File name: Pandora159s1_Wakkerstroom_20211218_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035222.5Z 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 v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20211218_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: 20211218 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 20211218T052628.9Z 8022.226724 231 1 48.06 2 60.27 102.67 130.59 279.47 0.00 1 0.00 1 0 17 1.076e-02 7.049e-03 4.604e-03 1.502e-03 2.446244e-01 7.508642e-04 2.600946e-03 -6.000000e+00 6.115108e-03 227.87 -2.00 3.06 -2.00 317.36 0.00e+00 -4.499081e-05 1.083424e-04 6.626940e-05 -6.000000e+00 2.693932e-04 281.33 -2.00 20.00 -2.00 316.63 0.00e+00 2.008 0.000 302.00 328.00 3 4.1803e+00 1.9843e-03 1.9711e-02 -6.0000e+00 1.5207e-02 3.0514e-02 2.2347e-03 1.1066e-02 -6.0000e+00 1.6521e-02 9.5669e-04 1.3424e-03 5.4427e-03 -6.0000e+00 9.8324e-03 -4.6450e-03 6.6051e-04 1.5286e-03 -6.0000e+00 4.1731e-03 1.1665e-03 -2.8257e-04 4.3068e-05 1.7396e-05 -6.0000e+00 2.8766e-04 -4.2663e-03 12 9 1 12 1 1 99.90 18.97 0.34 -0.00427 -0.00639 48 11 1 8 0 977.220 14.99 18.97 16.95 21.38 21.27 18.6 874.61 -1966 -3776 -3434 -4284 645 -927 446 1676 -383 -891 -1405 104 1091 -235 -376 -1364 -809 89 -189 836 -369 1758 2327 -667 91 -206 -277 -14 672 1894 2051 1556 1219 -1812 -188 1337 -740 715 27 -1262 -1834 -734 -1170 -1264 -216 -1252 -935 -203 -272 613 983 476 986 634 772 1293 730 256 1020 1037 1589 1266 1050 417 -1164 279 424 566 2145 236 -362 -614 -451 91 -308 238 594 681 1718 -332 -678 -1264 -1976 -903 -957 -1027 -589 -401 -315 -245 154 615 929 2066 1472 479 772 409 -787 -373 -368 -328 740 661 -1254 -873 -100 -739 -187 -21 -190 -439 -161 139 307 1217 774 770 325 -765 -759 -228 -182 -53 845 610 991 1821 660 142 182 136 120 307 -210 -363 -47 -202 -441 -265 -25 -400 73 -229 -490 -448 -527 68 -95 48 200 -52 -126 -198 15 169 -42 -77 -305 -187 21 -46 210 -96 445 596 -185 26 -62 -83 -4 176 481 546 449 379 -592 -57 388 -238 264 12 -643 -1014 -420 -685 -745 -126 -736 -539 -113 -149 334 558 290 625 423 527 896 517 181 705 711 1115 948 847 355 -1003 221 313 407 1613 201 -334 -587 -432 84 -269 189 430 470 1218 -264 -601 -1223 -2022 -952 -1069 -1215 -726 -506 -397 -300 178 652 912 1954 1462 519 909 525 -1070 -499 -468 -390 836 765 -1578 -1149 -136 -1039 -272 -32 -302 -706 -252 205 423 1575 1003 1033 462 -1153 -1167 -348 -272 -76 1166 810 1257 2298 885 201 269 205 182 482 -345 -621 -82 -358 -787 -467 -42 -667 120 SS 20211218T054217.4Z 8022.237701 239 1 48.56 2 56.84 101.30 133.91 278.21 0.00 1 0.00 1 0 17 2.087e-02 7.956e-03 1.818e-02 6.067e-03 2.297355e-01 3.037101e-03 2.460558e-03 -6.000000e+00 1.186340e-02 227.87 -2.00 3.06 -2.00 317.38 0.00e+00 3.013393e-05 4.365282e-04 7.147227e-05 -6.000000e+00 5.225818e-04 281.33 -2.00 20.00 -2.00 316.65 0.00e+00 1.822 0.000 302.00 328.00 3 6.1861e+00 8.0331e-03 1.8119e-02 -6.0000e+00 2.9501e-02 6.8418e-02 9.0445e-03 1.0426e-02 -6.0000e+00 3.2050e-02 -9.2308e-05 5.4105e-03 5.1337e-03 -6.0000e+00 1.9074e-02 -7.9969e-03 2.6497e-03 1.4476e-03 -6.0000e+00 8.0967e-03 1.8380e-04 -3.0155e-04 1.7559e-04 1.6813e-05 -6.0000e+00 5.5798e-04 -5.2338e-03 11 8 0 10 0 0 99.90 18.97 0.63 -0.00523 -0.00750 18 4 1 8 0 2674.650 15.01 18.97 17.87 21.38 21.27 18.6 878.29 -2278 -4743 -7591 3138 -3513 -4259 3353 11465 9519 -422 1264 -6294 2528 -392 472 -329 -1134 2292 1505 4122 -242 -2863 249 762 1292 2432 -3377 549 427 -140 1110 4282 -521 -4992 1254 3138 -2006 255 -232 -964 -1095 299 -983 -1514 167 -1747 -162 -2253 -235 847 397 1832 1187 -486 1529 1037 469 -186 -353 220 1621 1175 455 96 611 -373 311 189 777 -143 -444 -191 410 524 -1408 406 64 718 739 316 -390 -1114 -1747 -1257 -817 740 -75 -981 233 -139 731 -743 384 1352 2626 520 1000 -22 -224 188 -652 66 1068 225 -1329 -1046 -263 -803 -20 17 -407 257 -198 381 45 288 734 738 22 -1067 -1092 291 -175 -159 1355 115 1311 1411 508 84 89 -110 12 1189 -565 -281 -365 17 -765 -449 425 -199 390 -284 -657 -1094 381 -405 -471 365 1299 1222 -62 180 -980 399 -73 98 -75 -268 539 371 1021 -64 -765 66 211 375 722 -1051 155 112 -36 296 1191 -163 -1660 368 878 -640 93 -101 -489 -603 169 -577 -903 97 -1033 -92 -1272 -127 452 223 1085 742 -323 1025 711 328 -130 -243 151 1125 873 367 83 517 -294 225 132 575 -120 -408 -181 388 477 -1223 313 45 472 506 242 -335 -1055 -1762 -1319 -906 867 -93 -1267 297 -173 839 -788 369 1243 2503 551 1163 -28 -306 252 -830 77 1174 256 -1665 -1376 -358 -1140 -29 26 -667 422 -315 563 61 368 932 973 31 -1630 -1704 445 -262 -230 1839 151 1621 1736 667 118 130 -165 19 1851 -938 -487 -650 31 -1404 -807 734 -334 638 SS 20211218T061556.6Z 8022.261072 253 1 41.06 2 49.48 98.39 141.02 275.46 0.00 1 0.00 1 0 25 1.101e-02 7.271e-03 3.594e-03 1.782e-03 1.931707e-01 8.970524e-04 2.072278e-03 -6.000000e+00 6.257427e-03 227.87 -2.00 3.06 -2.00 316.24 0.00e+00 9.008586e-05 9.888482e-05 2.820446e-05 -6.000000e+00 2.756450e-04 281.34 -2.00 20.00 -2.00 315.56 0.00e+00 1.536 0.000 302.00 328.00 3 4.9032e+00 2.3336e-03 1.5234e-02 -6.0000e+00 1.5561e-02 4.5396e-02 2.6097e-03 8.7126e-03 -6.0000e+00 1.6905e-02 -9.0628e-03 1.5067e-03 4.2887e-03 -6.0000e+00 1.0061e-02 -5.8707e-04 6.9852e-04 1.2058e-03 -6.0000e+00 4.2706e-03 9.0514e-04 -3.7854e-04 5.0574e-05 1.4625e-05 -6.0000e+00 2.9432e-04 -5.0602e-03 12 9 1 12 1 1 99.83 18.98 0.28 -0.00506 -0.00790 19 5 1 8 0 2044.120 15.00 18.98 18.25 21.38 21.38 18.7 881.16 -2790 -1915 -4109 -3366 -2605 741 2062 1492 648 -1772 1068 676 944 83 152 -1753 545 -500 1016 811 219 1186 1211 802 839 92 -1628 358 -366 2735 2371 3229 1118 -1433 394 696 -478 -56 1097 -1434 -1316 -788 -1216 -1377 -932 -1161 -505 -562 -683 679 929 962 516 1030 7 1685 26 550 1006 1316 1588 907 857 555 -927 -47 430 846 1504 -18 30 -647 -267 21 -289 430 446 633 1124 -373 -1082 -1070 -2041 -699 -1136 -632 -609 -672 -487 -285 265 75 746 1654 1698 379 466 211 -367 -601 -214 -445 936 340 -1231 -877 835 -655 -237 4 -302 -125 -249 273 291 1133 770 618 413 -562 -678 -320 -199 -13 833 564 1230 1658 581 169 130 -54 -22 582 -310 -381 6 -60 -594 -225 -82 -462 -9 -589 -431 -945 -719 -490 129 369 302 146 -420 242 154 235 23 47 -595 187 -176 362 299 82 438 451 312 344 39 -694 140 -135 950 855 1224 459 -608 155 266 -199 -27 605 -916 -901 -555 -878 -1000 -670 -835 -353 -381 -450 440 622 682 382 787 6 1330 21 440 790 1028 1266 770 772 526 -880 -42 348 662 1226 -17 30 -660 -273 21 -272 368 350 470 851 -313 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