File name: Pandora159s1_Wakkerstroom_20231216_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240122T142041.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20231216_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20231216 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20231216T075717.9Z 8750.331457 174 1 54.12 2 26.81 87.94 70.60 105.93 0.00 1 0.00 1 0 17 9.465e-03 7.551e-03 1.536e-04 1.061e-04 1.389961e-01 5.390566e-05 1.518220e-03 -6.000000e+00 5.376604e-03 227.88 -2.00 3.06 -2.00 314.86 0.00e+00 5.997570e-04 4.532053e-06 6.368658e-05 -6.000000e+00 2.368275e-04 281.25 -2.00 20.00 -2.00 314.31 0.00e+00 1.120 0.000 302.00 328.00 3 3.0256e-01 1.3821e-04 1.1080e-02 -6.0000e+00 1.3371e-02 9.6187e-03 1.5353e-04 6.3584e-03 -6.0000e+00 1.4530e-02 -2.9402e-04 8.7680e-05 3.1097e-03 -6.0000e+00 8.6467e-03 -1.4761e-03 3.8638e-05 9.9558e-04 -6.0000e+00 3.6671e-03 1.4207e-01 -4.1512e-04 2.9630e-06 1.2369e-05 -6.0000e+00 2.5309e-04 -1.7443e-04 11 8 0 10 0 0 60.88 19.77 0.31 -0.00017 -0.00329 3433 738 2 8 0 14.290 15.00 19.77 25.87 21.98 21.88 27.7 894.98 -1219 -1507 -2331 -3174 -542 558 1371 1692 870 -958 -149 1375 297 427 304 -1120 -25 115 368 682 -43 1070 1494 648 646 70 -803 -128 1169 2363 2010 2394 1382 -1687 -371 646 -280 482 -181 -1427 -1626 -1024 -1226 -1268 -578 -1230 -986 -509 -582 710 907 629 953 634 515 1160 501 486 842 1091 1464 1087 862 336 -1015 60 126 756 1756 159 -227 -384 -347 -115 -319 342 462 965 1289 -326 -725 -1306 -2092 -871 -1062 -1036 -635 -588 -387 -417 331 220 918 1864 1322 674 727 237 -739 -514 -227 -126 823 751 -958 -646 -585 -692 -64 -58 -217 -300 -68 171 429 1115 729 627 297 -503 -713 -191 -145 85 923 495 1202 1660 593 391 158 -25 103 389 -235 -393 -62 -127 -589 -242 -209 -438 -165 -435 -574 -890 -1121 -164 157 399 549 312 -360 -54 485 114 183 145 -574 -13 60 196 371 -24 577 807 366 349 39 -442 -71 589 1128 984 1230 758 -957 -193 322 -152 278 -125 -1145 -1300 -843 -1030 -1069 -480 -1020 -789 -421 -461 546 721 531 773 535 443 1004 441 425 722 929 1282 1020 870 330 -1067 56 107 661 1485 154 -241 -394 -356 -122 -319 305 398 771 1052 -300 -688 -1360 -2319 -924 -1208 -1266 -817 -728 -479 -533 388 251 934 1786 1324 741 815 292 -970 -661 -272 -139 926 883 -1159 -825 -778 -893 -86 -82 -317 -438 -94 232 528 1269 891 744 381 -701 -961 -255 -203 113 1153 589 1441 1962 745 485 204 -32 136 527 -339 -560 -91 -189 -893 -358 -300 -611 -241 SS 20231216T080230.4Z 8750.335074 176 1 54.19 2 25.65 87.24 69.53 105.45 0.00 1 0.00 1 0 17 9.467e-03 7.562e-03 1.522e-04 1.059e-04 1.378372e-01 5.376834e-05 1.512647e-03 -6.000000e+00 5.377248e-03 227.88 -2.00 3.06 -2.00 314.84 0.00e+00 6.875403e-04 4.504359e-06 6.882326e-05 -6.000000e+00 2.368556e-04 281.25 -2.00 20.00 -2.00 314.29 0.00e+00 1.109 0.000 302.00 328.00 3 3.0830e-01 1.3776e-04 1.0989e-02 -6.0000e+00 1.3373e-02 9.1661e-03 1.5296e-04 6.3419e-03 -6.0000e+00 1.4532e-02 -1.6825e-04 8.7447e-05 3.0979e-03 -6.0000e+00 8.6477e-03 -1.2734e-03 3.8595e-05 1.0280e-03 -6.0000e+00 3.6675e-03 1.4282e-01 -4.0827e-04 2.9589e-06 1.2248e-05 -6.0000e+00 2.5311e-04 -2.3464e-04 11 8 0 10 0 0 48.98 19.78 0.31 -0.00023 -0.00330 3379 727 2 8 0 14.520 15.01 19.78 27.19 21.98 21.88 28.0 902.21 -1198 -1402 -2339 -3158 -522 569 1396 1738 925 -954 -46 1380 290 424 286 -1178 46 121 350 756 -37 1082 1470 639 611 53 -815 -111 1153 2347 1975 2425 1384 -1712 -326 615 -279 416 -188 -1468 -1637 -1042 -1228 -1253 -566 -1215 -986 -569 -591 726 878 620 949 620 483 1159 477 472 829 1085 1457 1055 855 290 -1020 13 123 738 1741 132 -234 -394 -342 -127 -340 341 441 941 1280 -356 -738 -1315 -2104 -895 -1090 -1046 -644 -598 -387 -417 316 213 931 1870 1305 656 743 249 -723 -512 -231 -125 836 760 -967 -640 -579 -680 -61 -74 -221 -292 -63 157 444 1097 741 615 306 -513 -709 -197 -142 86 933 494 1200 1695 601 403 168 -32 101 392 -251 -406 -67 -115 -595 -249 -226 -434 -153 -436 -544 -911 -1137 -161 163 414 573 338 -364 -17 494 114 185 138 -614 24 64 189 382 -19 592 806 336 335 30 -455 -63 590 1136 981 1263 769 -985 -171 311 -154 243 -132 -1101 -1325 -868 -1045 -1069 -476 -1020 -800 -439 -474 566 707 488 778 529 421 1015 425 418 718 935 1290 1002 872 289 -1007 12 106 653 1487 129 -250 -409 -354 -137 -344 308 384 759 1055 -306 -708 -1382 -2187 -959 -1252 -1291 -782 -748 -484 -538 374 227 956 1809 1319 727 840 309 -959 -664 -279 -139 950 837 -1181 -824 -777 -885 -82 -105 -325 -430 -88 216 549 1259 847 736 395 -673 -965 -265 -200 115 1174 593 1451 2020 707 504 219 -42 134 536 -341 -582 -98 -173 -909 -373 -328 -610 -210 SS 20231216T080846.6Z 8750.339429 179 1 53.88 2 24.26 86.35 68.24 104.88 0.00 1 0.00 1 0 17 9.498e-03 7.554e-03 1.552e-04 1.077e-04 1.360195e-01 5.468628e-05 1.487274e-03 -6.000000e+00 5.395151e-03 227.88 -2.00 3.06 -2.00 314.85 0.00e+00 6.781623e-04 4.584279e-06 7.018875e-05 -6.000000e+00 2.376428e-04 281.25 -2.00 20.00 -2.00 314.30 0.00e+00 1.097 0.000 302.00 328.00 3 3.5237e-01 1.4026e-04 1.0850e-02 -6.0000e+00 1.3417e-02 8.1837e-03 1.5576e-04 6.2498e-03 -6.0000e+00 1.4580e-02 6.2419e-04 8.8959e-05 3.0457e-03 -6.0000e+00 8.6764e-03 -1.5010e-03 3.9138e-05 1.0084e-03 -6.0000e+00 3.6798e-03 1.3859e-01 -3.7583e-04 3.0216e-06 1.2213e-05 -6.0000e+00 2.5395e-04 -4.1494e-04 11 8 0 10 0 0 93.17 19.78 0.32 -0.00041 -0.00324 3421 736 2 8 0 14.340 15.01 19.78 28.68 21.98 21.88 28.1 909.13 -1190 -1452 -2357 -3197 -533 525 1448 1739 929 -973 -129 1402 316 443 264 -1181 -15 132 352 667 -60 1023 1524 647 632 87 -804 -127 1157 2361 2002 2408 1367 -1696 -345 675 -256 482 -143 -1450 -1635 -1050 -1210 -1268 -547 -1222 -985 -502 -563 754 891 647 968 647 508 1160 486 464 837 1095 1473 1127 853 333 -1008 51 121 749 1741 164 -236 -393 -345 -140 -333 350 448 948 1279 -319 -729 -1294 -2105 -850 -1072 -1010 -634 -584 -363 -401 326 235 949 1880 1348 688 751 251 -737 -500 -204 -123 856 766 -954 -626 -566 -667 -45 -54 -222 -294 -69 152 426 1102 721 616 285 -497 -703 -176 -137 78 935 493 1201 1677 609 393 145 -24 99 390 -261 -405 -63 -112 -580 -239 -219 -426 -142 -431 -560 -913 -1145 -163 149 427 570 337 -369 -47 499 123 192 127 -610 -8 69 188 365 -34 555 827 367 343 49 -444 -71 585 1130 983 1239 751 -964 -179 336 -139 278 -99 -1163 -1306 -863 -1015 -1067 -454 -1012 -788 -414 -445 579 706 544 782 544 435 1000 426 405 713 929 1283 1052 856 351 -1054 48 103 651 1462 158 -248 -401 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