File name: Pandora159s1_Wakkerstroom_20211224_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035209.8Z 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_20211224_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: 20211224 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 20211224T073859.4Z 8028.318743 299 1 18.60 2 31.77 90.82 93.56 287.22 0.00 1 0.00 1 0 17 9.442e-03 7.573e-03 1.445e-03 1.020e-03 1.443023e-01 5.192754e-04 1.575967e-03 -6.000000e+00 5.366971e-03 227.81 -2.00 3.06 -2.00 314.76 0.00e+00 7.343300e-05 4.246106e-05 1.749989e-05 -6.000000e+00 2.366879e-04 281.59 -2.00 20.00 -2.00 314.20 0.00e+00 1.176 0.000 302.00 328.00 3 3.8381e+00 1.3304e-03 1.1579e-02 -6.0000e+00 1.3343e-02 2.9057e-02 1.4786e-03 6.5383e-03 -6.0000e+00 1.4495e-02 1.5055e-03 8.4502e-04 3.2232e-03 -6.0000e+00 8.6285e-03 -2.3664e-03 3.7097e-04 9.0702e-04 -6.0000e+00 3.6646e-03 3.8959e-03 -2.4557e-04 2.8317e-05 1.2020e-05 -6.0000e+00 2.5243e-04 -6.3742e-03 12 9 1 12 1 1 99.97 19.15 0.26 -0.00637 -0.00822 42 25 1 8 0 428.340 14.99 19.15 22.23 21.48 21.48 19.1 900.92 -721 -1424 -2188 -3199 -291 629 1326 1461 924 -969 -16 1725 176 478 103 -1308 -110 478 627 568 24 847 1445 374 868 133 -858 -223 1157 2323 1992 2682 1560 -1645 -404 844 -463 302 -44 -1451 -1647 -1087 -1132 -1360 -699 -1323 -929 -525 -586 618 842 544 696 821 530 1241 505 377 875 969 1355 1130 729 478 -1096 75 123 546 1636 102 -192 -229 -264 52 -387 389 559 781 1348 -357 -783 -1111 -2092 -867 -951 -1011 -664 -618 -325 -482 295 187 994 1807 1382 699 808 384 -696 -632 -138 -203 658 830 -890 -737 -893 -687 -67 65 -60 -192 -28 47 508 1009 552 548 294 -542 -681 -200 -224 73 1004 531 1130 1748 478 466 217 -115 -65 233 -238 -332 -167 20 -606 -275 -176 -281 -171 -269 -569 -879 -1194 -93 186 408 502 352 -388 -6 646 72 218 48 -654 -55 242 324 301 13 447 763 208 502 79 -510 -122 575 1188 1043 1346 837 -918 -207 412 -247 186 -30 -1153 -1416 -895 -949 -1146 -581 -1095 -799 -430 -460 472 663 455 607 690 456 1074 446 331 750 889 1183 1054 733 504 -1153 71 113 475 1485 98 -202 -236 -272 56 -388 374 478 620 1088 -325 -739 -1149 -2312 -921 -1080 -1235 -855 -770 -405 -618 347 213 1009 1725 1375 763 903 472 -915 -815 -166 -240 738 966 -1071 -937 -1186 -887 -90 91 -87 -281 -39 65 625 1232 670 648 375 -704 -918 -267 -311 97 1247 629 1342 2037 593 572 278 -150 -86 314 -320 -470 -243 30 -914 -407 -252 -389 -231 SS 20211224T074451.5Z 8028.322818 302 1 52.02 2 30.47 90.17 94.76 286.57 0.00 1 0.00 1 0 17 9.595e-03 7.385e-03 3.218e-04 2.052e-04 1.421293e-01 1.037084e-04 1.541099e-03 -6.000000e+00 5.454123e-03 227.81 -2.00 3.06 -2.00 315.29 0.00e+00 5.665747e-05 9.478001e-06 2.077666e-05 -6.000000e+00 2.405305e-04 281.59 -2.00 20.00 -2.00 314.69 0.00e+00 1.160 0.000 302.00 328.00 3 1.1516e+00 2.6716e-04 1.1406e-02 -6.0000e+00 1.3560e-02 1.8635e-02 2.9769e-04 6.4224e-03 -6.0000e+00 1.4731e-02 1.0535e-03 1.6992e-04 3.1642e-03 -6.0000e+00 8.7686e-03 -2.5200e-03 7.5605e-05 8.8900e-04 -6.0000e+00 3.7241e-03 5.8436e-02 -2.0283e-04 5.7741e-06 1.1397e-05 -6.0000e+00 2.5652e-04 -6.4168e-03 11 8 0 10 0 0 99.99 19.15 0.30 -0.00642 -0.00794 3318 714 2 8 0 14.390 15.00 19.15 22.73 21.48 21.48 19.4 905.43 -1148 -1708 -2320 -3376 -627 534 1454 1861 934 -803 -215 1527 274 521 254 -1144 -135 122 240 664 -47 938 1582 620 689 91 -758 -297 1180 2292 2072 2316 1448 -1674 -347 805 -227 599 -123 -1346 -1686 -999 -1209 -1231 -554 -1169 -956 -535 -584 706 981 580 976 605 491 1134 545 440 839 1104 1493 1134 908 448 -977 97 168 792 1769 213 -266 -390 -380 -102 -335 372 562 1005 1433 -260 -671 -1235 -2062 -896 -1035 -1028 -621 -591 -418 -445 296 239 898 1900 1321 665 705 261 -772 -541 -241 -168 841 795 -906 -671 -547 -705 -71 -49 -228 -315 -80 140 386 1133 762 652 299 -455 -734 -148 -161 32 887 497 1128 1694 639 363 152 -94 102 375 -216 -408 -80 -79 -557 -237 -187 -418 -122 -366 -583 -794 -1073 -171 135 380 542 303 -273 -70 487 95 201 109 -481 -63 57 115 296 -24 458 772 318 336 46 -378 -151 542 994 918 1077 718 -863 -164 363 -111 340 -76 -972 -1319 -805 -995 -1015 -450 -947 -747 -399 -417 490 701 441 772 499 414 961 471 378 704 920 1275 1037 892 463 -1005 89 140 626 1458 201 -275 -421 -411 -107 -329 326 438 797 1156 -215 -620 -1253 -2233 -1000 -1237 -1210 -770 -757 -535 -550 366 267 896 1779 1291 712 829 338 -978 -673 -305 -196 925 910 -1148 -899 -699 -938 -98 -71 -342 -474 -114 184 500 1359 907 812 402 -609 -1021 -204 -216 44 1165 622 1321 1948 780 471 206 -129 141 533 -300 -598 -121 -121 -869 -363 -277 -601 -187 SS 20211224T075524.9Z 8028.330149 307 1 37.39 2 28.13 88.92 96.93 285.42 0.00 1 0.00 1 0 17 1.066e-02 8.508e-03 4.641e-03 2.874e-03 1.522439e-01 1.453616e-03 1.650894e-03 -6.000000e+00 6.060819e-03 227.81 -2.00 3.06 -2.00 315.41 0.00e+00 3.146199e-04 1.348383e-04 5.976118e-05 -6.000000e+00 2.672792e-04 281.59 -2.00 20.00 -2.00 314.79 0.00e+00 1.133 0.000 302.00 328.00 3 5.8482e+00 3.7471e-03 1.1517e-02 -6.0000e+00 1.5069e-02 7.4576e-02 4.1746e-03 6.8822e-03 -6.0000e+00 1.6369e-02 -1.4847e-02 2.3881e-03 3.3894e-03 -6.0000e+00 9.7438e-03 3.2594e-04 1.0681e-03 9.9743e-04 -6.0000e+00 4.1385e-03 5.2494e-04 -5.1170e-04 8.1016e-05 1.2622e-05 -6.0000e+00 2.8505e-04 -6.6808e-03 12 9 1 12 1 1 99.99 19.15 0.56 -0.00668 -0.01053 17 5 1 8 0 2067.360 15.01 19.15 24.13 21.48 21.48 19.5 912.36 -1260 -1178 -3045 -2836 136 -1275 770 388 1510 -2713 -702 811 -403 -382 382 -2111 -213 485 505 937 476 2179 1600 1623 1108 134 -218 -479 720 3104 1741 3352 1273 -2170 -387 1007 -1550 381 222 -1366 -887 -1022 -780 -853 -192 -952 -526 -623 -100 1167 623 216 630 621 264 1337 501 1029 0 102 1795 752 1240 246 -1296 30 181 -4 1510 154 -315 -114 -37 -136 -425 782 368 -255 458 -210 -1070 -845 -1826 -736 -1216 -1265 -255 -817 -154 -410 19 -93 499 1198 1092 360 695 623 -605 -219 -124 -85 464 717 -1600 -1006 4244 -1163 -423 202 44 -142 -79 109 452 982 729 -204 17 -700 -643 -213 -362 -152 571 576 916 1263 186 204 134 65 -2 543 -444 -120 128 279 -321 -21 -112 -793 -247 -379 -378 -993 -855 35 -315 194 110 461 -891 -219 248 -134 -140 154 -927 -93 214 228 431 223 992 735 774 555 69 -112 -230 316 1288 747 1482 604 -1074 -176 438 -739 204 140 -987 -685 -818 -635 -696 -154 -764 -410 -467 -72 821 455 167 503 514 222 1128 431 880 0 85 1524 683 1187 248 -1310 28 153 -3 1260 145 -321 -120 -39 -139 -415 689 295 -192 349 -176 -995 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