File name: Pandora159s1_Wakkerstroom_20240905_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240905T221329.0Z 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_20240905_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: 20240905 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 20240905T050451.7Z 9014.211710 53 1 49.23 2 78.44 76.21 93.88 94.36 0.00 1 0.00 1 0 25 2.049e-01 6.477e-03 8.883e-02 2.395e-03 5.625586e-01 1.257870e-03 5.597051e-03 -6.000000e+00 1.158755e-01 227.16 -2.00 3.06 -2.00 320.91 0.00e+00 5.389128e-03 5.271873e-04 1.810530e-03 -6.000000e+00 5.035884e-03 277.17 -2.00 20.00 -2.00 320.36 0.00e+00 4.832 0.001 302.00 328.00 3 1.9894e+00 3.9706e-03 4.8624e-02 -6.0000e+00 2.8807e-01 7.2423e-03 5.1796e-03 3.1701e-02 -6.0000e+00 3.1362e-01 -4.7666e-02 5.2189e-03 1.3545e-02 -6.0000e+00 1.8629e-01 1.1127e-02 2.5780e-03 7.4763e-03 -6.0000e+00 7.8667e-02 7.6121e-04 -1.0984e-03 6.9317e-05 5.6979e-05 -6.0000e+00 5.4798e-03 1.2912e-02 11 8 0 10 0 0 99.64 19.10 0.31 0.01291 0.00466 139 30 4 8 0 354.130 14.99 19.10 15.95 21.48 21.38 25.9 829.46 -98830 -66792 -89758 -17960 -89180 -32336 -76826 -64327 -64761 -60832 -40765 -25054 -40160 -33178 -20046 -17324 4688 -17080 -1815 -14006 -2257 -12419 -5345 -7685 -12339 -9064 -14509 -6316 -15033 6734 -6911 -1782 285 -2344 2323 -7076 -6221 261 -99 -7901 -1083 -2400 223 -3002 1237 -216 331 1544 939 2756 759 1345 1483 2358 36 935 -606 1247 691 1527 2042 2341 2188 1608 804 647 2860 1005 2750 -159 530 -369 -445 359 -383 -419 453 -30 -201 153 -526 -1007 -2078 -830 -934 -397 -146 -335 71 542 1150 808 1112 1625 994 315 768 115 -816 -292 -281 -39 901 239 -1935 -916 -745 -649 -27 -182 -714 -274 -50 401 397 1443 881 259 -178 -954 -739 -210 -226 -18 453 344 1422 1511 375 286 373 97 126 268 -369 -286 82 -179 -420 -108 64 -137 215 -1039 -593 -1069 -101 -937 -189 -754 -631 -711 -682 -390 -234 -554 -550 -365 -364 89 -403 -40 -366 -54 -327 -150 -215 -388 -289 -493 -193 -501 216 -273 -79 14 -127 115 -383 -370 17 -8 -824 -118 -283 27 -386 155 -28 44 209 133 407 127 248 298 505 8 221 -149 299 162 354 492 624 663 545 284 221 929 341 1017 -70 253 -184 -219 166 -163 -160 160 -11 -81 72 -291 -633 -1433 -598 -719 -325 -125 -297 62 455 893 584 763 1137 780 287 800 125 -970 -342 -306 -41 882 241 -2153 -1066 -912 -776 -35 -261 -1130 -450 -82 618 573 1970 1220 380 -279 -1573 -1210 -331 -343 -26 633 505 1986 2193 566 482 682 188 254 569 -844 -688 201 -448 -1049 -259 144 -294 447 SS 20240905T051135.8Z 9014.216387 56 1 49.61 2 76.98 75.36 92.42 93.62 0.00 1 0.00 1 0 25 8.563e-02 6.092e-03 2.789e-02 9.983e-04 5.111630e-01 5.094234e-04 5.150954e-03 -6.000000e+00 4.842891e-02 227.16 -2.00 3.06 -2.00 320.39 0.00e+00 7.624629e-03 1.829643e-04 1.814176e-03 -6.000000e+00 2.104667e-03 277.17 -2.00 20.00 -2.00 319.83 0.00e+00 4.330 0.000 302.00 328.00 3 1.0181e+00 1.5060e-03 4.4313e-02 -6.0000e+00 1.2040e-01 2.3461e-02 1.8799e-03 3.0897e-02 -6.0000e+00 1.3108e-01 -2.8608e-02 1.8003e-03 1.2420e-02 -6.0000e+00 7.7859e-02 4.0071e-03 9.2037e-04 9.5378e-03 -6.0000e+00 3.2879e-02 3.0492e-03 -1.0302e-03 2.8210e-05 6.2795e-05 -6.0000e+00 2.2902e-03 1.2729e-02 10 0 0 10 0 0 81.03 19.10 0.26 0.01273 0.00499 353 76 2 8 0 139.740 15.00 19.10 16.30 21.48 21.38 26.0 831.61 -25337 -32034 -28386 -23746 -30883 -18281 -30983 -21880 -29281 -25351 -32016 -22867 -26271 -9010 -10198 -7462 -1490 -4596 -296 1500 -1199 -1325 -10 -5198 -4006 -3387 -2010 -5714 122 -1476 -73 2403 1003 -781 -469 -1719 -2532 825 -1593 -2457 -3924 -913 -1899 -852 -244 -421 -145 -416 744 1188 1624 353 1554 699 1080 688 100 67 123 700 997 1366 1262 871 -732 919 258 1456 1253 287 91 -326 70 -75 96 564 288 411 1079 -755 -543 -1412 -2094 -1120 -996 -923 -504 -202 173 427 1131 1094 1472 1882 988 717 880 214 -512 -227 -90 -104 1158 509 -1184 -742 -722 -697 -183 -235 -433 -323 1 321 493 1097 498 371 -431 -926 -970 -266 -407 -162 504 127 1404 1612 463 285 207 129 129 343 -304 -395 108 -136 -470 -137 -51 -13 206 -237 -371 -337 -259 -331 -167 -341 -245 -388 -338 -471 -347 -474 -176 -252 -211 -44 -155 -10 54 -45 -50 0 -219 -176 -154 -91 -262 5 -70 -4 152 73 -61 -35 -128 -209 78 -187 -340 -611 -147 -325 -149 -43 -77 -27 -80 145 243 362 88 415 201 323 212 32 21 38 213 318 480 501 384 -337 399 109 615 585 155 49 -184 39 -43 50 264 125 179 520 -435 -331 -976 -1574 -879 -834 -825 -473 -194 165 390 953 852 1078 1396 818 682 957 265 -686 -301 -111 -115 1176 533 -1363 -899 -919 -942 -267 -349 -699 -540 2 498 712 1627 748 541 -676 -1528 -1600 -423 -625 -239 766 186 1947 2309 746 472 369 241 251 701 -669 -846 235 -303 -1049 -295 -111 -28 415 SS 20240905T051701.1Z 9014.220152 58 1 49.64 2 75.82 74.66 91.24 93.04 0.00 1 0.00 1 0 25 5.105e-02 6.169e-03 1.422e-02 6.835e-04 4.735785e-01 3.472286e-04 4.848725e-03 -6.000000e+00 2.887530e-02 227.16 -2.00 3.06 -2.00 320.05 0.00e+00 6.204965e-03 1.120723e-04 1.273405e-03 -6.000000e+00 1.254882e-03 277.17 -2.00 20.00 -2.00 319.47 0.00e+00 3.997 0.000 302.00 328.00 3 6.6462e-01 1.0040e-03 4.0163e-02 -6.0000e+00 7.1785e-02 2.5201e-02 1.2140e-03 2.6281e-02 -6.0000e+00 7.8152e-02 -2.0318e-02 1.0849e-03 1.1274e-02 -6.0000e+00 4.6422e-02 1.0040e-03 5.6342e-04 7.5751e-03 -6.0000e+00 1.9604e-02 5.8685e-03 -8.9966e-04 1.9451e-05 5.4270e-05 -6.0000e+00 1.3655e-03 1.2642e-02 10 0 0 10 0 0 98.16 19.10 0.25 0.01264 0.00588 576 124 2 8 0 85.730 15.00 19.10 16.85 21.48 21.38 26.1 835.31 -22665 -15445 -11911 -9113 -19764 -10933 -23946 -6802 -19731 -11371 -19734 -10703 -11581 -7768 -3918 -6266 -1061 -2496 1 -1234 305 -388 407 -1831 -922 -3235 -4265 -2986 -4016 792 766 3169 342 -602 -2346 -492 -2301 -86 -1351 -2081 -2227 -1742 -1536 -1537 -115 -1131 237 -228 370 1038 1270 1081 1530 668 758 908 231 391 278 957 980 1258 1114 804 -624 605 453 934 1668 109 80 -461 -73 -65 -148 387 402 455 633 -630 -801 -1381 -2100 -956 -1050 -695 -387 -180 133 245 1039 987 1400 1938 1330 708 834 213 -553 -383 -94 -42 1057 444 -1226 -770 -1076 -614 -35 -173 -399 -254 0 296 443 1117 574 383 -285 -970 -839 -322 -288 -131 558 186 1398 1578 476 353 134 109 114 333 -288 -398 68 -86 -555 -109 -72 -5 190 -316 -230 -180 -128 -282 -138 -367 -98 -358 -199 -384 -213 -288 -214 -127 -243 -43 -112 0 -61 15 -19 21 -101 -53 -199 -266 -179 -240 48 54 253 32 -59 -221 -45 -237 -10 -198 -359 -424 -352 -324 -333 -25 -254 53 -52 86 252 335 314 478 225 265 326 85 142 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