File name: Pandora159s1_Wakkerstroom_20211227_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035216.0Z 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_20211227_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: 20211227 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 20211227T074720.1Z 8031.324538 274 1 49.85 2 30.28 89.87 59.19 289.17 0.00 1 0.00 1 0 17 8.871e-03 6.502e-03 3.089e-03 1.889e-03 1.417450e-01 9.543296e-04 1.527478e-03 -6.000000e+00 5.042687e-03 227.78 -2.00 3.06 -2.00 315.48 0.00e+00 5.435478e-04 8.977463e-05 3.937434e-05 -6.000000e+00 2.225061e-04 281.72 -2.00 20.00 -2.00 314.85 0.00e+00 1.157 0.000 302.00 328.00 3 5.4354e+00 2.4628e-03 1.1378e-02 -6.0000e+00 1.2536e-02 2.8632e-02 2.7434e-03 6.4337e-03 -6.0000e+00 1.3618e-02 8.3949e-04 1.5701e-03 3.1478e-03 -6.0000e+00 8.1067e-03 -3.4160e-03 7.0357e-04 9.7354e-04 -6.0000e+00 3.4441e-03 8.0367e-04 -1.6557e-04 5.3444e-05 1.1586e-05 -6.0000e+00 2.3716e-04 -7.2048e-03 11 8 0 10 0 0 99.98 19.20 0.23 -0.00720 -0.00845 28 6 1 8 0 1780.000 15.00 19.20 20.49 21.48 21.48 19.1 891.99 -522 -1717 -1789 -2718 -1029 -516 1038 1442 21 -844 -889 824 -289 119 561 -1366 -389 41 175 1367 144 1729 1411 1364 282 325 -1305 151 1273 2592 1786 2096 1322 -2632 -1053 792 -634 -39 142 -1168 -1026 -445 -1088 -1120 -270 -957 -620 -707 -426 478 654 546 932 702 304 1634 277 364 712 684 1168 1301 924 703 -635 -23 -94 38 1737 -53 -257 163 -135 -12 -351 -137 152 -135 814 -618 -1127 -1139 -1944 -822 -883 -1179 -272 -410 156 -111 380 -72 758 1078 1199 473 883 429 -492 -414 -213 -333 439 444 -1265 -635 -413 -632 -12 369 42 -46 69 134 226 579 284 440 123 -345 -374 141 -123 63 1148 182 926 1435 276 161 101 -141 -97 489 -33 -428 158 5 -128 -338 -89 -678 -197 -153 -544 -565 -802 -265 -125 257 397 6 -268 -273 249 -95 43 222 -585 -169 18 78 616 67 778 643 642 140 165 -665 71 550 1068 757 928 620 -1286 -475 341 -297 -21 89 -832 -785 -349 -875 -903 -215 -763 -480 -527 -306 335 473 416 735 573 254 1364 237 309 595 569 996 1169 885 702 -631 -21 -79 31 1438 -50 -258 169 -142 -12 -340 -121 121 -102 619 -520 -1049 -1139 -2051 -894 -1017 -1439 -347 -538 203 -141 453 -80 758 1029 1179 505 1015 535 -644 -535 -260 -382 481 504 -1565 -818 -551 -868 -17 541 63 -70 101 184 286 693 337 542 161 -481 -538 201 -173 85 1482 227 1094 1675 339 208 134 -190 -131 676 -47 -653 244 8 -204 -533 -137 -1022 -290 SS 20211227T081129.1Z 8031.341309 288 1 49.53 2 24.92 86.79 64.14 285.51 0.00 1 0.00 1 0 17 9.411e-03 6.957e-03 3.452e-03 2.164e-03 1.359005e-01 1.094529e-03 1.475208e-03 -6.000000e+00 5.349013e-03 227.78 -2.00 3.06 -2.00 315.37 0.00e+00 3.008808e-04 1.006064e-04 1.929378e-05 -6.000000e+00 2.360343e-04 281.72 -2.00 20.00 -2.00 314.74 0.00e+00 1.102 0.000 302.00 328.00 3 5.6194e+00 2.8224e-03 1.0869e-02 -6.0000e+00 1.3297e-02 3.5882e-02 3.1424e-03 6.1600e-03 -6.0000e+00 1.4445e-02 -8.1675e-05 1.7968e-03 3.0294e-03 -6.0000e+00 8.5994e-03 -3.0055e-03 8.0116e-04 8.7839e-04 -6.0000e+00 3.6531e-03 7.0762e-04 -2.1569e-04 6.1219e-05 1.1136e-05 -6.0000e+00 2.5159e-04 -6.7958e-03 11 8 0 10 0 0 99.98 19.20 0.45 -0.00680 -0.00842 35 8 1 8 0 1414.820 15.01 19.20 21.97 21.48 21.48 19.3 900.41 -1946 -1007 -1823 -3695 1435 -1306 1762 1397 1268 -1559 665 1151 -44 17 452 -436 -223 92 -333 599 -589 986 1049 1017 -2 509 -740 653 241 1776 1640 2522 2614 -1653 493 603 -325 -707 346 -1050 -1163 -697 -964 -1033 -559 -1224 -988 -384 -937 1432 1016 740 463 609 -311 1349 579 196 671 280 1679 996 1236 621 -800 -84 442 -264 1824 277 -97 -254 100 196 -728 360 -218 1088 247 -211 -1112 -694 -2241 -676 -925 -778 -522 -661 198 -344 571 -299 811 1013 1121 258 897 301 -478 -114 -301 -117 1 902 -1271 -512 -596 -590 -27 253 -173 -13 -84 -14 319 674 892 241 194 -624 -321 29 140 -337 1376 716 763 1534 557 463 -57 -47 -321 771 -395 -213 -99 199 -452 -332 -81 -641 -105 -606 -332 -604 -1152 377 -332 453 400 400 -519 210 359 -15 6 185 -191 -99 41 -153 280 -283 460 492 495 -1 265 -385 314 108 750 705 1130 1229 -812 222 264 -154 -386 219 -763 -904 -558 -789 -847 -455 -993 -777 -289 -684 1003 737 566 370 503 -263 1135 496 167 563 236 1437 905 1190 626 -802 -77 370 -213 1510 259 -98 -267 105 200 -709 316 -174 806 188 -177 -1029 -691 -2372 -734 -1065 -952 -667 -869 261 -440 680 -329 807 963 1097 274 1024 375 -624 -146 -368 -134 1 1016 -1569 -657 -794 -813 -38 371 -264 -19 -122 -19 400 798 1047 295 252 -869 -460 42 196 -456 1756 882 894 1769 674 587 -75 -63 -432 1054 -572 -321 -153 312 -720 -521 -124 -962 -154 SS 20211227T081622.5Z 8031.344705 290 1 9.06 2 23.84 86.08 65.15 284.82 0.00 1 0.00 1 0 17 9.592e-03 7.782e-03 2.444e-03 1.877e-03 1.340066e-01 9.614966e-04 1.473028e-03 -6.000000e+00 5.452032e-03 227.78 -2.00 3.06 -2.00 314.27 0.00e+00 2.560942e-04 7.231505e-05 2.086332e-05 -6.000000e+00 2.405744e-04 281.72 -2.00 20.00 -2.00 313.76 0.00e+00 1.093 0.000 302.00 328.00 3 4.4547e+00 2.4524e-03 1.0768e-02 -6.0000e+00 1.3554e-02 2.9187e-02 2.7176e-03 6.0945e-03 -6.0000e+00 1.4723e-02 -5.3204e-03 1.5579e-03 3.0025e-03 -6.0000e+00 8.7649e-03 -1.9945e-03 6.7586e-04 8.6450e-04 -6.0000e+00 3.7236e-03 2.3071e-03 -4.0034e-04 5.2019e-05 1.1834e-05 -6.0000e+00 2.5642e-04 -7.0163e-03 12 9 1 12 1 1 99.18 19.20 0.24 -0.00702 -0.01002 8 11 1 8 0 987.590 15.00 19.20 22.36 21.48 21.48 19.4 902.36 -1336 -1371 -1940 -3046 -955 651 1290 2112 435 -1067 -653 1416 447 166 763 -1286 -61 -21 603 1267 -203 1243 874 416 751 216 -419 -54 760 2225 1478 3565 1835 -1576 -446 1027 -411 227 2 -1516 -1745 -1029 -1105 -1061 -435 -1178 -1195 -720 -545 532 914 291 598 490 699 1243 320 355 826 884 1354 678 978 228 -641 500 -251 810 1775 374 -266 -377 -358 185 -63 232 618 1002 1193 -367 -1124 -1128 -2175 -858 -1168 -1094 -822 -807 -470 -530 -128 209 454 1400 1339 198 372 450 -665 -639 -35 -179 604 651 -822 -969 1225 -748 25 125 -225 -87 44 282 272 1198 754 547 185 -321 -686 -310 -367 -165 906 516 1090 1740 552 354 31 102 239 254 -282 -316 -272 -171 -468 -342 -118 -420 -198 -575 -620 -879 -1304 -365 234 475 843 191 -482 -288 609 204 82 406 -725 -35 -12 348 742 -122 731 516 254 472 139 -268 -33 430 1210 816 2009 1089 -963 -257 569 -244 148 1 -1242 -1507 -905 -987 -949 -386 -1043 -1037 -606 -446 427 745 248 523 439 635 1132 296 327 750 800 1247 653 982 237 -661 483 -228 709 1595 366 -276 -402 -383 194 -64 219 540 830 1002 -333 -1093 -1160 -2334 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