File name: Pandora159s1_Wakkerstroom_20220117_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035245.0Z 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 v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20220117_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: 20220117 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 20220117T070423.3Z 8052.294714 256 1 48.01 2 42.54 91.47 146.03 276.51 0.00 1 0.00 1 0 17 1.693e-02 1.022e-02 1.327e-02 6.787e-03 1.710742e-01 3.408617e-03 1.812015e-03 -6.000000e+00 9.621553e-03 227.61 -2.00 3.06 -2.00 316.15 0.00e+00 -1.615851e-04 3.699782e-04 1.533280e-04 -6.000000e+00 4.262394e-04 282.57 -2.00 20.00 -2.00 315.45 0.00e+00 1.356 0.000 302.00 328.00 3 6.8704e+00 8.8553e-03 1.3396e-02 -6.0000e+00 2.3902e-02 7.9263e-02 9.9045e-03 7.6195e-03 -6.0000e+00 2.5962e-02 -7.6778e-06 5.7010e-03 3.7315e-03 -6.0000e+00 1.5466e-02 -4.5253e-03 2.6305e-03 1.1024e-03 -6.0000e+00 6.5795e-03 1.5093e-04 -3.6731e-04 1.9331e-04 1.3364e-05 -6.0000e+00 4.5266e-04 -8.5370e-03 12 8 8 10 0 0 99.38 19.22 1.18 -0.00854 -0.01130 12 3 2 8 0 4000.000 15.00 19.22 21.00 21.48 21.48 19.5 892.12 -2743 3567 -1931 1252 -2611 1500 -2750 7664 1893 -5856 -2030 800 3330 3596 977 -4362 -734 -3440 1683 278 1880 -759 2641 -1406 553 -228 -661 -1680 2248 4128 1957 609 -281 -675 -2081 4545 -945 955 -2665 -1424 221 1321 -558 -1916 224 -2497 711 -1866 919 -563 1834 -811 1631 -969 39 2674 316 787 -638 483 158 1415 514 1175 -752 573 -1259 1523 1620 740 1159 418 2004 -1668 435 -983 -233 -1180 -1869 240 -1691 117 -2258 -83 -1263 574 -763 524 -577 1379 1711 -432 -217 1401 -506 -415 217 60 78 -950 -224 -1188 -147 -446 -717 -1878 -954 -297 -38 907 118 207 -327 1048 -1103 625 -574 559 651 -84 454 1099 781 355 1382 -1732 605 1080 1166 -1284 645 96 -146 -707 -541 -571 1404 875 -97 -735 -106 -299 -830 -623 819 -469 274 -525 273 -547 1541 444 -1539 -502 192 843 1016 314 -1583 -262 -1285 616 106 715 -294 996 -576 234 -100 -286 -689 819 1420 705 236 -116 -283 -827 1641 -386 446 -1525 -924 153 938 -412 -1437 163 -1850 498 -1293 598 -367 1210 -580 1194 -757 31 2089 256 631 -510 379 128 1204 472 1126 -725 499 -1022 1155 1287 665 1127 427 2016 -1683 406 -840 -178 -848 -1392 193 -1532 114 -2374 -89 -1455 697 -987 690 -769 1749 2011 -473 -215 1311 -499 -443 252 76 104 -1264 -280 -1382 -162 -509 -887 -2475 -1297 -418 -55 1372 186 328 -501 1477 -1449 760 -698 699 870 -120 668 1604 1113 489 1802 -2211 718 1261 1432 -1709 873 132 -203 -1025 -823 -911 2256 1444 -163 -1221 -170 -467 -1271 SS 20220117T094101.3Z 8052.403488 332 1 3.08 2 9.29 45.89 178.21 205.33 0.00 1 0.00 1 0 17 9.391e-03 8.305e-03 5.550e-03 4.565e-03 1.247098e-01 2.351743e-03 1.392622e-03 -6.000000e+00 5.335170e-03 227.61 -2.00 3.06 -2.00 313.79 0.00e+00 1.643103e-04 1.635933e-04 3.200774e-05 -6.000000e+00 2.363818e-04 282.57 -2.00 20.00 -2.00 313.33 0.00e+00 1.013 0.000 302.00 328.00 3 4.6969e+00 5.9720e-03 1.0014e-02 -6.0000e+00 1.3254e-02 4.3805e-02 6.6035e-03 5.7004e-03 -6.0000e+00 1.4397e-02 -3.7046e-03 3.7995e-03 2.8200e-03 -6.0000e+00 8.5763e-03 -1.4635e-03 1.6349e-03 8.1275e-04 -6.0000e+00 3.6479e-03 1.9633e-03 -4.3933e-04 1.2568e-04 1.1754e-05 -6.0000e+00 2.5105e-04 -7.4035e-03 12 9 1 12 1 1 999.00 19.25 0.28 -0.00740 -0.01070 1 7 1 8 0 1439.910 15.00 19.25 24.33 21.58 21.48 20.0 911.72 -1455 -787 -337 -2063 -1612 -1850 1708 100 1246 -136 311 1609 -179 647 1014 -203 94 216 1163 112 -570 1098 512 668 578 956 -2085 -33 1732 2047 1198 1866 982 -605 19 864 -404 -390 285 -1001 -1988 -1409 -862 -1080 -776 -1323 -1665 -533 -179 414 -463 993 818 925 323 399 -536 685 164 886 1676 992 958 563 -1203 325 835 710 1641 -383 -117 -325 -595 376 23 1239 -215 1004 1282 642 -1550 -1181 -1650 -866 -1192 -446 -660 -529 -133 -74 -228 -463 1140 2190 2183 584 503 233 -819 -902 293 -9 714 272 -729 -864 -143 -987 -94 106 -365 -1050 -138 424 178 1299 408 147 785 -718 -687 -270 -416 93 689 836 622 1956 629 677 -105 119 31 926 -521 -443 315 -150 -310 -365 -457 -331 -237 -721 -407 -172 -1008 -718 -787 729 47 620 -69 155 786 -93 358 598 -126 58 136 735 72 -374 704 331 442 395 662 -1456 -22 1062 1214 723 1154 631 -394 12 520 -257 -273 222 -855 -1790 -1290 -796 -1002 -715 -1216 -1501 -466 -151 346 -395 870 735 852 301 374 -510 646 153 823 1578 972 978 591 -1263 319 769 634 1501 -380 -122 -348 -642 396 23 1177 -191 850 1096 584 -1520 -1219 -1764 -945 -1352 -525 -804 -657 -165 -90 -266 -511 1168 2164 2202 622 566 277 -1009 -1101 343 -10 777 303 -858 -1054 -177 -1258 -122 140 -496 -1434 -182 535 213 1482 464 172 952 -917 -896 -351 -534 117 832 983 707 2188 729 808 -128 147 38 1160 -678 -594 428 -207 -430 -503 -621 -442 -313 SS 20220117T095832.5Z 8052.415654 342 1 1.18 2 7.10 21.21 176.61 118.04 0.00 1 0.00 1 0 17 9.462e-03 8.028e-03 2.405e-03 2.025e-03 1.201605e-01 1.046768e-03 1.332016e-03 -6.000000e+00 5.376130e-03 227.61 -2.00 3.06 -2.00 313.61 0.00e+00 3.472469e-04 7.058833e-05 3.511630e-05 -6.000000e+00 2.381822e-04 282.57 -2.00 20.00 -2.00 313.17 0.00e+00 1.008 0.000 302.00 328.00 3 1.9514e+00 2.6540e-03 9.8444e-03 -6.0000e+00 1.3356e-02 1.6824e-02 2.9281e-03 5.4929e-03 -6.0000e+00 1.4507e-02 -4.5564e-04 1.6887e-03 2.7024e-03 -6.0000e+00 8.6419e-03 -2.0238e-03 7.2564e-04 8.1226e-04 -6.0000e+00 3.6761e-03 3.1227e-02 -2.7947e-04 5.5678e-05 1.1379e-05 -6.0000e+00 2.5296e-04 -7.9349e-03 12 9 1 12 1 1 75.78 19.25 0.28 -0.00793 -0.01003 5 125 2 8 0 84.240 15.00 19.25 25.52 21.58 21.58 19.9 916.41 -1347 -2109 -1724 -2780 -566 532 1492 1900 891 -681 212 1211 654 229 547 -906 250 147 84 678 306 789 1594 760 763 405 -1154 -168 1452 2442 2177 2080 1298 -1264 -606 1363 -255 -210 -403 -1621 -1793 -1140 -1366 -1389 -1114 -1100 -1003 -281 -565 623 807 282 505 1049 473 944 284 405 444 691 969 994 937 185 -828 8 427 731 2027 672 -46 -467 -353 -493 -204 250 363 1095 1271 -152 -757 -1271 -2085 -671 -1177 -993 -829 -593 -659 -478 511 -177 768 2026 1073 743 511 111 -612 -546 -4 41 1012 1047 -795 -913 -402 -834 -246 -112 -232 3 -93 141 424 657 810 591 332 -348 -572 -181 -112 108 1147 411 1254 1582 748 -112 140 -181 129 378 -454 -276 -148 -93 -590 -403 -163 -199 -257 -720 -1134 -918 -1459 -272 236 681 962 470 -375 112 623 362 132 328 -585 162 96 56 459 211 531 1068 504 527 288 -818 -116 901 1510 1368 1293 856 -860 -379 854 -165 -149 -325 -1379 -1648 -1030 -1260 -1283 -1018 -995 -916 -243 -490 522 696 246 459 984 434 872 267 378 406 657 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