File name: Pandora159s1_Wakkerstroom_20220124_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035445.5Z 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_20220124_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: 20220124 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 20220124T051610.5Z 8059.219566 201 1 49.06 2 67.37 100.70 42.01 298.66 0.00 1 0.00 1 0 25 2.197e-02 7.262e-03 1.439e-02 2.953e-03 2.941616e-01 1.476037e-03 3.099046e-03 -6.000000e+00 1.247750e-02 227.64 -2.00 3.06 -2.00 318.28 0.00e+00 3.358782e-04 2.747650e-04 7.211694e-05 -6.000000e+00 5.530125e-04 282.62 -2.00 20.00 -2.00 317.53 0.00e+00 2.578 0.000 302.00 328.00 3 4.7620e+00 3.9808e-03 2.4792e-02 -6.0000e+00 3.0999e-02 4.3783e-02 4.5278e-03 1.3354e-02 -6.0000e+00 3.3675e-02 2.5850e-03 2.9203e-03 6.5650e-03 -6.0000e+00 2.0060e-02 -6.5449e-03 1.5024e-03 1.8643e-03 -6.0000e+00 8.5294e-03 3.8004e-04 -4.6491e-04 8.5626e-05 2.0595e-05 -6.0000e+00 5.8731e-04 -5.1528e-03 11 9 0 11 8 0 98.28 19.06 0.23 -0.00515 -0.00865 17 4 1 8 0 2885.310 15.00 19.06 18.71 21.38 21.38 19.5 880.73 3808 -12405 -869 -8582 2167 -3569 -8571 -7236 3541 3576 -5186 3781 -4625 3621 1184 -1367 226 -1319 -412 907 -4213 -154 1188 -649 3353 -1592 -2494 -1484 1802 2965 2887 1301 1211 -2181 718 2823 705 1256 -1997 -1222 -1537 -244 -3323 -797 97 -710 -869 83 261 1002 1398 517 1468 535 874 1622 304 248 1369 938 1219 1036 1285 634 -535 378 -428 496 1190 797 -465 213 -228 148 -309 778 791 1122 1412 -611 -401 -1694 -1916 -1105 -695 -851 -874 -696 120 -394 10 404 747 1797 1927 865 216 579 -993 -556 -384 -132 1084 167 -1205 -1199 -630 -825 160 282 -113 -319 -64 302 324 875 1102 505 294 -328 -353 112 -601 -213 234 589 1179 1936 773 65 130 52 99 79 -376 -625 251 25 -445 -543 116 -380 327 235 -988 -63 -635 130 -217 -583 -548 271 287 -451 312 -468 393 151 -198 34 -210 -68 153 -763 -27 208 -123 649 -335 -529 -295 327 528 549 275 278 -533 161 606 168 349 -682 -481 -663 -109 -1569 -372 45 -331 -401 37 115 445 655 262 780 301 507 956 185 150 806 550 734 670 897 474 -406 266 -284 319 810 613 -393 186 -199 125 -246 557 516 698 916 -451 -331 -1555 -1868 -1115 -740 -964 -1041 -850 146 -466 11 411 704 1634 1849 918 254 739 -1355 -751 -490 -156 1208 191 -1502 -1575 -856 -1166 233 438 -184 -531 -103 459 459 1170 1465 702 434 -511 -560 177 -927 -317 333 805 1531 2499 1073 96 202 82 160 132 -662 -1152 468 47 -857 -1026 212 -674 564 SS 20220124T053305.8Z 8059.231317 210 1 51.63 2 63.67 99.04 45.26 294.93 0.00 1 0.00 1 0 25 1.095e-02 7.102e-03 9.558e-04 3.031e-04 2.582841e-01 1.512785e-04 2.735478e-03 -6.000000e+00 6.220180e-03 227.64 -2.00 3.06 -2.00 317.42 0.00e+00 1.194392e-04 2.233352e-05 6.254406e-05 -6.000000e+00 2.756707e-04 282.62 -2.00 20.00 -2.00 316.68 0.00e+00 2.242 0.000 302.00 328.00 3 1.1090e+00 4.0035e-04 2.1601e-02 -6.0000e+00 1.5453e-02 1.8738e-02 4.5119e-04 1.1678e-02 -6.0000e+00 1.6787e-02 -8.0542e-04 2.7256e-04 5.7250e-03 -6.0000e+00 9.9999e-03 -2.8060e-03 1.3475e-04 1.6054e-03 -6.0000e+00 4.2522e-03 2.0581e-02 -3.2940e-04 8.6267e-06 1.8339e-05 -6.0000e+00 2.9276e-04 -5.6280e-03 11 8 0 10 0 0 99.90 19.06 0.25 -0.00563 -0.00810 848 182 2 8 0 57.800 15.00 19.06 20.02 21.38 21.38 19.9 889.48 -2524 -2716 -3759 -4875 -2472 -980 -699 688 -469 -1657 -1441 869 -313 232 4 -1285 -263 -342 107 266 -273 805 1576 447 466 -158 -877 -474 1016 2284 2039 2405 1237 -1782 -734 737 -448 517 -130 -1292 -1615 -994 -1165 -1081 -362 -1006 -663 -451 -413 781 1154 606 1055 692 569 1238 553 435 785 1128 1581 1355 1091 566 -932 292 334 901 1829 268 -234 -429 -450 -225 -341 425 684 1051 1454 -197 -612 -1205 -2088 -987 -1092 -1034 -711 -621 -436 -424 345 372 996 1977 1396 698 693 254 -805 -643 -349 -253 882 763 -987 -722 -690 -702 -39 -91 -304 -357 -109 121 427 1205 834 674 204 -594 -823 -204 -169 -21 858 463 1218 1736 606 316 150 -49 102 377 -225 -383 -29 -83 -564 -247 -154 -347 10 -269 -317 -452 -553 -268 -100 -75 83 -64 -238 -204 123 -46 39 1 -273 -58 -78 25 65 -68 197 389 118 131 -46 -256 -130 255 555 525 671 378 -574 -220 212 -142 190 -58 -677 -851 -545 -657 -614 -204 -568 -366 -264 -236 444 631 358 657 454 385 851 390 306 538 765 1098 1014 890 494 -824 235 248 646 1389 234 -208 -399 -418 -200 -307 341 493 715 1029 -160 -561 -1133 -2114 -1035 -1226 -1245 -902 -754 -529 -535 399 392 1029 1955 1467 753 830 315 -1071 -844 -460 -304 992 888 -1270 -982 -910 -968 -56 -140 -493 -549 -173 177 572 1618 1116 944 286 -897 -1277 -311 -251 -30 1235 637 1574 2228 840 440 220 -74 156 597 -380 -636 -50 -144 -993 -425 -254 -592 16 SS 20220124T053921.3Z 8059.235664 213 1 13.26 2 62.29 98.43 46.49 293.66 0.00 1 0.00 1 0 25 1.030e-02 7.343e-03 1.596e-03 6.753e-04 2.474441e-01 3.395928e-04 2.639963e-03 -6.000000e+00 5.850753e-03 227.64 -2.00 3.06 -2.00 316.61 0.00e+00 -1.708566e-06 4.134392e-05 4.904955e-05 -6.000000e+00 2.592923e-04 282.62 -2.00 20.00 -2.00 315.90 0.00e+00 2.140 0.000 302.00 328.00 3 1.7443e+00 8.8689e-04 2.0638e-02 -6.0000e+00 1.4535e-02 2.6173e-02 9.9404e-04 1.1164e-02 -6.0000e+00 1.5790e-02 -3.5138e-03 5.8103e-04 5.4829e-03 -6.0000e+00 9.4059e-03 -8.8430e-04 2.7691e-04 1.5363e-03 -6.0000e+00 3.9998e-03 1.2011e-02 -3.3469e-04 1.9013e-05 1.8071e-05 -6.0000e+00 2.7536e-04 -5.8493e-03 12 9 1 12 1 1 99.97 19.06 0.25 -0.00585 -0.00836 128 109 1 8 0 96.890 15.00 19.06 20.85 21.38 21.38 20.1 895.32 -2708 -1948 -3208 -4175 -2041 -732 399 -74 864 -2003 -74 192 667 275 439 -1305 -132 -7 145 742 -459 1311 1059 973 459 450 -1149 31 1056 2359 1869 2041 1082 -1948 -287 507 -149 319 -38 -1384 -1494 -1036 -1047 -1149 -253 -1042 -866 -315 -636 889 846 844 916 681 483 1252 399 397 790 1116 1636 1148 1066 408 -809 109 454 571 1835 69 -242 -470 -597 -267 -377 521 571 1132 1260 -161 -820 -1091 -2119 -926 -1094 -1119 -738 -719 -386 -461 357 315 1070 1861 1439 716 739 223 -814 -730 -334 -89 874 893 -1033 -770 -619 -657 -172 -25 -308 -381 -37 156 498 1143 873 568 242 -654 -751 -180 -161 1 819 463 1116 1809 565 310 172 2 87 513 -298 -298 -58 -44 -636 -315 -179 -400 -24 -433 -335 -564 -697 -301 -103 58 -12 155 -384 -14 37 138 65 116 -376 -39 -2 45 239 -152 425 348 337 167 169 -434 11 352 765 634 739 420 -792 -109 188 -59 144 -20 -821 -947 -678 -697 -772 -168 -697 -570 -202 -403 558 552 582 655 507 368 963 313 311 607 851 1273 942 924 372 -741 94 368 454 1512 63 -234 -470 -597 -261 -351 448 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