File name: Pandora159s1_Wakkerstroom_20211120_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033931.3Z 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 v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20211120_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: 20211120 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 20211120T064738.6Z 7994.283086 274 1 17.78 2 41.15 89.22 131.25 276.75 0.00 1 0.00 1 0 17 9.808e-03 7.339e-03 3.011e-03 1.845e-03 1.741060e-01 9.350817e-04 1.875799e-03 -6.000000e+00 5.578238e-03 228.19 -2.00 3.06 -2.00 315.42 0.00e+00 2.771843e-04 8.667730e-05 3.940842e-05 -6.000000e+00 2.442447e-04 280.09 -2.00 20.00 -2.00 314.82 0.00e+00 1.327 0.000 302.00 328.00 3 4.6460e+00 2.4123e-03 1.3368e-02 -6.0000e+00 1.3888e-02 4.2963e-02 2.6875e-03 7.8594e-03 -6.0000e+00 1.5091e-02 -4.4677e-03 1.5378e-03 3.8662e-03 -6.0000e+00 8.9718e-03 -7.8101e-04 6.8915e-04 1.1079e-03 -6.0000e+00 3.7992e-03 1.4340e-03 -2.0292e-04 5.1760e-05 1.3930e-05 -6.0000e+00 2.6224e-04 -1.5257e-03 12 9 1 12 1 1 99.94 18.76 0.30 -0.00153 -0.00305 14 9 4 8 0 1173.460 15.01 18.76 18.08 21.17 21.17 18.3 882.85 -2094 -1755 -2109 -3241 -86 781 1772 1508 1041 -1754 641 1146 223 40 -3 -1470 184 113 387 1703 -349 1073 527 264 645 -148 -299 -157 1301 2332 2354 2577 1555 -1568 -601 1565 -257 378 291 -1170 -1634 -644 -1390 -1722 -720 -1118 -957 -503 -957 1001 527 677 709 125 582 1325 328 375 1161 1125 1384 999 939 223 -770 184 -87 574 1517 287 -90 -164 -436 -56 -222 589 175 992 993 -106 -774 -1305 -2035 -996 -723 -1086 -588 -372 -354 -297 225 102 796 1643 1534 816 632 148 -938 -304 -189 -129 885 441 -1041 -762 -487 -653 -133 41 -146 -382 -303 315 416 1049 780 517 297 -548 -697 -185 -160 85 960 626 968 1859 643 394 30 -52 96 206 -111 -373 -98 -173 -517 -283 -95 -325 -152 -603 -535 -645 -931 -21 185 434 411 311 -554 193 344 73 15 -1 -629 79 50 173 772 -163 491 245 127 323 -76 -152 -75 579 998 1034 1189 760 -793 -285 711 -126 210 186 -845 -1256 -506 -1119 -1389 -575 -890 -747 -379 -705 722 392 528 573 105 494 1129 285 324 983 952 1195 907 901 223 -765 170 -75 480 1316 275 -92 -172 -458 -57 -218 531 146 782 805 -93 -744 -1342 -2190 -1099 -833 -1318 -737 -477 -454 -371 266 112 814 1624 1568 891 739 186 -1224 -391 -233 -150 990 508 -1282 -975 -639 -882 -184 58 -214 -564 -436 428 530 1274 943 645 389 -760 -988 -259 -220 114 1233 780 1158 2206 798 510 41 -70 130 285 -160 -559 -150 -266 -802 -433 -142 -478 -220 SS 20211120T071215.8Z 7994.300182 284 1 2.12 2 35.69 86.11 136.48 274.57 0.00 1 0.00 1 0 17 1.034e-02 8.137e-03 3.812e-03 2.863e-03 1.628181e-01 1.467929e-03 1.781638e-03 -6.000000e+00 5.880811e-03 228.19 -2.00 3.06 -2.00 314.43 0.00e+00 1.692030e-04 1.125724e-04 1.549499e-05 -6.000000e+00 2.575251e-04 280.09 -2.00 20.00 -2.00 313.92 0.00e+00 1.230 0.000 302.00 328.00 3 3.5408e+00 3.7510e-03 1.2457e-02 -6.0000e+00 1.4642e-02 4.1125e-02 4.1601e-03 7.3802e-03 -6.0000e+00 1.5911e-02 -6.4478e-03 2.3822e-03 3.6406e-03 -6.0000e+00 9.4597e-03 -9.0473e-04 1.0351e-03 1.0252e-03 -6.0000e+00 4.0039e-03 4.8035e-03 -7.7384e-04 7.9254e-05 1.4057e-05 -6.0000e+00 2.7661e-04 1.4770e-03 12 9 1 12 1 1 25.41 18.77 0.24 0.00148 -0.00434 3 22 1 8 0 484.500 15.01 18.77 19.94 21.17 21.17 18.3 891.95 -1396 -1967 -993 -4373 532 -26 1550 1853 1558 -1607 60 1631 11 1949 -604 -790 -481 556 -97 1156 -407 1467 858 178 -63 338 -261 -352 1654 2690 2096 1617 1410 -2032 -163 1406 681 87 -128 -2117 -1829 -1364 -1356 -857 174 -914 -719 -763 -1655 402 493 952 911 528 792 486 409 637 984 867 1571 729 509 389 -890 434 177 902 1879 28 -178 -418 -460 -380 -597 356 526 1657 1545 52 -486 -1286 -1988 -611 -1559 -1212 -559 -643 -298 -388 214 199 710 1550 987 597 981 204 -1116 -157 -576 -324 1154 745 -1340 -804 -592 -667 -253 71 -127 -97 122 55 452 815 870 545 -15 -169 -791 -280 349 369 842 450 953 1475 525 263 415 43 56 207 -284 -619 272 160 -658 -335 -331 -541 -166 -563 -835 -419 -1778 191 -9 549 711 645 -693 25 673 5 924 -313 -428 -264 305 -55 656 -237 835 493 105 -39 210 -161 -208 917 1442 1150 923 837 -1241 -94 784 403 57 -93 -1707 -1545 -1176 -1183 -746 151 -791 -610 -632 -1349 321 402 805 789 471 715 443 375 583 888 782 1434 695 506 398 -909 417 161 796 1709 28 -185 -445 -490 -397 -601 335 463 1391 1325 48 -477 -1337 -2142 -669 -1784 -1442 -685 -802 -372 -475 249 219 736 1558 1019 651 1127 247 -1406 -195 -691 -371 1278 847 -1614 -996 -750 -864 -334 96 -176 -135 166 72 555 964 1024 658 -19 -222 -1062 -374 458 474 1046 545 1115 1712 632 328 529 55 72 273 -386 -871 385 231 -953 -480 -468 -751 -227 SS 20211120T073726.4Z 7994.317666 299 1 34.72 2 30.13 82.36 141.83 272.20 0.00 1 0.00 1 0 17 9.919e-03 7.440e-03 1.217e-03 7.497e-04 1.487588e-01 3.764761e-04 1.618195e-03 -6.000000e+00 5.641222e-03 228.19 -2.00 3.06 -2.00 315.47 0.00e+00 1.931207e-04 3.528424e-05 3.273606e-05 -6.000000e+00 2.470012e-04 280.09 -2.00 20.00 -2.00 314.86 0.00e+00 1.156 0.000 302.00 328.00 3 3.2849e+00 9.7213e-04 1.1583e-02 -6.0000e+00 1.4045e-02 2.7784e-02 1.0840e-03 6.7571e-03 -6.0000e+00 1.5261e-02 6.6811e-04 6.1939e-04 3.3226e-03 -6.0000e+00 9.0731e-03 -2.2783e-03 2.7704e-04 9.4239e-04 -6.0000e+00 3.8422e-03 6.8053e-03 -1.8076e-04 2.1191e-05 1.2120e-05 -6.0000e+00 2.6519e-04 -1.7175e-03 12 9 1 12 1 1 100.00 18.79 0.30 -0.00172 -0.00308 378 121 1 8 0 87.020 15.00 18.79 20.73 21.17 21.17 18.1 894.17 -1616 -1128 -2798 -3282 -938 582 1353 1819 1314 -1012 541 1305 685 -10 721 -1631 116 -262 448 544 7 1074 1270 765 459 280 -1019 347 991 2615 1815 2752 1185 -1618 -36 761 359 482 -5 -1683 -1540 -1237 -1118 -1347 -572 -1301 -903 -583 -659 645 886 814 781 664 342 1264 341 465 773 1103 1468 1026 899 328 -928 75 369 746 2028 175 -81 -457 -322 -84 -344 541 569 1248 1340 -93 -723 -1124 -2107 -778 -1116 -987 -653 -660 -337 -426 432 170 1111 1749 1525 658 911 159 -767 -639 -161 -106 924 903 -1047 -565 -549 -567 -99 75 -255 -272 -109 89 434 991 826 559 307 -568 -633 -153 -50 -33 942 491 1243 1647 536 408 -4 20 93 550 -259 -253 -146 -86 -526 -150 -176 -435 -102 -490 -362 -910 -984 -242 139 336 504 403 -327 166 397 227 -4 295 -660 51 -119 206 234 3 503 598 377 237 135 -538 168 438 1090 781 1237 572 -808 -17 334 171 268 -3 -1189 -1171 -971 -893 -1080 -452 -1025 -686 -423 -458 437 620 604 606 536 282 1048 289 391 635 899 1229 921 867 332 -933 67 300 579 1644 163 -82 -486 -342 -86 -330 462 433 968 1067 -76 -660 -1124 -2249 -855 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