File name: Pandora159s1_Wakkerstroom_20210920_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T032803.6Z 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_20210920_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: 20210920 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 20210920T041412.6Z 7933.176535 179 1 48.40 2 85.74 86.64 97.46 255.83 0.00 1 0.00 1 0 242 1.045e+00 6.525e-01 8.385e-01 5.534e-01 6.536843e-01 3.970203e-01 7.804783e-03 -6.000000e+00 7.681943e-01 227.60 -2.00 3.06 -2.00 316.04 0.00e+00 -1.998099e-02 3.785715e-02 3.614647e-03 -6.000000e+00 5.223707e-02 277.58 -2.00 20.00 -2.00 315.06 0.00e+00 11.065 0.008 302.00 328.00 3 3.0509e+00 1.0119e+00 9.5323e-02 -6.0000e+00 1.8839e+00 1.7198e+00 1.1431e+00 5.4579e-02 -6.0000e+00 2.1198e+00 -1.0966e+00 6.2822e-01 1.6337e-02 -6.0000e+00 1.2134e+00 3.8579e-01 2.9613e-01 2.7327e-02 -6.0000e+00 5.1132e-01 5.1703e-07 1.8914e-02 2.1255e-02 2.1141e-04 -6.0000e+00 4.1919e-02 -8.5758e-03 12 8 8 10 0 0 10.55 18.90 18.08 -0.00858 0.13355 12 3 2 8 0 4000.000 15.00 18.90 15.72 21.27 21.27 17.3 873.72 900000 900000 900000 900000 900000 900000 900000 -27966 62575 -33080 900000 900000 93214 900000 -48133 900000 -114720 900000 -72577 900000 69408 900000 175400 900000 900000 900000 900000 900000 99589 900000 900000 87705 900000 900000 900000 171091 900000 900000 900000 900000 -89561 900000 -37705 900000 -13925 139143 -102840 900000 900000 900000 900000 900000 900000 900000 -35557 900000 900000 -45839 900000 73414 900000 900000 4819 900000 5407 900000 900000 900000 79844 900000 215757 900000 -79675 900000 -28664 -19701 900000 28694 900000 900000 900000 9099 900000 136677 45205 99549 70836 -21188 900000 900000 900000 27347 900000 900000 304272 900000 -31415 900000 198219 85245 -6505 18718 381964 4771 150758 -66243 900000 -44202 900000 50502 82206 7037 171739 34294 56433 39253 900000 -52647 1728 48196 101807 900000 38084 125824 35821 900000 71007 205034 -29415 900000 -18806 3065 37274 32384 27475 -13266 -38984 44750 24081 -1863 193665 12394 30914 900000 900000 900000 900000 900000 900000 900000 -14745 32993 -17442 900000 900000 49148 900000 -25378 900000 -79551 900000 -38267 900000 36596 900000 92482 900000 900000 900000 900000 900000 52509 900000 900000 46243 900000 900000 900000 90209 900000 900000 900000 900000 -88471 900000 -20940 900000 -7342 73364 -85708 900000 900000 900000 900000 900000 900000 900000 -23473 900000 900000 -31060 900000 38708 900000 900000 2541 900000 2851 900000 900000 900000 42099 900000 113760 900000 -94821 900000 -16728 -10387 900000 15129 900000 900000 900000 5704 900000 72064 23835 52488 37349 -21076 900000 900000 900000 14419 900000 900000 160431 900000 -42900 900000 104513 44946 -6212 12986 201394 4079 79488 -120937 900000 -74813 900000 42277 53361 9276 90551 31723 40202 32731 900000 -114650 2317 41041 53679 900000 31682 66342 28034 900000 39328 108106 -52054 900000 -34259 4716 43809 42388 39348 -28458 -107476 55125 34415 -3181 102112 16655 35874 SS 20210920T055421.2Z 7933.246078 211 1 51.12 2 63.83 73.99 117.72 242.56 0.00 1 0.00 1 0 25 1.271e-02 6.722e-03 2.585e-03 5.409e-04 3.042040e-01 2.700806e-04 3.201847e-03 -6.000000e+00 7.206942e-03 227.60 -2.00 3.06 -2.00 318.20 0.00e+00 1.422268e-03 4.861436e-05 1.993171e-04 -6.000000e+00 3.130580e-04 277.58 -2.00 20.00 -2.00 317.54 0.00e+00 2.255 0.000 302.00 328.00 3 2.0337e+00 7.2504e-04 2.2986e-02 -6.0000e+00 1.7933e-02 -1.0151e-02 8.2161e-04 1.3952e-02 -6.0000e+00 1.9506e-02 -8.2904e-03 5.3389e-04 6.8036e-03 -6.0000e+00 1.1585e-02 -1.2829e-03 2.7535e-04 2.2930e-03 -6.0000e+00 4.8987e-03 7.5162e-03 -4.3883e-04 1.5588e-05 2.3154e-05 -6.0000e+00 3.3968e-04 1.2944e-03 11 8 0 10 0 0 96.13 18.89 0.25 0.00129 -0.00200 381 82 2 8 0 129.060 15.00 18.89 17.01 21.27 21.27 17.1 879.84 -4049 -2535 -4616 -5445 -4596 -1405 -1910 -325 -1447 -2946 -2871 -1460 -1009 -1027 -361 -1823 -153 -778 -173 77 -188 988 1260 533 148 -317 -1123 -545 447 2147 1773 2423 986 -2123 -549 446 -646 609 3 -1350 -1525 -1110 -1140 -1209 -412 -963 -477 -252 -459 968 1042 776 1086 774 492 1165 449 449 709 1105 1588 1280 1084 501 -659 465 465 956 1789 328 -123 -382 -345 -121 -227 506 556 1146 1213 -281 -648 -1157 -2097 -834 -1113 -1005 -536 -549 -314 -280 562 472 1157 1892 1430 688 733 116 -802 -667 -415 -214 796 589 -1104 -684 -749 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6.450442e-03 227.60 -2.00 3.06 -2.00 317.98 0.00e+00 1.080331e-03 3.686840e-05 1.596994e-04 -6.000000e+00 2.801949e-04 277.58 -2.00 20.00 -2.00 317.32 0.00e+00 2.150 0.000 302.00 328.00 3 1.7560e+00 5.8549e-04 2.1872e-02 -6.0000e+00 1.6051e-02 -1.1274e-02 6.6237e-04 1.3171e-02 -6.0000e+00 1.7458e-02 -6.8161e-03 4.1957e-04 6.4497e-03 -6.0000e+00 1.0369e-02 -1.2427e-03 2.1343e-04 2.0488e-03 -6.0000e+00 4.3845e-03 1.1047e-02 -4.2134e-04 1.2634e-05 2.1066e-05 -6.0000e+00 3.0402e-04 1.1505e-03 11 8 0 10 0 0 89.58 18.88 0.28 0.00115 -0.00202 528 114 2 8 0 93.040 14.99 18.88 17.63 21.27 21.27 17.7 886.98 -3235 -2646 -4193 -4301 -2926 -1268 -1072 416 -567 -2989 -1566 -573 -642 -551 238 -1796 -67 -429 -66 44 -722 790 1429 723 81 227 -1194 -42 1047 2289 1715 2451 1238 -1829 -788 474 -543 284 -99 -1619 -1528 -1065 -1122 -1046 -262 -974 -627 -318 -392 862 980 786 1072 810 538 1164 481 469 688 1137 1484 1357 1146 514 -753 319 476 874 1946 275 -8 -387 -329 -184 -243 449 800 1203 1275 -218 -685 -1240 -2081 -886 -1101 -1008 -618 -545 -312 -315 493 495 1221 1948 1395 720 758 130 -836 -615 -378 -290 785 735 -1068 -741 -683 -652 -92 -105 -283 -327 -47 189 443 1091 750 580 158 -696 -815 -284 -162 -46 807 398 1215 1692 544 424 152 67 169 463 -212 -345 -23 -52 -573 -208 -174 -287 49 -246 -219 -360 -381 -228 -93 -84 36 -55 -311 -160 -60 -77 -70 34 -293 -11 -76 -12 8 -141 151 277 149 18 52 -273 -9 208 446 360 562 313 -488 -195 113 -143 88 -37 -713 -735 -534 -580 -546 -135 -508 -321 -159 -193 425 512 443 640 468 321 707 299 290 415 741 914 903 835 403 -597 232 320 573 1358 222 -7 -357 -302 -163 -199 328 573 822 919 -166 -591 -1189 -2151 -948 -1166 -1143 -738 -670 -382 -372 534 529 1188 1835 1407 812 881 169 -1164 -842 -482 -338 925 828 -1330 -973 -938 -936 -129 -157 -451 -528 -73 273 632 1452 1000 809 238 -1045 -1250 -426 -237 -69 1145 541 1552 2164 756 637 242 102 261 744 -363 -626 -43 -99 -1096 -388 -310 -493 81 SS 20210920T060619.1Z 7933.254388 216 1 51.42 2 61.29 72.21 119.99 240.61 0.00 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