828 -1734 -1395 -270 512 1538 393 1546 2472 2788 -221 527 123 -1240 434 -784 1290 -1133 1009 -668 -398 105 -102 -1288 SS 20240321T065416.6Z 8846.287692 242 1 1.56 2 56.03 69.72 167.56 240.20 0.00 1 0.00 1 0 17 9.651e-03 7.465e-03 3.879e-03 2.453e-03 2.117018e-01 1.313631e-03 2.270803e-03 -6.000000e+00 5.820561e-03 227.24 -2.00 3.06 -2.00 315.31 0.00e+00 7.494706e-05 1.226053e-04 2.268016e-05 -6.000000e+00 2.607654e-04 283.82 -2.00 20.00 -2.00 314.67 0.00e+00 1.784 0.000 302.00 328.00 3 3.3609e+00 3.3683e-03 1.7771e-02 -6.0000e+00 1.4420e-02 -7.7617e-03 3.7417e-03 9.4843e-03 -6.0000e+00 1.5627e-02 1.1187e-03 2.1408e-03 4.6619e-03 -6.0000e+00 9.3255e-03 -2.5736e-03 9.4248e-04 1.3027e-03 -6.0000e+00 3.9109e-03 3.2385e-03 -1.1707e-03 7.8175e-05 2.0165e-05 -6.0000e+00 3.0473e-04 -2.4458e-02 -4.8234e-04 12 9 1 12 5 5 -94.26 18.18 0.23 -0.02446 -0.03326 5 36 1 5 0 258.170 21.17 14.98 18.18 27.84 52.40 17.0 903.71 -1496 -1437 -2029 -3796 -533 354 8 2341 1680 -1025 904 634 645 1237 -186 -249 -501 -167 -399 1208 240 887 1097 -1230 1732 567 -195 -371 -286 -3022 1531 2644 1039 -879 -385 504 -225 -533 562 -636 -1111 -981 -1419 -1447 -559 -1374 -727 -893 -183 671 981 1453 1353 776 554 511 87 721 553 1321 1289 1556 1359 48 -342 479 -396 829 710 818 -214 -709 -253 -368 38 126 756 339 1228 8 -336 -1264 -1604 -1356 -936 -964 -557 -650 -1145 -225 180 92 960 1296 1157 590 216 -571 -431 -395 -426 -168 528 420 -303 -363 -766 -725 -366 -162 -172 -304 -100 -289 730 780 1016 1035 461 -687 -757 -103 -169 193 856 1039 974 1423 1151 253 297 -128 54 431 -187 -468 147 -242 -716 -243 -243 -475 -321 -435 -416 -591 -1134 -142 90 2 674 530 -322 281 204 227 454 -77 -105 -220 -75 -186 570 116 428 538 -608 870 295 -100 -182 -140 -1490 744 1277 536 -467 -197 255 -124 -324 359 -448 -820 -758 -1128 -1160 -443 -1088 -559 -669 -139 508 736 1148 1081 651 479 433 75 615 467 1155 1117 1430 1287 47 -328 443 -358 723 653 797 -212 -737 -263 -370 37 116 653 291 1076 8 -324 -1300 -1709 -1523 -1077 -1147 -675 -812 -1439 -270 208 104 1026 1332 1233 663 251 -707 -543 -495 -522 -199 613 499 -373 -460 -993 -953 -488 -228 -244 -435 -138 -385 944 979 1254 1322 611 -922 -1050 -142 -227 256 1108 1317 1183 1766 1447 330 394 -175 73 603 -269 -689 223 -366 -1094 -365 -363 -690 -470 SS 20240321T065912.4Z 8846.291116 245 1 9.01 2 55.00 68.90 168.46 237.03 0.00 1 0.00 1 0 17 9.515e-03 7.602e-03 3.863e-03 2.437e-03 2.058942e-01 1.304802e-03 2.225680e-03 -6.000000e+00 5.743501e-03 227.24 -2.00 3.06 -2.00 315.29 0.00e+00 8.467641e-05 1.213381e-04 2.382644e-05 -6.000000e+00 2.572309e-04 283.82 -2.00 20.00 -2.00 314.66 0.00e+00 1.739 0.000 302.00 328.00 3 5.1154e+00 3.3470e-03 1.7334e-02 -6.0000e+00 1.4229e-02 -1.8687e-04 3.7202e-03 9.2785e-03 -6.0000e+00 1.5416e-02 5.0646e-03 2.1266e-03 4.5649e-03 -6.0000e+00 9.2000e-03 -3.6194e-03 9.3490e-04 1.2816e-03 -6.0000e+00 3.8607e-03 5.8524e-04 -1.5540e-04 7.7793e-05 1.9833e-05 -6.0000e+00 3.0046e-04 -2.4703e-02 -3.0440e-04 12 9 1 12 5 5 94.71 18.18 0.23 -0.02470 -0.02587 5 6 1 5 0 1499.660 21.17 15.03 18.18 28.17 52.40 17.0 906.02 -1104 -2121 -3009 -1613 -838 -843 1035 1725 1740 526 -718 -269 1925 1482 498 -1181 645 384 114 -814 203 -67 515 -202 533 171 -412 947 1759 1976 1630 2462 807 -1304 -111 88 15 234 -41 -1821 -1543 -858 -1377 -1741 -1444 -1456 -1181 -1106 -387 887 633 1166 839 270 664 512 1003 198 914 1217 1331 899 1119 190 87 339 370 1036 1672 865 -270 -88 -112 -877 65 102 399 308 807 411 -797 -1187 -1315 -1089 -1092 -750 -773 -724 -1212 -460 480 565 658 1308 1667 700 380 19 -444 -414 -358 -171 593 365 -305 -650 -855 -701 -57 -528 -358 -571 -309 -494 542 928 825 759 2 -371 -499 -38 -210 -68 1361 875 1155 1288 1013 888 627 100 116 112 -145 -459 -161 -402 -483 -450 -447 -328 -29 -315 -630 -901 -463 -219 -220 277 489 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