File name: Pandora159s1_Wakkerstroom_20231205_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240122T132021.3Z 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_20231205_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: 20231205 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 20231205T044912.4Z 8739.200839 204 1 49.50 2 67.35 104.34 39.50 342.41 0.00 1 0.00 1 0 17 7.480e-02 1.374e-02 5.701e-02 7.840e-03 3.412410e-01 3.948148e-03 3.573537e-03 -6.000000e+00 4.249594e-02 228.01 -2.00 3.06 -2.00 319.12 0.00e+00 2.889268e-03 9.147998e-04 4.517684e-04 -6.000000e+00 1.867332e-03 280.76 -2.00 20.00 -2.00 318.41 0.00e+00 2.577 0.000 302.00 328.00 3 5.4977e+00 1.0944e-02 2.6320e-02 -6.0000e+00 1.0573e-01 5.5849e-02 1.2606e-02 1.6641e-02 -6.0000e+00 1.1491e-01 -3.0029e-02 8.7782e-03 7.7062e-03 -6.0000e+00 6.8355e-02 1.0489e-03 4.5691e-03 3.5352e-03 -6.0000e+00 2.8955e-02 1.6758e-04 -6.2082e-04 2.3136e-04 3.1791e-05 -6.0000e+00 2.0003e-03 2.5081e-03 12 8 8 10 0 0 99.98 20.13 0.78 0.00251 -0.00216 55 12 4 8 0 899.870 15.00 20.13 24.30 22.29 22.09 26.6 881.86 -28871 25675 -32225 10764 -19660 -12061 -23583 33429 6813 -94 -19518 -10009 923 -17859 12740 2507 20440 -5218 12488 -10124 -1490 -9572 8567 -5547 2571 8655 -5215 3117 -12499 7867 -9019 6842 -1208 3702 429 6502 1350 2554 -680 2632 -2350 -1433 -734 -2890 4955 -1580 -677 -1411 3894 4363 161 716 1304 1017 -1364 3863 -289 531 -1548 5871 -95 3979 -149 -94 -486 1059 565 2364 1470 -317 620 -2759 2061 -829 -441 -516 1935 -957 631 -267 -733 -1420 -3527 29 -1587 -111 -1440 -976 -344 505 -924 737 227 1493 1559 -113 1358 -819 -149 -680 1279 -404 444 -821 -1570 -2131 7880 -1305 -431 264 -643 360 -156 1016 -222 1219 -169 736 -270 -970 -1323 -198 -460 -675 919 -615 1911 803 858 583 615 -591 -28 138 -69 271 87 371 -1002 25 -152 330 -501 -1581 931 -2071 437 -961 -528 -1212 1122 324 -5 -1238 -613 59 -1613 1003 243 1778 -608 1291 -1353 -187 -1286 987 -768 348 1141 -785 412 -1841 964 -1418 1029 -215 644 73 1023 243 532 -174 756 -776 -493 -259 -1059 1693 -577 -244 -507 1323 1505 62 295 568 469 -665 1827 -145 262 -765 2690 -47 2077 -89 -60 -314 631 318 1286 871 -216 456 -2184 1550 -614 -302 -320 1068 -524 363 -176 -549 -1182 -3209 27 -1579 -117 -1616 -1122 -392 552 -951 685 196 1258 1408 -115 1526 -1038 -201 -906 1574 -461 475 -916 -1905 -2748 9664 -1825 -633 414 -1078 609 -258 1563 -320 1645 -231 1042 -412 -1573 -2186 -319 -721 -1022 1309 -852 2463 1057 1217 897 1003 -1003 -48 248 -131 543 177 772 -2121 51 -299 623 -929 SS 20231205T053313.0Z 8739.231401 225 1 49.86 2 57.81 100.36 43.45 327.40 0.00 1 0.00 1 0 17 1.898e-02 7.082e-03 1.365e-02 3.985e-03 2.461697e-01 1.986975e-03 2.611935e-03 -6.000000e+00 1.078535e-02 228.01 -2.00 3.06 -2.00 317.75 0.00e+00 9.405890e-04 3.137459e-04 8.383355e-05 -6.000000e+00 4.739053e-04 280.76 -2.00 20.00 -2.00 317.02 0.00e+00 1.871 0.000 302.00 328.00 3 5.5951e+00 5.2941e-03 1.8890e-02 -6.0000e+00 2.6835e-02 3.1424e-02 5.9801e-03 1.1225e-02 -6.0000e+00 2.9163e-02 -6.3661e-03 3.6415e-03 5.4928e-03 -6.0000e+00 1.7347e-02 -2.5950e-03 1.8108e-03 1.7245e-03 -6.0000e+00 7.3497e-03 3.1364e-04 -3.6402e-04 1.1569e-04 1.8512e-05 -6.0000e+00 5.0760e-04 1.5017e-03 11 9 0 11 8 0 99.90 20.14 0.44 0.00150 -0.00123 25 5 1 8 0 1993.940 15.00 20.14 24.89 22.29 22.09 26.8 885.69 -5402 -8280 -5504 -3814 -8282 -4844 7422 3541 49 -3079 -2463 -90 -1259 -1320 987 422 2562 -2775 693 2878 -1172 4129 -266 -2119 325 -438 1001 -676 1972 4324 811 4081 264 -1075 333 1825 -1589 -479 734 -1046 -371 -1358 -2445 -1757 -495 -1025 -216 -697 -506 1201 1543 225 797 680 1409 419 1043 901 859 703 2655 1485 1104 -38 -726 708 -107 542 2078 68 -274 460 131 431 -52 201 304 -672 207 43 -1771 -875 -2186 -1470 -325 -738 -103 -1100 1 -468 -76 281 268 989 700 403 766 673 -928 -235 -473 541 451 236 -1541 -344 643 -973 92 48 -83 70 170 90 342 158 845 362 321 -619 -669 -320 -46 -158 839 470 1306 1632 483 613 148 361 -259 206 -180 -415 191 -257 -290 -412 97 -482 13 -581 -995 -651 -414 -840 -454 654 364 6 -386 -303 -11 -176 -212 176 82 510 -601 151 634 -273 906 -62 -529 84 -117 261 -168 451 953 195 1030 74 -312 90 472 -463 -161 290 -485 -185 -713 -1331 -957 -267 -554 -114 -359 -255 597 805 128 472 422 892 273 686 589 552 451 1722 1044 842 -31 -591 526 -74 364 1473 55 -243 418 120 379 -43 150 205 -437 140 32 -1517 -814 -2181 -1517 -353 -859 -125 -1392 1 -568 -86 290 254 907 677 428 893 859 -1270 -314 -599 626 500 271 -1937 -449 869 -1384 136 75 -136 115 271 134 470 206 1095 490 464 -954 -1057 -497 -70 -232 1165 625 1646 2053 653 881 223 553 -406 332 -305 -741 346 -479 -543 -758 172 -832 22 SS 20231205T060524.8Z 8739.253759 239 1 50.71 2 50.75 97.46 47.61 318.14 0.00 1 0.00 1 0 25 9.575e-03 6.789e-03 1.385e-03 6.091e-04 2.020323e-01 3.032458e-04 2.171166e-03 -6.000000e+00 5.440522e-03 228.01 -2.00 3.06 -2.00 316.68 0.00e+00 1.043833e-03 3.727072e-05 8.950371e-05 -6.000000e+00 2.390542e-04 280.76 -2.00 20.00 -2.00 315.98 0.00e+00 1.577 0.000 302.00 328.00 3 2.9323e+00 7.9358e-04 1.5787e-02 -6.0000e+00 1.3537e-02 -3.3529e-03 8.8974e-04 9.2921e-03 -6.0000e+00 1.4711e-02 -2.2264e-03 5.1841e-04 4.5109e-03 -6.0000e+00 8.7506e-03 -1.3311e-03 2.4503e-04 1.4975e-03 -6.0000e+00 3.7076e-03 6.2485e-03 -3.0266e-04 1.7373e-05 1.6139e-05 -6.0000e+00 2.5605e-04 1.3314e-03 11 8 0 10 0 0 99.93 20.14 0.26 0.00133 -0.00094 327 70 1 8 0 150.910 15.00 20.14 25.49 22.29 22.09 26.7 887.98 -1758 -1929 -2868 -3510 -1137 446 967 1292 472 -1083 -350 1063 -111 404 11 -1387 -207 -316 275 440 -117 931 1753 667 902 225 -645 -272 1084 2210 1911 2391 1083 -1738 -454 664 -440 568 -30 -1432 -1603 -1075 -1236 -1285 -451 -1058 -768 -441 -399 779 976 686 992 613 582 1143 479 503 817 1072 1540 1250 950 471 -981 114 103 734 1727 201 -221 -383 -337 -136 -388 362 524 919 1194 -313 -626 -1286 -2057 -907 -1012 -898 -589 -493 -358 -304 351 293 870 1771 1261 554 764 257 -765 -554 -304 -227 852 712 -1029 -649 -491 -611 -13 45 -230 -262 -78 199 390 1157 634 664 182 -512 -700 -109 -153 52 877 403 1180 1575 481 359 149 -19 133 402 -217 -405 12 -98 -542 -194 -170 -334 -10 -319 -378 -570 -648 -182 67 151 225 92 -220 -69 210 -25 101 3 -390 -59 -93 83 137 -37 289 600 219 311 80 -228 -99 361 709 642 858 422 -704 -169 238 -174 236 -15 -837 -1017 -705 -832 -871 -302 -710 -501 -277 -243 468 611 459 697 452 439 871 373 388 617 805 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