File name: Pandora159s1_Wakkerstroom_20240101_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240113T080548.5Z 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_20240101_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: 20240101 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 20240101T045347.7Z 8766.204024 208 1 6.78 2 68.86 105.81 57.47 307.55 0.00 1 0.00 1 0 25 1.323e-02 6.886e-03 5.253e-03 1.189e-03 3.394760e-01 5.949895e-04 3.550874e-03 -6.000000e+00 7.511581e-03 227.74 -2.00 3.06 -2.00 317.87 0.00e+00 1.965557e-04 1.005337e-04 8.631157e-05 -6.000000e+00 3.319812e-04 281.93 -2.00 20.00 -2.00 317.15 0.00e+00 2.747 0.000 302.00 328.00 3 1.5731e+00 1.5869e-03 2.7051e-02 -6.0000e+00 1.8670e-02 2.6743e-02 1.7961e-03 1.5298e-02 -6.0000e+00 2.0289e-02 -8.2896e-03 1.1368e-03 7.5128e-03 -6.0000e+00 1.2080e-02 -2.4277e-03 5.8163e-04 2.1087e-03 -6.0000e+00 5.1270e-03 7.5961e-03 -5.0729e-04 3.3356e-05 2.2454e-05 -6.0000e+00 3.5383e-04 1.0372e-03 12 9 1 12 1 1 99.96 19.88 0.21 0.00104 -0.00277 61 103 2 8 0 102.580 14.99 19.88 23.33 22.09 21.88 27.2 877.76 -2344 -4881 -2167 -6732 -1130 -4235 -760 -2456 -1459 -2362 -3760 1026 -3157 87 -1870 -573 -1013 626 70 -102 -838 1049 1424 0 911 -776 -757 -1248 890 1223 1950 2281 1553 -2357 -742 -212 -785 448 0 -1169 -1989 -914 -1296 -630 -436 -658 -695 -302 -493 992 1066 637 1101 563 652 897 475 597 888 1251 1849 1555 1239 614 -539 224 230 894 1857 359 -391 -349 -512 -123 -301 608 347 615 1117 -609 -523 -1328 -2078 -954 -992 -1196 -501 -694 -288 -414 481 462 1071 1950 1089 720 612 235 -813 -629 -483 -200 834 649 -965 -836 -569 -791 -72 -152 -272 -354 48 103 647 1207 690 652 174 -600 -761 -196 -82 -10 727 462 1036 1784 381 277 137 -20 41 216 -116 -467 79 -57 -473 -250 -7 -403 -69 -164 -389 -173 -527 -75 -281 -52 -196 -129 -222 -360 99 -363 11 -267 -90 -170 108 13 -20 -164 201 280 0 206 -186 -180 -282 186 255 437 566 427 -694 -203 -57 -231 142 0 -534 -934 -447 -656 -320 -221 -335 -350 -149 -243 491 563 367 673 342 410 578 314 392 568 790 1197 1092 958 482 -430 176 169 644 1433 300 -361 -316 -461 -113 -255 488 254 431 829 -492 -478 -1280 -2163 -1032 -1083 -1402 -583 -833 -344 -503 536 498 1058 1875 1132 792 754 307 -1086 -828 -623 -247 961 772 -1200 -1098 -780 -1083 -104 -224 -429 -571 74 149 906 1665 955 896 257 -904 -1166 -294 -125 -14 1003 642 1359 2345 550 412 206 -31 64 359 -196 -833 138 -102 -847 -435 -12 -673 -116 SS 20240101T050346.1Z 8766.210950 213 1 1.44 2 66.72 104.90 59.19 305.59 0.00 1 0.00 1 0 25 1.408e-02 7.288e-03 5.384e-03 1.799e-03 3.116335e-01 9.034313e-04 3.279367e-03 -6.000000e+00 7.991931e-03 227.74 -2.00 3.06 -2.00 317.11 0.00e+00 -8.026470e-05 1.244441e-04 6.754016e-05 -6.000000e+00 3.532035e-04 281.93 -2.00 20.00 -2.00 316.39 0.00e+00 2.512 0.000 302.00 328.00 3 1.2428e+00 2.3775e-03 2.4745e-02 -6.0000e+00 1.9864e-02 2.0369e-02 2.6709e-03 1.3986e-02 -6.0000e+00 2.1586e-02 -9.4194e-03 1.5981e-03 6.8690e-03 -6.0000e+00 1.2852e-02 3.7441e-04 7.8625e-04 1.9198e-03 -6.0000e+00 5.4552e-03 1.3322e-02 -4.7549e-04 5.0344e-05 2.1967e-05 -6.0000e+00 3.7642e-04 4.4981e-04 12 9 1 12 1 1 -19.93 19.88 0.26 0.00045 -0.00312 16 126 2 8 0 84.280 14.99 19.88 24.06 22.09 21.88 27.3 881.00 -3375 -4832 -5306 -7753 -1038 -4222 3028 -1591 1637 -2188 -170 -355 -1987 -1315 286 -283 -556 -95 -749 1474 -569 1291 507 1582 123 544 -1296 -314 679 2418 2534 2359 1799 -1682 428 634 62 34 -429 -1412 -1018 -1137 -1342 -1105 -523 -598 -891 -258 -1004 1086 334 1062 934 228 100 1152 518 730 801 1058 2238 1292 1573 776 -576 182 367 569 1730 290 -199 -511 -518 -250 -604 467 473 1022 771 -223 -939 -1201 -2453 -801 -1120 -1106 -865 -659 -255 -411 389 312 995 1635 1045 257 661 61 -763 -516 -458 -205 677 1093 -1075 -998 -573 -586 -170 177 -156 -278 124 181 687 1016 962 735 250 -543 -701 -380 -140 281 732 285 1022 1540 433 89 179 -24 20 356 -339 -295 13 79 -627 -322 -101 -476 41 -375 -598 -675 -946 -106 -468 334 -192 214 -313 -24 -52 -335 -257 59 -65 -134 -24 -198 395 -159 352 143 470 37 169 -406 -99 198 690 776 740 621 -617 145 210 23 14 -209 -759 -598 -661 -804 -666 -313 -358 -527 -149 -577 659 204 698 617 160 73 852 393 550 590 770 1658 988 1312 663 -500 154 287 437 1413 260 -187 -501 -505 -234 -551 398 365 793 601 -190 -866 -1230 -2597 -876 -1256 -1274 -1049 -821 -316 -492 446 342 1041 1660 1087 287 786 78 -1005 -696 -576 -244 787 1307 -1367 -1287 -769 -793 -242 259 -235 -427 184 259 934 1345 1271 1018 359 -804 -1058 -563 -201 400 1025 382 1344 2028 596 127 262 -36 31 549 -540 -494 22 133 -1072 -536 -166 -779 66 SS 20240101T051803.2Z 8766.220871 220 1 45.04 2 63.65 103.62 61.72 302.93 0.00 1 0.00 1 0 25 2.417e-02 7.746e-03 2.118e-02 4.585e-03 2.785877e-01 2.292185e-03 2.950034e-03 -6.000000e+00 1.372784e-02 227.74 -2.00 3.06 -2.00 318.28 0.00e+00 -2.924815e-04 4.202361e-04 1.207626e-04 -6.000000e+00 6.066437e-04 281.93 -2.00 20.00 -2.00 317.53 0.00e+00 2.240 0.000 302.00 328.00 3 4.9974e+00 6.1793e-03 2.2163e-02 -6.0000e+00 3.4121e-02 3.5928e-02 7.0241e-03 1.2645e-02 -6.0000e+00 3.7075e-02 1.3852e-02 4.4890e-03 6.2391e-03 -6.0000e+00 2.2074e-02 -1.1637e-02 2.2959e-03 1.7671e-03 -6.0000e+00 9.3728e-03 4.0132e-04 -1.6635e-04 1.3418e-04 1.9864e-05 -6.0000e+00 6.4632e-04 -1.8455e-03 12 9 1 12 9 1 99.99 19.88 0.90 -0.00185 -0.00310 102 24 1 8 0 437.190 15.00 19.88 25.17 22.09 21.88 27.6 888.92 11022 -8230 -6350 -6259 -6948 -6136 7652 6813 9196 -1939 -4390 -468 1421 1360 -596 -5371 533 -7 2120 -557 1592 4657 1752 2650 2351 -3190 560 -2416 -1543 2953 3472 2954 1860 -2379 1143 317 -3778 -1359 460 -1478 -1245 -1108 -1087 -848 -492 -837 -1071 238 -214 236 1140 -1033 -263 443 -457 282 893 1076 589 1217 1524 822 1643 -31 244 -432 1001 1309 1235 588 45 -99 -31 348 -723 1140 1116 952 1195 -645 -627 -1513 -2026 -1371 -818 -579 -293 -1035 53 -210 378 602 -19 2056 1644 942 1124 808 -575 -736 -180 308 762 1038 -1719 -721 -721 -514 -142 -57 -458 -43 -326 -106 689 992 907 761 175 -564 -692 -754 -1 -400 714 344 1101 1946 258 688 662 -197 81 853 -489 -887 -117 -88 -680 -233 168 -97 435 702 -687 -530 -490 -493 -418 488 496 727 -179 -412 -44 146 161 -82 -845 83 -1 354 -99 282 800 317 506 480 -710 120 -500 -298 540 672 624 429 -585 256 70 -952 -392 156 -592 -545 -504 -511 -400 -230 -393 -497 107 -94 105 531 -529 -142 250 -268 168 539 645 347 710 914 531 1140 -23 182 -302 642 823 829 448 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