File name: Pandora159s1_Wakkerstroom_20240307_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240307T221527.2Z 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_20240307_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: 20240307 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 20240307T051810.5Z 8832.220955 167 1 6.34 2 72.63 86.71 28.70 91.05 0.00 1 0.00 1 0 17 5.799e-02 9.716e-03 4.883e-02 6.820e-03 3.624908e-01 3.402742e-03 3.777002e-03 -6.000000e+00 3.284839e-02 227.44 -2.00 3.06 -2.00 318.52 0.00e+00 1.440840e-03 6.952536e-04 1.082825e-04 -6.000000e+00 1.455996e-03 282.26 -2.00 20.00 -2.00 317.79 0.00e+00 3.304 0.000 302.00 328.00 3 3.9999e+00 9.2366e-03 3.1406e-02 -6.0000e+00 8.1576e-02 4.5261e-02 1.0564e-02 1.6538e-02 -6.0000e+00 8.8708e-02 -7.2276e-03 7.1976e-03 8.1045e-03 -6.0000e+00 5.2839e-02 -1.5157e-03 3.7782e-03 2.5832e-03 -6.0000e+00 2.2410e-02 4.1580e-04 -6.7393e-04 1.9269e-04 2.6086e-05 -6.0000e+00 1.5513e-03 1.0976e-02 12 9 9 12 1 1 999.00 19.98 0.35 0.01098 0.00591 2 5 1 8 0 2110.370 15.00 19.98 22.09 22.09 21.98 27.9 866.65 36737 -14308 11535 -6959 -6401 -4228 33135 -10106 14640 17449 -18247 -13691 2372 1620 1891 6039 -401 -2114 -2124 3179 -4147 6554 7341 188 -4072 -4253 1862 2317 3635 -6348 2520 6798 726 -2499 408 -3477 -2480 -3093 -1409 -4257 -5678 966 -408 888 -2825 -122 -2153 -1496 930 1635 1005 518 1330 1349 573 1032 1179 2316 861 3300 2463 -360 1822 593 -944 730 646 809 1933 868 -519 -637 -1229 618 412 1792 -179 567 513 -341 -728 -1197 -2967 -1248 -936 -1034 32 -511 16 -570 596 -516 991 1172 1543 2018 675 589 -1895 -237 -105 546 1202 -504 -1941 -962 -578 -568 190 -93 -3 -39 591 -474 76 157 999 941 704 -49 -1276 -145 -465 -621 1381 668 1366 2315 -686 510 -255 104 -289 326 -218 -644 307 -72 -521 -86 220 -589 219 1130 -793 515 -349 -290 -183 1078 -562 714 871 -1283 -983 170 139 188 646 -48 -274 -290 429 -614 875 1002 29 -697 -758 313 369 550 -1071 430 1236 153 -556 84 -731 -566 -831 -442 -1569 -2293 386 -170 370 -1223 -52 -928 -638 388 694 457 255 686 731 322 591 685 1325 490 1836 1423 -228 1226 429 -694 502 423 529 1337 673 -435 -550 -1059 507 319 1262 -119 367 354 -264 -623 -1113 -2938 -1269 -1000 -1161 38 -605 19 -655 645 -528 950 1115 1551 2199 807 761 -2601 -318 -134 651 1368 -597 -2452 -1256 -777 -792 275 -143 -5 -63 932 -723 109 218 1381 1345 1055 -76 -2025 -226 -711 -924 1970 927 1826 3112 -997 779 -408 170 -480 556 -388 -1186 570 -136 -989 -160 398 -1037 379 SS 20240307T052907.6Z 8832.228561 169 1 52.50 2 70.21 85.40 26.34 89.81 0.00 1 0.00 1 0 25 1.136e-02 6.583e-03 1.915e-03 3.175e-04 3.215625e-01 1.589397e-04 3.386006e-03 -6.000000e+00 6.433775e-03 227.44 -2.00 3.06 -2.00 318.56 0.00e+00 1.597007e-03 3.218156e-05 2.548244e-04 -6.000000e+00 2.851870e-04 282.26 -2.00 20.00 -2.00 317.82 0.00e+00 2.922 0.000 302.00 328.00 3 3.7539e-01 4.3189e-04 2.7878e-02 -6.0000e+00 1.5978e-02 1.4884e-02 4.9295e-04 1.4986e-02 -6.0000e+00 1.7375e-02 -8.0700e-03 3.3036e-04 7.1952e-03 -6.0000e+00 1.0349e-02 -1.8965e-03 1.7240e-04 2.5062e-03 -6.0000e+00 4.3890e-03 2.2736e-02 -5.4565e-04 9.1793e-06 2.4558e-05 -6.0000e+00 3.0387e-04 1.1507e-02 11 8 0 10 0 0 99.58 19.98 0.24 0.01151 0.00741 1560 336 2 8 0 31.620 15.00 19.98 22.92 22.09 22.09 28.2 873.42 -3233 -2375 -4156 -4586 -2471 -2501 -490 -597 -942 -3081 -1743 -452 -792 -766 -173 -1609 -191 -508 -70 70 -768 953 971 -384 -64 -635 -1768 -727 213 1865 1299 2125 819 -1995 -652 -115 -677 89 -396 -1627 -1630 -1120 -1198 -1077 -306 -984 -556 -334 -281 959 1003 878 1076 683 528 1167 296 462 792 1184 1647 1368 1195 499 -683 491 465 1081 1815 208 32 -363 -201 -177 -277 512 441 995 1082 -352 -665 -1432 -2066 -871 -1106 -859 -548 -461 -225 -173 609 501 1281 1986 1286 672 766 151 -816 -557 -354 -101 910 617 -1188 -717 -691 -638 -22 -129 -312 -352 -56 158 525 1183 768 553 80 -741 -793 -264 -223 -48 733 335 1316 1657 518 338 99 51 124 389 -262 -387 72 -90 -535 -127 -120 -201 95 -169 -135 -246 -255 -121 -118 -24 -34 -59 -205 -114 -31 -63 -72 -19 -197 -24 -68 -10 10 -115 139 146 -62 -11 -113 -315 -121 33 291 222 399 171 -436 -132 -23 -149 23 -125 -601 -657 -471 -521 -473 -134 -435 -242 -143 -119 411 459 435 566 381 279 628 163 253 461 684 984 815 782 352 -487 321 284 651 1178 156 26 -310 -170 -143 -208 341 291 634 737 -254 -546 -1311 -2032 -889 -1212 -929 -624 -539 -261 -193 675 507 1187 1804 1265 742 875 193 -1115 -745 -441 -114 1047 739 -1453 -922 -930 -901 -32 -208 -493 -565 -86 246 747 1580 1033 782 123 -1207 -1312 -426 -349 -72 1040 454 1683 2144 735 520 162 86 213 646 -466 -723 138 -175 -1054 -242 -219 -353 163 SS 20240307T054143.8Z 8832.237313 176 1 44.84 2 67.42 83.84 23.62 88.24 0.00 1 0.00 1 0 25 1.497e-02 7.379e-03 1.008e-02 2.221e-03 2.882509e-01 1.106585e-03 3.035630e-03 -6.000000e+00 8.478602e-03 227.44 -2.00 3.06 -2.00 318.21 0.00e+00 1.288941e-03 2.011000e-04 1.229712e-04 -6.000000e+00 3.757892e-04 282.26 -2.00 20.00 -2.00 317.46 0.00e+00 2.584 0.000 302.00 328.00 3 4.1311e+00 2.9772e-03 2.4695e-02 -6.0000e+00 2.1056e-02 5.0483e-02 3.3850e-03 1.3206e-02 -6.0000e+00 2.2896e-02 -7.2825e-03 2.1551e-03 6.4281e-03 -6.0000e+00 1.3638e-02 -4.4344e-03 1.1021e-03 2.0985e-03 -6.0000e+00 5.7850e-03 7.1735e-04 -6.4551e-04 6.4250e-05 2.1630e-05 -6.0000e+00 4.0036e-04 1.0197e-02 12 9 1 12 1 1 99.95 19.99 0.20 0.01020 0.00535 39 9 1 8 0 1120.800 15.00 19.99 24.50 22.09 22.09 28.5 879.86 -6768 -2468 -2148 -5820 -2559 -4036 1336 -5241 -445 -5075 -159 1275 653 1775 499 861 665 1205 -680 2101 -1267 19 -870 1166 -2468 -1256 -1680 696 828 1942 3743 1008 1037 -2956 -543 -939 -430 -141 17 -2128 -1216 -405 -1117 -409 -715 -1414 -680 285 -738 1356 1310 1113 1745 1218 857 1366 71 276 547 1013 1384 1336 1006 72 -1076 507 630 1115 1402 501 3 -191 -111 12 -336 -53 -323 1363 1081 -147 -1121 -1235 -2277 -770 -1070 -1020 -691 -612 39 -153 278 371 1394 1552 1336 342 591 148 -965 -472 -332 -305 360 310 -1571 -1009 2629 -915 126 70 -403 25 -28 439 514 980 908 401 10 -774 -678 -318 -458 -361 606 180 1076 1442 247 110 -104 176 20 330 -475 -139 282 11 -572 -58 104 -403 90 -511 -196 -173 -454 -174 -269 90 -424 -38 -471 -14 115 67 211 69 130 106 199 -119 372 -236 4 -164 228 -527 -274 -364 139 157 364 742 224 250 -754 -127 -218 -109 -42 6 -874 -536 -186 -530 -195 -341 -680 -320 131 -337 616 632 576 948 696 506 821 43 169 328 602 849 879 718 55 -826 359 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