File name: Pandora159s1_Wakkerstroom_20211028_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033836.5Z 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_20211028_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: 20211028 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 20211028T090205.5Z 7971.376452 330 1 10.57 2 17.07 36.31 93.35 296.44 0.00 1 0.00 1 0 25 9.862e-03 7.750e-03 3.018e-03 2.231e-03 1.413218e-01 1.140627e-03 1.535970e-03 -6.000000e+00 5.606789e-03 228.14 -2.00 3.06 -2.00 314.50 0.00e+00 2.324666e-04 8.833635e-05 3.148398e-05 -6.000000e+00 2.445180e-04 279.06 -2.00 20.00 -2.00 314.00 0.00e+00 1.046 0.000 302.00 328.00 3 4.8562e+00 2.9188e-03 1.0659e-02 -6.0000e+00 1.3963e-02 3.0168e-02 3.2378e-03 6.3817e-03 -6.0000e+00 1.5175e-02 -2.1250e-03 1.8520e-03 3.1462e-03 -6.0000e+00 9.0171e-03 -9.3456e-04 8.0528e-04 9.0451e-04 -6.0000e+00 3.8146e-03 1.5690e-03 -2.2918e-04 6.2023e-05 1.2138e-05 -6.0000e+00 2.6368e-04 -4.7480e-04 12 9 1 12 1 1 99.58 18.76 0.22 -0.00047 -0.00220 6 7 1 8 0 1483.690 15.01 18.76 21.70 21.17 21.17 17.9 901.71 -1176 -2020 -1797 -3006 547 1058 2921 934 814 -275 770 1219 -95 -184 256 -1085 -434 590 381 1339 -459 1456 1492 1038 363 519 -1673 -396 1252 1368 3315 1667 1700 -2008 -582 915 -459 -186 303 -1866 -1498 -721 -1400 -998 -842 -1153 -1242 -750 -888 -45 -18 587 1028 535 472 1249 604 484 878 812 1363 793 1594 74 -484 167 -133 817 1723 170 -375 240 -336 -61 -472 205 359 1092 1090 -288 -795 -1481 -1888 -1025 -1087 -966 -186 -607 -130 -372 436 -122 974 1674 1050 856 594 609 -499 -382 -189 -50 831 448 -1154 -884 -178 -939 -35 93 -26 -416 212 -36 110 718 538 475 -136 -711 -462 -337 -163 165 760 741 1304 1747 -58 531 -292 234 18 567 -190 -274 -18 104 -727 -178 12 -486 -200 -470 -853 -752 -1191 190 348 983 351 331 -115 311 491 -41 -87 130 -582 -236 319 210 751 -263 816 841 606 219 319 -1032 -229 674 716 1738 920 974 -1188 -322 491 -263 -119 220 -1511 -1271 -623 -1232 -879 -737 -1005 -1059 -619 -714 -36 -15 494 887 474 425 1131 553 442 788 729 1246 760 1591 77 -497 160 -120 711 1543 167 -391 255 -359 -64 -474 191 310 898 912 -260 -773 -1534 -2034 -1127 -1247 -1160 -230 -769 -164 -461 511 -134 998 1654 1071 925 681 740 -629 -476 -226 -56 915 508 -1393 -1105 -228 -1232 -47 128 -37 -589 290 -46 135 840 628 572 -171 -942 -625 -455 -216 213 944 893 1511 2009 -70 658 -373 300 23 745 -259 -385 -26 151 -1065 -256 18 -677 -275 SS 20211028T091137.5Z 7971.383073 335 1 51.22 2 15.92 29.20 95.18 295.43 0.00 1 0.00 1 0 25 9.587e-03 7.226e-03 8.409e-04 5.333e-04 1.387665e-01 2.708628e-04 1.504410e-03 -6.000000e+00 5.450317e-03 228.14 -2.00 3.06 -2.00 315.34 0.00e+00 2.945731e-04 2.428648e-05 3.704995e-05 -6.000000e+00 2.376946e-04 279.06 -2.00 20.00 -2.00 314.77 0.00e+00 1.040 0.000 302.00 328.00 3 2.9611e+00 6.9820e-04 1.0552e-02 -6.0000e+00 1.3573e-02 1.9310e-02 7.7678e-04 6.2765e-03 -6.0000e+00 1.4752e-02 3.4632e-04 4.4375e-04 3.0916e-03 -6.0000e+00 8.7655e-03 -2.1729e-03 1.9684e-04 9.0580e-04 -6.0000e+00 3.7081e-03 1.0577e-02 -1.4996e-04 1.5088e-05 1.1297e-05 -6.0000e+00 2.5632e-04 -4.4490e-04 11 8 0 10 0 0 99.95 18.77 0.25 -0.00044 -0.00157 770 166 1 8 0 63.150 15.01 18.77 22.40 21.17 21.17 18.2 907.88 -1465 -1374 -2504 -2837 -712 1034 1157 2305 862 -1043 27 1331 257 422 376 -1482 35 -165 550 469 -17 950 1704 552 738 121 -755 -84 928 2681 1862 2846 1254 -1349 -448 830 -215 519 -143 -1538 -1620 -1094 -1165 -1417 -630 -1378 -827 -571 -465 605 844 564 865 678 416 1208 448 635 816 1132 1477 1143 894 349 -946 124 154 694 1785 74 -180 -450 -249 -207 -263 301 497 966 1283 -299 -626 -1236 -2058 -768 -1132 -870 -687 -484 -452 -408 321 194 912 1780 1291 619 743 125 -685 -597 -183 -242 893 737 -900 -600 -554 -622 -60 -40 -227 -237 -99 132 354 1052 664 592 252 -462 -645 -219 -97 66 960 397 1213 1503 596 303 127 -89 57 457 -255 -339 -22 -87 -589 -117 -195 -399 -124 -469 -466 -853 -888 -192 258 302 664 277 -351 9 420 89 161 159 -677 16 -76 259 226 -8 454 814 277 387 65 -403 -41 416 1129 807 1286 608 -673 -205 364 -103 289 -95 -1083 -1229 -854 -927 -1132 -496 -1081 -624 -452 -352 446 643 456 662 539 337 985 372 523 658 998 1216 1008 847 347 -931 110 135 578 1557 67 -179 -466 -257 -207 -246 276 406 731 994 -261 -610 -1199 -2127 -817 -1294 -1065 -888 -643 -602 -522 377 205 948 1745 1324 696 833 154 -898 -767 -219 -267 1024 803 -1086 -764 -734 -856 -85 -60 -353 -367 -146 178 432 1309 823 698 322 -639 -925 -311 -134 88 1187 515 1471 1800 758 409 162 -115 75 612 -364 -510 -33 -138 -943 -184 -297 -587 -178 SS 20211028T091706.9Z 7971.386885 338 1 9.31 2 15.37 24.69 96.24 294.85 0.00 1 0.00 1 0 17 9.707e-03 7.972e-03 1.932e-03 1.482e-03 1.409967e-01 7.613688e-04 1.538826e-03 -6.000000e+00 5.518696e-03 228.14 -2.00 3.06 -2.00 314.27 0.00e+00 2.559962e-04 5.632095e-05 3.142301e-05 -6.000000e+00 2.406771e-04 279.06 -2.00 20.00 -2.00 313.78 0.00e+00 1.037 0.000 302.00 328.00 3 4.0832e+00 1.9437e-03 1.0599e-02 -6.0000e+00 1.3743e-02 3.3612e-02 2.1532e-03 6.3801e-03 -6.0000e+00 1.4937e-02 -4.0198e-03 1.2347e-03 3.1474e-03 -6.0000e+00 8.8754e-03 -4.7768e-04 5.3342e-04 9.0812e-04 -6.0000e+00 3.7546e-03 3.4245e-03 -2.8049e-04 4.1182e-05 1.2337e-05 -6.0000e+00 2.5954e-04 -4.2398e-04 12 9 1 12 1 1 58.40 18.78 0.30 -0.00042 -0.00253 11 14 1 8 0 761.000 15.01 18.78 23.13 21.17 21.17 18.3 910.60 -1723 -1319 -2306 -3234 208 709 1238 1973 928 -439 289 1278 201 674 118 -1145 128 16 354 734 -104 589 1789 494 353 -268 -1061 -224 1093 2635 2011 2498 1712 -1587 -397 1243 -355 762 -266 -1344 -1808 -939 -1247 -1162 -635 -1312 -842 -704 -667 535 904 134 898 780 441 1048 722 394 528 895 1339 1317 952 220 -990 199 6 754 1705 -156 -98 -431 -466 -124 -19 202 534 613 1055 -305 -756 -1500 -1940 -871 -1109 -1079 -731 -573 -366 -477 276 294 1098 1821 1649 415 891 273 -509 -395 -190 -356 901 846 -900 -858 -643 -772 -58 -211 -213 -121 -274 34 383 1476 650 629 315 -661 -625 -67 -159 208 1115 634 1253 1491 530 220 160 -15 -47 448 -236 -434 -137 -59 -552 -207 -390 -411 -96 -714 -578 -1014 -1423 78 248 450 797 416 -205 129 563 89 331 65 -624 75 9 199 423 -61 338 1020 296 222 -174 -678 -132 628 1425 1118 1454 1061 -947 -233 697 -219 503 -197 -1081 -1575 -838 -1137 -1060 -571 -1176 -726 -581 -562 438 763 113 785 709 409 978 684 372 487 821 1259 1244 967 223 -1047 188 5 651 1542 -152 -104 -453 -489 -133 -19 192 481 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