File name: Pandora159s1_Wakkerstroom_20240425_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240425T220254.5Z 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 v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20240425_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: 20240425 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 20240425T103218.8Z 8881.439107 7 1 58.02 2 41.65 347.15 131.58 188.25 0.00 1 0.00 1 0 25 9.752e-03 7.534e-03 1.647e-04 1.009e-04 1.620857e-01 5.069207e-05 1.771129e-03 -6.000000e+00 5.489679e-03 225.68 -2.00 3.06 -2.00 315.44 0.00e+00 1.466446e-05 4.724620e-06 2.251786e-05 -6.000000e+00 2.425435e-04 279.94 -2.00 20.00 -2.00 314.84 0.00e+00 1.337 0.000 302.00 328.00 3 -9.8963e-02 1.3006e-04 1.3058e-02 -6.0000e+00 1.3589e-02 3.6567e-03 1.4504e-04 7.2789e-03 -6.0000e+00 1.4799e-02 1.6362e-03 8.3230e-05 3.6081e-03 -6.0000e+00 8.8148e-03 -2.3898e-03 3.7680e-05 1.0207e-03 -6.0000e+00 3.7471e-03 1.7079e-01 -4.1212e-04 2.8328e-06 1.3474e-05 -6.0000e+00 2.6068e-04 6.7840e-03 11 8 0 10 0 0 20.05 18.70 0.31 0.00678 0.00369 4370 940 4 8 0 11.090 15.08 18.70 36.95 20.96 20.25 27.9 937.03 -1617 -1729 -2741 -3398 -528 232 1386 1488 736 -1101 61 1390 184 455 185 -1173 98 125 359 566 -177 1163 1446 657 596 19 -838 -116 1282 2402 1950 2402 1113 -1901 -204 600 -208 547 -159 -1419 -1567 -958 -1199 -1156 -524 -1192 -948 -537 -470 880 848 645 968 573 550 1187 492 557 931 1223 1568 1122 912 225 -1028 177 153 979 1716 58 -255 -460 -357 -177 -344 411 489 1113 1285 -349 -685 -1350 -2018 -791 -1046 -988 -660 -648 -435 -431 353 253 1113 1950 1311 690 759 150 -813 -517 -252 -36 964 744 -1039 -603 -594 -642 14 -101 -284 -343 -61 162 554 1215 809 679 262 -554 -690 -193 -182 85 870 443 1333 1679 566 367 85 -5 107 393 -288 -418 -39 -186 -615 -228 -209 -368 -53 -461 -524 -835 -954 -127 58 361 396 217 -340 18 408 59 164 74 -509 43 56 164 264 -84 538 675 323 308 10 -442 -56 566 1011 850 1104 550 -970 -95 271 -103 315 -101 -1045 -1246 -724 -926 -894 -400 -907 -755 -409 -344 631 633 512 803 458 448 976 413 464 757 989 1304 1003 878 229 -1032 159 136 829 1419 55 -264 -497 -383 -184 -333 353 408 866 1034 -318 -644 -1396 -2221 -899 -1185 -1201 -844 -853 -572 -545 408 285 1121 1868 1324 767 861 187 -1081 -671 -305 -43 1093 885 -1271 -777 -798 -897 19 -144 -423 -510 -86 225 696 1418 945 831 348 -794 -953 -263 -258 115 1110 539 1633 2042 684 472 114 -6 146 557 -407 -621 -60 -289 -970 -351 -312 -531 -75 SS 20240425T103927.4Z 8881.444067 10 1 54.97 2 42.04 344.61 131.75 186.13 0.00 1 0.00 1 0 17 9.717e-03 7.543e-03 1.676e-04 1.018e-04 1.626194e-01 5.105587e-05 1.775210e-03 -6.000000e+00 5.470385e-03 225.68 -2.00 3.06 -2.00 315.46 0.00e+00 2.775740e-05 4.806337e-06 2.171436e-05 -6.000000e+00 2.416862e-04 279.94 -2.00 20.00 -2.00 314.86 0.00e+00 1.345 0.000 302.00 328.00 3 -8.1117e-02 1.3109e-04 1.3124e-02 -6.0000e+00 1.3541e-02 2.6630e-03 1.4639e-04 7.3048e-03 -6.0000e+00 1.4746e-02 1.9939e-03 8.3919e-05 3.6174e-03 -6.0000e+00 8.7836e-03 -2.5597e-03 3.7852e-05 1.0201e-03 -6.0000e+00 3.7341e-03 1.6653e-01 -4.2291e-04 2.8709e-06 1.3447e-05 -6.0000e+00 2.5975e-04 6.2841e-03 11 8 0 10 0 0 6.48 18.86 0.33 0.00628 0.00311 4336 933 4 8 0 11.250 15.09 18.86 36.53 21.17 20.77 27.9 934.81 -1651 -1710 -2761 -3268 -675 365 1240 1608 554 -1019 -25 1409 177 444 169 -1132 96 97 396 602 -98 1127 1507 617 659 16 -794 -101 1272 2424 1914 2409 1053 -1848 -264 660 -272 569 -208 -1393 -1578 -970 -1214 -1165 -515 -1217 -930 -515 -449 858 880 621 969 528 554 1162 474 549 912 1231 1553 1158 895 248 -1037 205 156 971 1722 56 -242 -474 -349 -177 -331 419 492 1064 1295 -389 -678 -1355 -2018 -815 -1069 -984 -666 -627 -440 -428 343 271 1087 1975 1304 698 749 138 -834 -539 -256 -55 968 713 -1030 -623 -605 -652 2 -106 -278 -340 -62 151 552 1219 790 676 247 -545 -696 -179 -175 87 885 472 1339 1688 584 368 98 -27 110 384 -292 -438 -30 -195 -620 -222 -210 -361 -45 -464 -512 -831 -905 -161 90 319 422 162 -311 -7 409 57 159 67 -486 41 43 178 278 -46 517 696 301 337 8 -414 -49 557 1011 827 1098 516 -935 -122 295 -134 325 -131 -1018 -1245 -728 -931 -895 -423 -997 -736 -389 -326 611 652 489 798 419 449 950 395 454 737 1071 1284 1029 857 250 -1035 183 138 817 1533 53 -249 -509 -373 -183 -319 359 409 824 1036 -353 -634 -1394 -2210 -921 -1205 -1189 -848 -822 -575 -539 395 303 1090 1883 1310 771 846 172 -1106 -697 -308 -65 1094 844 -1255 -799 -810 -907 2 -151 -411 -504 -87 208 691 1419 991 825 326 -779 -958 -261 -248 118 1125 572 1636 2047 703 472 130 -37 151 543 -411 -650 -45 -304 -975 -341 -313 -521 -68 SS 20240425T104431.2Z 8881.447584 12 1 55.29 2 42.36 342.84 131.83 184.62 0.00 1 0.00 1 0 25 9.759e-03 7.547e-03 1.685e-04 1.023e-04 1.633100e-01 5.140673e-05 1.784818e-03 -6.000000e+00 5.494091e-03 225.68 -2.00 3.06 -2.00 315.47 0.00e+00 2.653479e-05 4.828729e-06 2.303419e-05 -6.000000e+00 2.427298e-04 279.94 -2.00 20.00 -2.00 314.88 0.00e+00 1.352 0.000 302.00 328.00 3 -8.0616e-02 1.3195e-04 1.3190e-02 -6.0000e+00 1.3600e-02 2.8187e-03 1.4717e-04 7.3377e-03 -6.0000e+00 1.4810e-02 1.9718e-03 8.4487e-05 3.6362e-03 -6.0000e+00 8.8215e-03 -2.5407e-03 3.8281e-05 1.0287e-03 -6.0000e+00 3.7505e-03 1.6531e-01 -4.1556e-04 2.8749e-06 1.3504e-05 -6.0000e+00 2.6086e-04 5.9194e-03 11 8 0 10 0 0 9.22 18.96 0.32 0.00592 0.00280 4283 921 4 8 0 11.390 15.09 18.96 36.46 21.27 20.96 27.8 934.65 -1717 -1683 -2818 -3339 -672 359 1269 1570 674 -1049 -3 1356 253 458 205 -1197 104 41 418 577 -143 1199 1502 631 638 38 -828 -84 1254 2437 1927 2400 1092 -1861 -264 616 -193 538 -148 -1428 -1570 -997 -1159 -1157 -488 -1205 -922 -518 -442 883 851 629 948 557 530 1177 465 535 907 1202 1553 1146 900 235 -1023 168 145 938 1729 45 -226 -469 -331 -156 -329 432 496 1078 1295 -356 -699 -1322 -2046 -786 -1073 -984 -652 -630 -430 -442 341 266 1108 1975 1310 676 760 145 -815 -550 -258 -40 971 744 -1030 -621 -620 -639 -9 -82 -296 -341 -80 173 554 1229 792 697 246 -545 -700 -191 -171 75 881 451 1327 1685 586 375 95 -15 109 401 -280 -426 -44 -194 -621 -224 -218 -354 -50 -481 -502 -846 -924 -160 88 326 411 196 -319 -1 393 81 163 81 -514 45 18 188 266 -67 549 694 307 326 20 -432 -41 549 1017 832 1094 535 -942 -122 276 -95 307 -93 -1045 -1240 -749 -889 -889 -370 -988 -731 -393 -322 630 632 497 782 443 430 964 389 444 735 968 1286 1020 863 237 -1024 151 128 792 1544 43 -233 -505 -355 -162 -318 371 413 837 1039 -324 -656 -1363 -2248 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