File name: Pandora159s1_Wakkerstroom_20241118_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20241119T080049.7Z 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 v1.8.60 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20241118_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: 20241118 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 20241118T074336.0Z 9088.321944 22 1 49.92 2 28.83 80.47 123.80 287.77 0.00 1 0.00 1 0 25 9.656e-03 7.655e-03 1.592e-04 1.046e-04 1.494428e-01 5.298925e-05 1.637992e-03 -6.000000e+00 5.482366e-03 228.20 -2.00 3.06 -2.00 315.13 0.00e+00 1.436671e-03 4.644990e-06 1.380318e-04 -6.000000e+00 2.401788e-04 280.05 -2.00 20.00 -2.00 314.57 0.00e+00 1.141 0.000 302.00 328.00 3 2.1308e-01 1.3632e-04 1.1556e-02 -6.0000e+00 1.3649e-02 6.2292e-03 1.5166e-04 7.1046e-03 -6.0000e+00 1.4842e-02 -1.9999e-03 8.6552e-05 3.3698e-03 -6.0000e+00 8.8239e-03 -7.6053e-04 3.8413e-05 1.4600e-03 -6.0000e+00 3.7268e-03 1.4872e-01 -4.4189e-04 2.9306e-06 1.5046e-05 -6.0000e+00 2.5836e-04 1.4061e-02 11 8 0 10 0 0 14.12 19.38 0.32 0.01406 0.01074 3746 806 2 8 0 13.180 15.02 19.38 31.50 21.69 21.58 28.6 906.82 -1540 -1482 -2689 -3140 -339 539 1360 1516 620 -1131 138 1429 197 509 163 -1174 160 105 469 674 -75 1233 1358 563 565 -36 -834 0 1293 2450 1959 2526 985 -1816 -25 525 -183 475 -239 -1521 -1529 -988 -1232 -1161 -570 -1257 -922 -545 -459 906 835 709 1006 544 574 1150 432 539 898 1142 1456 989 774 55 -1087 137 70 1042 1665 -17 -199 -476 -280 -181 -328 457 459 1189 1199 -432 -764 -1466 -2049 -805 -1111 -964 -646 -571 -399 -369 413 278 1210 1978 1318 701 795 104 -790 -481 -249 13 999 645 -1051 -565 -606 -615 35 -130 -279 -335 -64 166 529 1171 720 587 188 -645 -734 -237 -189 107 898 454 1423 1631 549 408 90 56 145 416 -271 -436 -1 -222 -626 -198 -266 -383 -59 -505 -515 -937 -1002 -93 152 364 452 203 -384 45 460 70 203 73 -563 77 51 235 346 -39 623 691 299 312 -19 -466 0 609 1106 918 1247 522 -986 -12 253 -97 268 -161 -1182 -1176 -782 -997 -941 -457 -1007 -712 -436 -352 680 653 587 802 452 484 976 373 461 751 954 1256 919 774 58 -1121 126 59 903 1415 -17 -211 -486 -284 -191 -322 399 389 940 985 -371 -733 -1543 -2286 -860 -1276 -1188 -837 -710 -494 -470 481 314 1222 1905 1341 784 909 131 -1053 -623 -300 14 1136 718 -1295 -730 -818 -804 47 -185 -414 -495 -89 228 656 1354 835 716 248 -861 -1010 -321 -267 144 1136 547 1727 1974 659 520 120 75 197 582 -377 -639 -2 -341 -973 -300 -391 -545 -82 SS 20241118T074942.1Z 9088.326182 25 1 49.97 2 27.50 79.32 125.02 287.36 0.00 1 0.00 1 0 25 9.659e-03 7.653e-03 1.556e-04 1.029e-04 1.478861e-01 5.215907e-05 1.619057e-03 -6.000000e+00 5.484304e-03 228.20 -2.00 3.06 -2.00 315.11 0.00e+00 1.322615e-03 4.545271e-06 1.290227e-04 -6.000000e+00 2.402605e-04 280.05 -2.00 20.00 -2.00 314.54 0.00e+00 1.127 0.000 302.00 328.00 3 1.9644e-01 1.3417e-04 1.1412e-02 -6.0000e+00 1.3654e-02 6.7752e-03 1.4931e-04 6.9851e-03 -6.0000e+00 1.4847e-02 -2.0923e-03 8.5161e-05 3.3294e-03 -6.0000e+00 8.8270e-03 -7.5390e-04 3.7631e-05 1.3843e-03 -6.0000e+00 3.7281e-03 1.5352e-01 -4.4076e-04 2.8784e-06 1.4527e-05 -6.0000e+00 2.5845e-04 1.3924e-02 11 8 0 10 0 0 60.83 19.40 0.31 0.01392 0.01061 3888 836 2 8 0 12.700 15.02 19.40 31.92 21.69 21.69 28.4 908.23 -1495 -1475 -2688 -3083 -307 539 1440 1509 663 -1150 129 1422 215 505 152 -1171 150 109 474 647 -110 1218 1373 578 589 -34 -830 -7 1294 2449 1944 2515 973 -1848 -39 583 -172 487 -245 -1524 -1548 -977 -1251 -1163 -581 -1269 -909 -542 -437 883 840 699 1005 549 605 1133 438 541 891 1160 1460 1028 788 64 -1099 150 60 1057 1671 -13 -205 -483 -291 -170 -326 430 469 1163 1217 -429 -763 -1445 -2038 -815 -1128 -968 -645 -573 -397 -357 402 285 1211 2001 1310 704 784 107 -791 -479 -234 15 1018 652 -1053 -567 -618 -623 35 -107 -277 -329 -63 161 555 1190 724 597 187 -635 -733 -229 -200 122 897 453 1415 1623 551 398 88 28 154 406 -276 -435 7 -217 -606 -204 -255 -362 -80 -496 -518 -947 -994 -85 154 390 455 220 -395 42 463 77 204 68 -566 73 54 239 334 -58 620 703 309 328 -18 -467 -4 613 1111 915 1246 518 -1006 -19 281 -91 275 -165 -1188 -1194 -775 -1014 -945 -467 -1018 -703 -434 -336 663 657 579 801 456 510 961 378 462 745 967 1259 954 787 67 -1132 137 50 913 1415 -13 -216 -493 -317 -178 -320 375 396 917 996 -398 -729 -1513 -2262 -867 -1290 -1186 -832 -709 -524 -453 465 321 1217 1916 1325 783 891 134 -1048 -617 -280 18 1150 777 -1289 -730 -830 -810 48 -152 -408 -482 -88 219 683 1365 834 723 245 -902 -1000 -309 -281 162 1126 541 1705 1948 656 503 116 37 207 563 -381 -632 11 -330 -934 -307 -372 -511 -118 SS 20241118T075439.2Z 9088.329620 27 1 49.95 2 26.42 78.34 126.02 287.03 0.00 1 0.00 1 0 25 9.644e-03 7.675e-03 1.528e-04 1.018e-04 1.463945e-01 5.151617e-05 1.600602e-03 -6.000000e+00 5.475820e-03 228.20 -2.00 3.06 -2.00 315.05 0.00e+00 1.289613e-03 4.448458e-06 1.247865e-04 -6.000000e+00 2.398881e-04 280.05 -2.00 20.00 -2.00 314.49 0.00e+00 1.116 0.000 302.00 328.00 3 1.8719e-01 1.3246e-04 1.1299e-02 -6.0000e+00 1.3633e-02 6.6228e-03 1.4742e-04 6.9031e-03 -6.0000e+00 1.4825e-02 -1.8580e-03 8.4073e-05 3.2920e-03 -6.0000e+00 8.8133e-03 -8.3627e-04 3.7083e-05 1.3585e-03 -6.0000e+00 3.7224e-03 1.5682e-01 -4.3146e-04 2.8507e-06 1.4366e-05 -6.0000e+00 2.5805e-04 1.3889e-02 11 8 0 10 0 0 7.52 19.41 0.31 0.01389 0.01065 3916 842 2 8 0 12.610 15.02 19.41 32.20 21.69 21.69 28.1 909.43 -1488 -1440 -2691 -3047 -388 531 1527 1547 645 -1091 92 1419 244 532 162 -1165 152 90 458 628 -84 1241 1371 584 594 -40 -843 -9 1255 2432 1946 2507 979 -1819 -10 573 -167 504 -229 -1524 -1556 -1005 -1259 -1168 -571 -1259 -935 -537 -470 901 838 713 992 535 590 1163 444 550 903 1167 1475 1004 779 79 -1083 154 62 1021 1658 -15 -220 -501 -297 -186 -317 443 461 1170 1183 -437 -750 -1471 -2030 -799 -1133 -973 -647 -574 -421 -364 415 278 1185 1993 1310 711 785 98 -777 -475 -250 20 997 643 -1055 -559 -625 -620 29 -111 -280 -331 -59 164 548 1167 722 607 188 -628 -724 -235 -182 125 899 452 1425 1622 542 397 93 51 138 405 -273 -437 -11 -214 -617 -201 -265 -372 -73 -503 -515 -965 -998 -109 140 420 475 218 -381 31 470 89 218 74 -571 75 45 234 329 -44 639 711 317 335 -21 -481 -5 602 1116 926 1255 526 -1000 -5 279 -90 287 -156 -1200 -1212 -804 -1030 -957 -463 -1019 -730 -433 -364 682 660 595 796 447 500 994 386 473 760 980 1280 938 782 83 -1122 142 52 887 1413 -15 -234 -514 -302 -197 -312 388 391 927 974 -376 -720 -1547 -2263 -853 -1302 -1198 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