File name: Pandora159s1_Wakkerstroom_20211113_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T034007.3Z 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_20211113_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: 20211113 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 20211113T043407.2Z 7987.190361 136 1 6.53 2 70.96 100.94 138.98 200.23 0.00 1 0.00 1 0 17 4.749e-02 1.009e-02 5.457e-02 6.484e-03 3.930518e-01 3.256261e-03 4.051101e-03 -6.000000e+00 2.701664e-02 228.23 -2.00 3.06 -2.00 318.72 0.00e+00 1.558547e-03 7.046188e-04 1.327755e-04 -6.000000e+00 1.181084e-03 279.77 -2.00 20.00 -2.00 318.05 0.00e+00 3.030 0.000 302.00 328.00 3 4.1272e+00 8.8798e-03 3.0412e-02 -6.0000e+00 6.7278e-02 5.4373e-02 1.0187e-02 1.7898e-02 -6.0000e+00 7.3099e-02 3.2071e-04 7.2536e-03 8.8252e-03 -6.0000e+00 4.3450e-02 -6.0587e-03 3.8316e-03 2.8948e-03 -6.0000e+00 1.8396e-02 4.2444e-04 -4.1770e-04 1.8239e-04 2.8407e-05 -6.0000e+00 1.2696e-03 -2.9388e-03 12 9 9 12 9 1 99.67 19.16 0.39 -0.00294 -0.00608 3 7 1 8 0 1587.620 15.00 19.16 19.23 21.48 21.48 18.0 888.32 8237 -8782 -19370 8613 1616 5002 -8066 -8235 13441 -19175 22409 -11207 12572 -14816 6609 -791 439 11579 -75 4847 -1165 10885 1609 723 -7724 1865 -4073 5173 -9804 -1987 2504 669 4570 -4137 -4225 1769 -1069 -813 87 -2079 9 -182 -1078 -2105 -1069 -3053 723 247 1690 3823 -1269 2468 -1164 157 -725 1964 -815 1395 -151 1164 1671 2150 3385 -1445 -540 -178 1402 -1043 1580 230 1947 -680 110 -223 239 37 -112 2429 716 740 -866 -694 -2407 -762 -2008 -868 -469 -1522 -90 -170 777 -589 1590 2599 2809 343 840 -273 -988 105 -1017 325 1459 510 -2220 -855 97 -449 -467 392 -598 105 209 133 380 1110 1306 316 692 -1174 -859 270 -331 -314 668 -185 727 2895 -167 -435 409 -977 -513 803 154 -631 -604 130 -93 340 447 -900 324 256 -359 -909 297 54 158 -307 -356 529 -1082 864 -635 662 -1210 519 -75 44 1116 -9 550 -143 1197 198 96 -1183 272 -628 699 -1465 -282 375 114 828 -843 -820 320 -216 -191 24 -683 3 -68 -418 -833 -421 -1236 282 97 654 1489 -550 1120 -579 81 -392 1064 -460 772 -83 629 923 1268 2148 -1020 -384 -120 888 -672 1061 174 1566 -577 92 -181 181 26 -72 1508 477 552 -727 -632 -2351 -764 -2133 -962 -541 -1802 -105 -194 835 -600 1504 2421 2766 376 1000 -355 -1355 142 -1322 391 1661 594 -2795 -1113 130 -624 -677 598 -960 171 335 204 554 1548 1817 457 1041 -1860 -1372 422 -508 -468 962 -260 978 3872 -242 -672 655 -1619 -864 1381 278 -1181 -1147 249 -178 641 816 -1606 564 SS 20211113T044756.1Z 7987.199955 143 1 50.05 2 67.94 99.56 139.92 195.47 0.00 1 0.00 1 0 25 4.962e-02 8.923e-03 4.984e-02 5.881e-03 3.524434e-01 2.967923e-03 3.660683e-03 -6.000000e+00 2.823470e-02 228.23 -2.00 3.06 -2.00 319.21 0.00e+00 -6.143375e-04 7.127981e-04 4.869677e-04 -6.000000e+00 1.234287e-03 279.77 -2.00 20.00 -2.00 318.53 0.00e+00 2.640 0.000 302.00 328.00 3 4.4320e+00 8.2589e-03 2.6833e-02 -6.0000e+00 7.0311e-02 1.4561e-02 9.5469e-03 1.6106e-02 -6.0000e+00 7.6392e-02 3.0768e-02 6.9030e-03 7.9887e-03 -6.0000e+00 4.5408e-02 -2.0334e-02 3.6155e-03 2.2775e-03 -6.0000e+00 1.9227e-02 4.5878e-04 -2.0257e-04 1.7372e-04 2.5437e-05 -6.0000e+00 1.3267e-03 -3.4750e-03 11 8 0 10 0 0 99.99 19.16 0.60 -0.00347 -0.00500 371 80 2 8 0 132.050 15.00 19.16 20.16 21.48 21.48 18.2 892.44 -1232 -21579 6122 -20546 -6349 -19659 1904 1249 4237 919 663 33888 -10283 7501 -4977 11724 -9024 4728 -5697 388 1269 -657 5118 3503 7596 1987 1118 -2952 2097 -3299 775 -4545 2189 -2334 687 682 4108 3209 -2696 1495 -3103 25 -4277 -2245 -2594 -242 -1055 882 -1260 1662 737 11 839 -671 1496 -1610 1263 -272 978 1421 4394 1451 1339 88 -1612 1452 1200 2674 929 1299 -1532 -427 -1651 839 -656 439 2068 2159 1624 600 1416 -741 -1304 -1333 -355 -1439 -557 -1783 133 -152 720 1057 1047 2902 1432 734 404 726 -1223 -478 -227 639 1032 1522 -1002 -691 -790 -1063 -36 -760 -682 -1003 -21 -363 960 907 984 512 42 -180 -1093 -49 -87 294 364 690 1150 2252 281 331 -167 234 379 383 100 -869 373 25 -320 -514 134 -536 167 -42 -978 222 -905 -224 -764 66 49 183 43 31 1248 -647 469 -404 905 -900 436 -609 41 136 -72 548 408 916 263 150 -390 251 -417 102 -698 345 -396 108 105 673 624 -667 415 -990 8 -1496 -781 -906 -83 -362 293 -428 560 267 5 352 -303 688 -787 613 -134 466 666 2058 757 765 55 -1025 845 655 1428 543 859 -1136 -327 -1278 610 -448 268 1134 1145 916 389 1027 -610 -1154 -1240 -350 -1526 -617 -2062 151 -167 728 980 900 2416 1296 743 458 909 -1658 -639 -284 723 1097 1656 -1207 -878 -1050 -1486 -52 -1206 -1148 -1731 -35 -571 1380 1234 1331 727 64 -290 -1808 -79 -137 443 523 942 1491 2912 401 510 -276 394 653 690 191 -1762 767 52 -678 -1066 265 -1021 307 SS 20211113T051057.4Z 7987.215942 155 1 7.02 2 62.88 97.26 140.97 187.17 0.00 1 0.00 1 0 25 1.209e-02 7.341e-03 5.488e-03 1.836e-03 2.887934e-01 9.227478e-04 3.058792e-03 -6.000000e+00 6.877090e-03 228.23 -2.00 3.06 -2.00 317.17 0.00e+00 3.292380e-05 1.271269e-04 6.207388e-05 -6.000000e+00 3.006702e-04 279.77 -2.00 20.00 -2.00 316.49 0.00e+00 2.182 0.000 302.00 328.00 3 2.9585e+00 2.4296e-03 2.2049e-02 -6.0000e+00 1.7126e-02 3.6548e-02 2.7292e-03 1.3025e-02 -6.0000e+00 1.8608e-02 -5.0299e-03 1.6360e-03 6.4028e-03 -6.0000e+00 1.1061e-02 -2.0527e-03 8.0393e-04 1.7889e-03 -6.0000e+00 4.6822e-03 3.1745e-03 -3.3180e-04 5.1619e-05 2.0308e-05 -6.0000e+00 3.2324e-04 -1.8400e-03 12 9 1 12 1 1 99.99 19.16 0.36 -0.00184 -0.00433 23 37 4 8 0 285.000 15.00 19.16 20.31 21.48 21.48 18.0 892.47 -3391 -329 -5126 -3872 -2975 -962 -4014 -7 -536 -1747 -2818 459 895 442 630 -2358 1368 -461 1195 -1196 395 932 1581 -474 951 383 -939 528 657 1683 1917 2587 214 -1851 -297 1129 180 90 -63 -1769 -1143 -1349 -905 -1308 -291 -1005 -432 -559 -207 827 1326 709 771 959 495 1685 86 666 632 1773 1218 1533 838 386 -1001 455 70 527 1978 -37 -150 -859 -128 -244 -567 186 786 1106 1146 -261 -882 -1005 -2068 -728 -1066 -1216 -751 -543 -431 -481 323 421 1008 2139 1513 501 809 189 -638 -560 -368 -406 840 491 -1078 -711 -557 -612 97 -192 -480 -258 -12 191 325 1335 714 694 110 -619 -577 -285 -132 -175 1015 361 1380 1702 807 12 183 -60 66 318 -428 -381 40 62 -624 -68 -241 -340 -64 -397 -41 -682 -475 -324 -98 -450 -1 -74 -255 -412 67 147 78 127 -538 316 -113 300 -319 105 246 424 -138 290 122 -300 156 182 455 551 809 75 -674 -100 366 64 35 -29 -914 -642 -796 -546 -798 -175 -609 -256 -324 -117 469 793 460 531 647 346 1193 63 482 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