File name: Pandora159s1_Wakkerstroom_20210613_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031128.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes 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_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210613_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: 20210613 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 20210613T051307.5Z 7834.217448 21 1 48.74 2 85.61 60.99 115.02 73.22 0.00 1 0.00 1 0 41 7.698e-01 3.061e-01 5.193e-01 5.065e-02 -2.157049e-02 2.933467e-02 5.099965e-02 -6.000000e+00 4.589052e-01 224.64 -2.00 3.06 -2.00 322.00 0.00e+00 1.399429e-02 1.516273e-02 1.379653e-01 -6.000000e+00 2.251671e-02 277.39 -2.00 20.00 -2.00 321.54 0.00e+00 10.846 0.008 302.00 328.00 3 2.8748e+00 1.1716e-01 8.7247e-01 -6.0000e+00 1.1333e+00 -1.2499e+00 1.3588e-01 1.1633e+00 -6.0000e+00 1.2420e+00 -8.2031e-02 8.6372e-02 1.8589e-01 -6.0000e+00 7.4128e-01 3.3715e-01 4.5439e-02 1.8116e-01 -6.0000e+00 3.1312e-01 1.3763e-05 5.8193e-02 2.0961e-03 2.1107e-03 -6.0000e+00 2.2287e-02 -8.3028e-04 12 8 8 10 0 0 29.65 18.31 0.98 -0.00083 0.43646 22 5 4 8 0 2215.180 14.99 18.31 3.57 20.77 20.87 16.0 814.94 -65416 900000 -65566 900000 -70082 900000 -98720 -31200 -7116 900000 34026 240723 -41768 -72771 900000 -108864 900000 -106149 900000 -39794 57757 900000 900000 -78072 900000 900000 40009 143621 -61968 57908 -56133 98152 -70461 900000 1712 -12526 -23668 320262 900000 75570 54278 -33592 900000 -8858 900000 1776 122207 537 114286 41950 144626 23153 189357 53241 43816 182386 -17039 40775 58191 900000 -5549 900000 52227 46709 86751 900000 245295 92055 137947 9054 85932 40004 54263 135 92498 77047 120406 69884 111254 96483 50431 64037 51529 97354 42005 86576 32058 50846 29068 70268 31573 49118 99171 46710 73416 42362 23637 3812 12104 -54 27316 31880 73444 66073 69401 68312 -78777 77537 50178 47286 7796 -2715 -14720 -8896 -3566 18938 25119 31686 30276 19224 27527 15478 39586 18146 29629 36898 63923 38483 31975 12495 3954 3216 -1167 -5012 -8475 -7299 -14870 -12437 -15242 -10079 -853 12699 30069 -3823 900000 -3227 900000 -3449 900000 -6377 -1535 -350 900000 1675 11847 -2467 -5969 900000 -12724 900000 -12733 900000 -2481 2842 900000 900000 -6916 900000 900000 1969 7068 -5083 2850 -4604 4830 -6242 900000 95 -945 -2252 15761 900000 3719 3027 -4739 900000 -1017 900000 175 6014 56 5624 3303 7118 2355 9319 4192 3881 8976 -3075 4549 6109 900000 -1293 900000 6169 5364 7014 900000 12072 10031 10183 2347 11177 7481 8774 32 9104 9479 11005 12037 14079 15262 12740 15757 16061 22587 16951 24955 14830 18517 12112 19020 11498 17266 23706 19923 28905 22794 15355 2914 8220 -42 17745 22279 39501 38370 41441 43705 -233390 53967 42969 39872 9055 -3243 -19125 -11266 -4645 22057 30657 38673 38342 27121 34771 21278 44252 22564 35621 43711 61120 49241 44285 19924 7187 6320 -2549 -11874 -21606 -18823 -41324 -33418 -41556 -25993 -2065 28456 65323 SS 20210613T052757.6Z 7834.227750 24 1 49.94 2 82.76 59.12 112.00 71.99 0.00 1 0.00 1 0 25 5.080e-01 7.435e-03 3.030e-01 4.582e-03 7.745242e-01 2.520955e-03 7.447165e-03 -6.000000e+00 2.882190e-01 224.64 -2.00 3.06 -2.00 321.81 0.00e+00 6.025905e-03 1.395659e-03 4.763403e-03 -6.000000e+00 1.307076e-02 277.39 -2.00 20.00 -2.00 321.34 0.00e+00 7.341 0.002 302.00 328.00 3 5.4804e-01 9.2593e-03 7.6009e-02 -6.0000e+00 7.1286e-01 1.5233e-01 1.4482e-02 5.6702e-02 -6.0000e+00 7.7776e-01 -1.5137e-01 1.6602e-02 2.2430e-02 -6.0000e+00 4.5936e-01 4.5855e-02 7.6021e-03 9.6085e-03 -6.0000e+00 1.9470e-01 3.6533e-04 -1.1578e-03 1.2814e-04 8.0996e-05 -6.0000e+00 1.3737e-02 -2.1898e-03 11 8 0 10 0 0 4.60 18.30 0.31 -0.00219 -0.01089 164 35 4 8 0 300.790 15.00 18.30 5.31 20.77 20.87 16.0 824.48 -217690 -272029 -87368 -157589 900000 900000 -214223 -214462 900000 14123 -116947 -86210 -132960 -87209 -91737 -10779 -86540 -60764 -67566 -44475 -45973 -36537 -53121 -17778 -46507 -56543 -31081 -65972 -25850 -9616 -33995 -53495 3892 3010 -23324 -24098 -9018 -20829 -8628 3868 -12514 4324 661 221 -1235 1025 72 1055 9624 11947 2409 4817 9029 2591 5456 5429 1303 506 1082 2404 37 1754 8488 2359 4714 1780 1910 4077 3881 195 1057 2183 176 1052 364 579 -363 781 1034 -1494 584 -702 -2029 -1759 -721 -2019 -6 -1438 -391 780 248 1118 449 1595 645 997 333 705 -839 234 -538 328 1090 664 -1534 -922 -1094 -1232 -15 -646 -540 -171 10 196 803 976 788 273 -297 -899 -692 -43 -284 39 150 558 1535 1492 -68 27 369 374 136 132 -247 -604 362 -103 -500 -92 111 -265 501 -972 -2540 -390 -704 900000 900000 -1339 -1532 900000 63 -522 -385 -891 -506 -737 -48 -966 -597 -784 -437 -472 -343 -617 -159 -602 -858 -375 -1119 -300 -107 -607 -1325 71 60 -540 -558 -217 -617 -280 133 -579 184 31 11 -63 53 4 61 547 727 183 407 814 273 598 624 161 63 129 278 5 237 1247 424 892 346 371 814 871 53 313 667 54 300 95 135 -80 177 269 -483 220 -310 -1002 -922 -399 -1204 -3 -922 -247 468 140 589 231 855 399 725 287 641 -853 238 -514 302 896 546 -1384 -876 -1099 -1337 -17 -810 -761 -258 15 291 1131 1320 1075 392 -455 -1434 -1080 -63 -403 59 216 775 2043 2090 -112 47 707 769 297 309 -621 -1607 974 -282 -1370 -242 269 -602 1088 SS 20210613T053413.8Z 7834.232104 27 1 50.65 2 81.57 58.30 110.73 71.46 0.00 1 0.00 1 0 25 3.736e-01 6.415e-03 2.519e-01 2.504e-03 6.977542e-01 1.348320e-03 6.795545e-03 -6.000000e+00 2.097469e-01 224.64 -2.00 3.06 -2.00 321.52 0.00e+00 3.975467e-03 6.794984e-04 2.525794e-03 -6.000000e+00 9.524907e-03 277.39 -2.00 20.00 -2.00 321.03 0.00e+00 6.433 0.002 302.00 328.00 3 4.5515e-01 4.6522e-03 6.3475e-02 -6.0000e+00 5.1925e-01 5.0412e-02 6.8673e-03 4.0511e-02 -6.0000e+00 5.6619e-01 -3.3665e-02 7.7312e-03 1.8364e-02 -6.0000e+00 3.3628e-01 1.3299e-03 3.6390e-03 7.4517e-03 -6.0000e+00 1.4325e-01 8.8220e-04 -9.7541e-04 7.0871e-05 7.1725e-05 -6.0000e+00 9.9913e-03 -2.0211e-03 11 8 0 10 0 0 21.76 18.30 0.27 -0.00202 -0.00935 269 58 2 8 0 183.500 15.00 18.30 6.11 20.77 20.87 16.2 829.26 -62663 -89373 -80113 -81149 -184867 41297 -179913 64886 -148645 900000 -167031 81467 -102613 -1228 -31114 -41007 48363 -35455 33361 -54717 -23983 -65509 -2898 -62434 13821 -22524 -20077 -29711 -19006 12422 -8521 18559 -14334 1739 -20923 -3969 -25485 6036 -6775 -874 -4154 4951 -5274 2640 4917 -1942 8928 -2446 6310 -745 8008 -750 5726 626 2267 3664 1317 167 213 2436 -1587 3027 783 2175 -1615 2050 334 2103 3214 388 1024 -348 297 -1049 -669 -100 1818 -1387 1865 -481 522 -1215 -1800 -5 -1196 -688 -1114 -190 -499 83 517 892 842 2191 524 62 775 414 -166 -315 422 -325 1299 119 -1588 -1381 -870 -607 -121 -87 -539 -190 -104 582 56 1272 454 588 -252 -695 -666 105 -130 -419 866 66 1271 1299 268 77 80 -115 94 282 -281 -376 -36 142 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