File name: Pandora159s1_Wakkerstroom_20211226_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035217.5Z 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_20211226_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: 20211226 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 20211226T040318.4Z 8030.168963 189 1 49.53 2 78.81 110.65 36.40 342.65 0.00 1 0.00 1 0 25 1.421e-01 6.066e-03 8.101e-02 1.849e-03 5.719271e-01 9.722033e-04 5.744339e-03 -6.000000e+00 8.074082e-02 227.79 -2.00 3.06 -2.00 320.77 0.00e+00 3.564934e-03 4.054731e-04 1.279499e-03 -6.000000e+00 3.563027e-03 281.67 -2.00 20.00 -2.00 320.17 0.00e+00 4.981 0.001 302.00 328.00 3 1.4193e+00 3.0860e-03 4.9001e-02 -6.0000e+00 2.0073e-01 5.4493e-02 4.0227e-03 2.9526e-02 -6.0000e+00 2.1808e-01 -2.6024e-02 3.9364e-03 1.3663e-02 -6.0000e+00 1.2982e-01 -1.7582e-03 1.9451e-03 6.2577e-03 -6.0000e+00 5.5120e-02 1.1479e-03 -9.5880e-04 5.2670e-05 5.2261e-05 -6.0000e+00 3.7995e-03 -3.6123e-03 10 0 0 10 0 0 99.66 19.15 0.34 -0.00361 -0.01082 215 46 4 8 0 229.270 15.00 19.15 20.20 21.48 21.38 19.3 891.88 -71577 -66749 -3937 -32326 -72028 -39725 -57813 -32191 -52373 -19762 -30598 -12552 -4238 -9955 -15108 -13137 -8236 -50 -3617 -13434 -1133 -11245 -3440 -2146 -1728 -11265 -3266 -2719 -12142 1039 3833 -2572 -1086 -1020 -6818 -801 -4298 -844 -5015 -3413 -4361 -2515 -1056 -2478 1518 -1102 605 39 142 702 2061 1244 2039 1355 980 1705 -1048 11 -162 458 1912 1690 1223 1508 -154 1897 1440 1051 1864 675 541 -161 31 -88 -331 -40 303 348 1134 -708 53 -998 -1854 -718 -1115 -868 -739 -296 -218 33 749 861 1075 1630 1346 449 801 482 -475 -401 -129 -197 1040 369 -1388 -1184 -183 -904 -190 -117 -279 -389 -11 319 529 1368 861 634 -93 -860 -1039 -326 -65 -285 475 191 1167 1495 603 39 112 -40 90 202 -178 -534 -52 -25 -518 -45 100 126 254 -542 -566 -19 -204 -623 -244 -459 -226 -510 -150 -270 -104 -41 -129 -259 -263 -177 -1 -89 -350 -30 -326 -96 -64 -56 -384 -115 -93 -449 36 151 -117 -56 -56 -384 -42 -256 -58 -442 -353 -512 -312 -136 -332 199 -152 84 6 21 109 350 237 422 305 234 420 -273 3 -41 113 481 468 386 529 -57 672 497 371 718 303 268 -84 16 -43 -149 -16 112 129 461 -346 30 -645 -1319 -535 -889 -738 -661 -271 -199 29 609 649 765 1172 1074 415 848 534 -577 -487 -146 -218 1047 378 -1561 -1407 -207 -1098 -248 -170 -446 -653 -18 506 784 1913 1211 936 -146 -1435 -1734 -523 -100 -425 672 261 1648 2165 901 65 205 -78 181 428 -406 -1287 -119 -57 -1201 -109 228 270 528 SS 20211226T053719.7Z 8030.234256 236 1 25.26 2 58.79 102.03 47.36 312.08 0.00 1 0.00 1 0 17 1.419e-02 1.047e-02 1.112e-02 3.974e-03 2.214747e-01 1.983934e-03 2.365393e-03 -6.000000e+00 8.062762e-03 227.79 -2.00 3.06 -2.00 317.13 0.00e+00 2.832212e-04 2.720743e-04 5.177004e-05 -6.000000e+00 3.557267e-04 281.68 -2.00 20.00 -2.00 316.41 0.00e+00 1.923 0.000 302.00 328.00 3 5.4897e+00 5.2230e-03 1.8546e-02 -6.0000e+00 2.0044e-02 7.3736e-04 5.8706e-03 1.0044e-02 -6.0000e+00 2.1775e-02 2.0981e-02 3.4910e-03 4.9355e-03 -6.0000e+00 1.2963e-02 -8.3896e-03 1.7017e-03 1.3984e-03 -6.0000e+00 5.5057e-03 3.5315e-04 -3.2638e-05 1.1381e-04 1.5999e-05 -6.0000e+00 3.7926e-04 -6.1112e-03 12 9 9 12 9 1 99.80 19.15 0.52 -0.00611 -0.00636 6 3 1 8 0 3582.260 14.99 19.15 22.36 21.48 21.48 19.1 900.73 -2328 -482 -106 -2558 -1857 -1120 1012 5548 329 -3106 -2826 4391 -85 -2554 3669 -47 -297 -729 1654 -1585 -2133 2477 -303 2264 72 2740 -620 432 -659 2459 874 2509 1417 -3168 -1395 1748 913 1033 -78 -646 -656 -1108 -961 -2020 -900 -1577 -29 -554 -895 -571 1603 417 432 115 -657 638 517 28 546 585 815 2018 1219 646 -406 91 643 -448 2257 -332 78 -562 -395 -156 475 -176 165 -18 1698 682 -564 -363 -2197 -758 -1398 -410 369 -228 -22 465 369 216 934 2315 1551 152 1332 181 -232 -579 -875 -68 611 1119 -883 -367 -6122 -307 384 697 463 75 -147 477 -10 863 514 34 598 -500 -401 613 -203 -411 1047 371 1365 1901 585 217 -23 -324 -323 199 -568 -296 335 -242 -592 -382 265 -178 215 -310 -68 -15 -350 -226 -129 121 716 50 -502 -448 661 -15 -517 791 -11 -74 -189 434 -442 -612 675 -86 661 23 867 -201 131 -189 670 252 765 466 -1111 -451 538 305 401 -36 -344 -376 -663 -590 -1261 -556 -977 -17 -324 -514 -328 940 263 285 80 -468 457 377 20 390 417 595 1551 1012 566 -357 74 485 -332 1727 -288 73 -546 -384 -148 422 -143 123 -13 1229 549 -505 -351 -2271 -805 -1580 -487 455 -290 -27 572 429 232 927 2205 1547 166 1562 232 -313 -772 -1115 -81 689 1297 -1111 -482 -8683 -431 555 1052 727 119 -227 695 -14 1109 661 46 839 -747 -610 922 -301 -591 1433 492 1717 2378 777 305 -34 -481 -485 306 -919 -497 571 -420 -1038 -661 444 -291 344 SS 20211226T064710.1Z 8030.282756 270 1 50.85 2 43.49 95.92 59.69 297.45 0.00 1 0.00 1 0 25 1.132e-02 7.423e-03 3.941e-03 1.882e-03 1.670001e-01 9.436091e-04 1.804613e-03 -6.000000e+00 6.433926e-03 227.79 -2.00 3.06 -2.00 316.47 0.00e+00 7.719185e-04 1.088583e-04 8.920324e-05 -6.000000e+00 2.838612e-04 281.68 -2.00 20.00 -2.00 315.76 0.00e+00 1.377 0.000 302.00 328.00 3 4.3096e+00 2.4628e-03 1.3517e-02 -6.0000e+00 1.5995e-02 1.9775e-02 2.7561e-03 7.6679e-03 -6.0000e+00 1.7376e-02 6.8081e-03 1.5931e-03 3.7325e-03 -6.0000e+00 1.0344e-02 -6.1354e-03 7.4152e-04 1.2299e-03 -6.0000e+00 4.3936e-03 1.9660e-03 -2.0753e-04 5.4147e-05 1.3813e-05 -6.0000e+00 3.0263e-04 -6.2659e-03 11 9 0 11 8 0 99.99 19.16 0.23 -0.00627 -0.00783 497 107 1 8 0 98.910 15.00 19.16 25.62 21.48 21.48 19.5 918.60 -1479 -2171 -3244 -3538 -543 2491 675 3531 -951 744 -1181 2163 -1018 795 -27 -977 -209 -323 -47 321 306 228 1716 -139 631 58 -181 -178 1512 2900 1791 3277 1689 -1187 -473 2089 -903 1852 -394 -1407 -2066 -723 -1214 -1502 -540 -1475 -584 -1001 31 37 1393 162 1190 469 540 974 548 548 755 1538 1496 1312 532 909 -1474 73 -132 950 1815 494 -79 -357 -139 -179 -47 86 1025 475 1762 -484 -341 -1207 -1899 -725 -1208 -779 -719 -522 -312 -279 187 542 601 2293 1295 813 553 390 -758 -712 -38 -350 1261 621 -833 -1009 -229 -921 25 -87 -285 -350 -232 341 137 1143 498 883 237 -435 -673 -207 -76 45 710 500 1270 1674 722 296 404 -116 334 286 -82 -603 -6 -119 -618 2 -258 -262 -70 -305 -483 -732 -744 -98 417 119 679 -210 166 -263 467 -247 212 -8 -316 -69 -108 -16 114 110 81 608 -52 246 23 -72 -67 517 947 609 1159 645 -472 -174 729 -348 810 -208 -857 -1372 -492 -848 -1058 -375 -1026 -394 -652 20 23 880 110 833 347 407 742 424 421 569 1152 1155 1078 471 843 -1380 61 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