File name: Pandora159s1_Wakkerstroom_20230206_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240122T100128.7Z 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_20230206_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: 20230206 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 20230206T043648.2Z 8437.192225 190 1 19.00 2 77.80 101.53 99.12 287.00 0.00 1 0.00 1 0 25 1.632e-01 8.115e-03 1.554e-01 4.513e-03 5.118049e-01 2.316411e-03 5.176541e-03 -6.000000e+00 9.265424e-02 227.69 -2.00 3.06 -2.00 320.19 0.00e+00 1.438633e-03 8.031903e-04 6.928833e-04 -6.000000e+00 4.108370e-03 282.70 -2.00 20.00 -2.00 319.54 0.00e+00 4.599 0.001 302.00 328.00 3 2.9631e+00 6.8954e-03 4.4124e-02 -6.0000e+00 2.3021e-01 6.6217e-02 8.5259e-03 2.4254e-02 -6.0000e+00 2.5012e-01 -1.9043e-02 7.6031e-03 1.1731e-02 -6.0000e+00 1.4899e-01 -1.5261e-03 3.8860e-03 3.9116e-03 -6.0000e+00 6.3313e-02 3.5069e-04 -7.9938e-04 1.2828e-04 3.8534e-05 -6.0000e+00 4.3631e-03 -1.5544e-03 12 9 1 12 1 1 99.86 19.51 0.28 -0.00155 -0.00756 15 9 2 8 0 1176.030 15.00 19.51 22.16 21.79 21.69 24.3 880.86 -13454 113247 65659 3803 -64457 -10185 -62081 -45161 -10529 -49379 1321 -16962 1475 -41603 23202 -13744 15596 -34433 3874 917 7892 -15944 12882 -299 882 -3984 -13527 -16416 -23433 6287 6359 9944 -9234 -1106 -1251 -3486 5640 2026 -1771 970 -496 -1104 787 -1912 3066 -3047 -2437 -1728 2634 2910 2710 2040 1944 2102 2536 3359 -158 -968 -900 224 1007 3745 -65 2167 1292 1300 284 818 1404 -671 208 -2230 708 -1505 -9 161 287 1365 1294 -398 -566 -1334 -2758 -103 -698 -470 -1659 41 633 426 422 765 1843 1678 1844 305 909 508 -830 -1108 -128 210 910 47 -1458 -845 -206 -893 -490 271 -762 -371 -530 446 613 1358 796 591 -87 -437 -607 -14 -141 -361 787 -216 829 1845 701 -301 225 96 -183 448 -18 -592 -192 291 -820 42 367 -290 127 -122 498 339 34 -1029 -96 -1029 -732 -139 -1008 17 -291 26 -1345 493 -480 454 -1752 147 38 313 -796 511 -15 46 -229 -860 -1035 -1539 326 377 657 -828 -97 -106 -298 484 213 -235 148 -86 -205 150 -382 588 -631 -506 -362 544 627 637 535 549 638 806 1099 -55 -337 -307 75 343 1358 -27 971 604 585 124 361 669 -371 124 -1419 436 -904 -5 80 132 619 639 -229 -372 -986 -2215 -85 -614 -437 -1637 41 627 409 382 642 1462 1343 1603 300 994 620 -1088 -1451 -158 236 960 51 -1697 -1026 -259 -1186 -690 409 -1246 -624 -886 711 924 1955 1153 889 -138 -724 -1010 -22 -222 -555 1159 -311 1137 2567 1068 -502 399 177 -346 876 -37 -1278 -418 643 -1829 90 762 -582 249 SS 20230206T044200.6Z 8437.195840 192 1 25.10 2 76.67 100.98 100.18 286.46 0.00 1 0.00 1 0 25 3.284e-01 1.050e-02 1.865e-01 5.874e-03 4.696271e-01 3.004731e-03 4.797425e-03 -6.000000e+00 1.864646e-01 227.69 -2.00 3.06 -2.00 320.06 0.00e+00 1.369090e-03 9.966402e-04 4.229026e-04 -6.000000e+00 8.268314e-03 282.70 -2.00 20.00 -2.00 319.40 0.00e+00 4.234 0.000 302.00 328.00 3 3.7529e+00 8.8567e-03 4.0521e-02 -6.0000e+00 4.6329e-01 5.5483e-02 1.0796e-02 2.1925e-02 -6.0000e+00 5.0338e-01 8.4301e-03 9.3242e-03 1.0736e-02 -6.0000e+00 2.9985e-01 -1.1245e-02 4.8071e-03 3.4021e-03 -6.0000e+00 1.2741e-01 2.2097e-04 -1.0385e-03 1.6969e-04 3.5635e-05 -6.0000e+00 8.7817e-03 -7.9986e-04 12 9 9 12 1 1 99.94 19.51 0.27 -0.00080 -0.00860 14 6 1 8 0 1661.440 15.00 19.51 22.42 21.79 21.69 24.4 883.11 14591 58307 -1599 15940 324525 -83399 142 -46776 41388 -15920 140405 -30345 -26648 -3610 -21213 26208 -22029 24080 -16491 19345 232 5930 -21426 -2075 -13314 6271 8250 -1735 15049 26611 327 2855 5506 -6260 -1060 -6223 1618 -2469 -7090 -2781 -1422 -3008 -2701 5637 -6352 1078 -3809 56 2447 3305 3938 4527 -1296 2319 1397 -2168 2410 2903 -693 -2232 3200 274 2360 -162 204 427 871 350 2685 36 -1105 1051 -821 911 -85 777 1950 1805 528 2188 309 -645 -2665 -1826 -577 -291 -706 -945 -307 -978 1249 21 1101 2833 899 1787 652 -187 -152 -530 -367 354 1501 716 -1854 -262 -4846 290 69 435 35 -149 -256 78 496 426 665 281 86 -627 -589 -28 -69 -129 752 1375 1544 1891 219 481 -492 80 -666 180 -141 -463 524 490 -455 -793 225 -461 307 134 405 -21 168 1859 -2027 2 -994 430 -305 804 -745 -755 -100 -840 761 -1108 840 -905 794 12 286 -1393 -121 -935 385 503 -112 802 1320 23 230 483 -648 -100 -609 161 -303 -1107 -491 -275 -631 -589 1158 -1471 236 -880 13 548 765 982 1237 -403 749 476 -790 864 1033 -249 -809 1139 109 1019 -79 101 202 394 159 1301 20 -690 671 -530 555 -48 398 909 831 266 1249 204 -480 -2175 -1552 -515 -276 -707 -972 -314 -975 1144 18 886 2248 786 1735 715 -231 -199 -694 -454 399 1568 764 -2170 -320 -6412 385 98 663 57 -253 -429 124 743 609 950 418 136 -1037 -979 -45 -109 -197 1100 1929 2079 2586 329 786 -863 145 -1249 349 -289 -992 1137 1080 -1011 -1725 467 -919 595 SS 20230206T050640.2Z 8437.212965 202 1 51.41 2 71.28 98.41 105.26 283.93 0.00 1 0.00 1 0 25 1.421e-02 6.472e-03 2.047e-03 2.799e-04 3.531676e-01 1.396056e-04 3.666653e-03 -6.000000e+00 8.070445e-03 227.69 -2.00 3.06 -2.00 318.77 0.00e+00 4.921128e-04 3.044907e-05 1.643079e-04 -6.000000e+00 3.578481e-04 282.70 -2.00 20.00 -2.00 318.04 0.00e+00 3.078 0.000 302.00 328.00 3 -5.8174e-03 3.8156e-04 2.9632e-02 -6.0000e+00 2.0052e-02 2.3320e-02 4.3897e-04 1.6042e-02 -6.0000e+00 2.1786e-02 -6.0776e-03 3.0579e-04 7.8754e-03 -6.0000e+00 1.2978e-02 -3.7226e-03 1.6074e-04 2.2723e-03 -6.0000e+00 5.5148e-03 2.7982e-02 -5.7256e-04 8.0266e-06 2.3668e-05 -6.0000e+00 3.8003e-04 -1.6664e-03 11 8 0 10 0 0 77.80 19.51 0.24 -0.00167 -0.00597 1751 377 2 8 0 27.440 15.00 19.51 23.34 21.79 21.69 24.4 888.83 -3971 -3726 -4438 -6867 -4458 -3070 -3333 -1442 -2075 -4339 -3456 -1428 -1779 -585 -355 -1486 -876 -647 -428 -298 -1031 232 688 -537 -773 -1230 -2120 -1253 -181 1286 1067 1676 854 -2241 -1197 -89 -839 30 -485 -1476 -1623 -1053 -1258 -945 -248 -745 -575 -152 -292 896 1143 872 1195 816 678 1290 511 414 737 1163 1692 1534 1362 788 -544 548 563 949 1809 324 -89 -266 -383 -114 -264 451 569 915 1253 -212 -582 -1136 -2054 -906 -1073 -975 -559 -520 -298 -269 533 572 1068 1842 1363 677 760 245 -771 -604 -323 -216 819 743 -1131 -840 -652 -705 -44 -97 -287 -358 -77 190 475 1150 783 565 129 -647 -800 -216 -170 -68 672 328 1104 1685 501 280 118 -22 85 345 -287 -394 7 -10 -524 -213 -74 -240 134 -159 -166 -205 -308 -176 -127 -134 -65 -106 -239 -190 -81 -117 -45 -32 -152 -95 -74 -51 -37 -133 29 89 -75 -116 -194 -337 -187 -25 178 161 281 159 -446 -223 -16 -167 7 -138 -498 -604 -411 -509 -386 -101 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