File name: Pandora159s1_Wakkerstroom_20231220_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240122T143421.8Z 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_20231220_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: 20231220 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 20231220T045406.7Z 8754.204244 94 1 36.73 2 67.39 105.63 151.88 162.53 0.00 1 0.00 1 0 25 2.044e-02 9.615e-03 1.615e-02 2.752e-03 3.096879e-01 1.372403e-03 3.243794e-03 -6.000000e+00 1.160154e-02 227.85 -2.00 3.06 -2.00 318.60 0.00e+00 1.657119e-03 2.803630e-04 1.504109e-04 -6.000000e+00 5.115606e-04 281.42 -2.00 20.00 -2.00 317.88 0.00e+00 2.580 0.000 302.00 328.00 3 4.2222e+00 3.7343e-03 2.5254e-02 -6.0000e+00 2.8848e-02 1.3953e-02 4.2669e-03 1.4306e-02 -6.0000e+00 3.1357e-02 1.3659e-02 2.8504e-03 6.9563e-03 -6.0000e+00 1.8662e-02 -6.7683e-03 1.4824e-03 2.4893e-03 -6.0000e+00 7.9087e-03 6.3628e-04 -1.0206e-04 7.9857e-05 2.4568e-05 -6.0000e+00 5.4668e-04 5.8519e-03 12 9 9 12 1 1 99.99 19.85 0.43 0.00585 0.00508 56 17 2 8 0 644.230 15.00 19.85 23.12 22.09 21.88 26.8 875.42 -1609 2204 -9563 -8081 -3475 1609 -3297 669 -2898 -7321 4654 -2922 5311 -3263 4967 -3572 492 -2747 -71 -3298 1840 759 -810 1909 -2029 2674 -4506 69 -80 4473 397 3143 129 -2101 -357 -1832 294 -758 639 -1926 -246 -1693 -1308 -2388 -54 -1233 -326 -20 -75 1881 1445 141 760 1113 -532 1485 100 1114 -131 1656 1549 1448 1411 429 -1046 200 530 763 1847 175 353 -588 -225 -58 521 841 712 1270 979 215 -538 -967 -2275 -632 -1087 -671 -372 -453 -500 12 802 385 1185 2365 1640 568 675 314 -842 -716 -217 -167 797 1149 -875 -337 -5331 -8 242 373 -82 -134 -188 110 206 1045 478 582 323 -734 -773 -100 190 516 977 571 1398 1730 1222 626 -91 -62 -105 420 -345 -446 -94 133 -612 -191 -229 -55 -181 -86 124 -615 -482 -179 77 -176 39 -192 -526 298 -212 410 -319 519 -448 63 -379 -10 -499 271 112 -125 303 -355 462 -829 11 -13 687 68 583 27 -456 -72 -370 64 -195 193 -688 -94 -687 -545 -1018 -23 -526 -136 -8 -31 768 627 67 379 583 -292 818 57 622 -72 903 877 884 931 306 -755 133 329 470 1211 131 285 -496 -189 -47 389 569 441 759 621 156 -437 -868 -2178 -624 -1148 -750 -435 -541 -600 14 860 383 1082 2111 1570 604 792 405 -1150 -966 -275 -195 885 1310 -1091 -438 -7530 -11 357 581 -135 -225 -306 168 292 1406 647 818 483 -1169 -1243 -158 292 768 1385 784 1820 2270 1716 945 -145 -101 -174 720 -625 -839 -182 259 -1204 -367 -426 -99 -319 SS 20231220T045934.8Z 8754.208042 97 1 26.03 2 66.22 105.14 151.54 159.88 0.00 1 0.00 1 0 17 2.615e-02 8.468e-03 2.717e-02 5.240e-03 3.043625e-01 2.617331e-03 3.180258e-03 -6.000000e+00 1.484766e-02 227.85 -2.00 3.06 -2.00 318.31 0.00e+00 1.420839e-03 4.924009e-04 1.804622e-04 -6.000000e+00 6.546456e-04 281.42 -2.00 20.00 -2.00 317.59 0.00e+00 2.462 0.000 302.00 328.00 3 5.2585e+00 7.0674e-03 2.4306e-02 -6.0000e+00 3.6920e-02 5.5758e-02 8.0399e-03 1.3979e-02 -6.0000e+00 4.0128e-02 6.4430e-03 5.2224e-03 6.7821e-03 -6.0000e+00 2.3882e-02 -1.1565e-02 2.6959e-03 2.3223e-03 -6.0000e+00 1.0124e-02 2.4572e-04 -1.5356e-04 1.5162e-04 2.3123e-05 -6.0000e+00 6.9945e-04 3.9766e-03 12 9 1 12 1 1 99.98 19.85 0.84 0.00398 0.00282 7 3 1 8 0 3253.120 15.00 19.85 23.18 21.98 21.88 26.9 876.15 3507 3629 -7286 -15225 -640 -3501 1390 3227 -735 11513 8125 2209 -9043 -621 1098 476 -4876 1699 -1227 85 81 1276 2424 3699 2627 -5021 -257 -2457 3614 -157 6958 -1320 -1111 -3476 2164 -3491 -580 -803 2317 -317 -2058 -1557 -2158 -777 -2470 -697 -2631 -774 -801 -39 3228 597 -38 880 1647 1435 498 815 1262 963 2115 -171 2999 754 -221 1609 -195 1125 1929 880 -502 -263 276 -372 -165 1433 185 601 -1103 1679 -956 -797 -2926 -1821 -784 -1257 -211 -584 -53 -907 200 904 1295 818 2066 244 617 -86 -346 421 -346 -135 593 1187 -1472 -1144 -762 -450 730 25 -568 -378 169 -705 642 632 460 581 114 -953 -784 483 -473 224 842 544 1258 1918 218 298 -9 68 -177 419 -217 145 137 -198 -154 -450 370 -757 -249 206 234 -533 -1133 -37 -203 82 211 -55 802 583 175 -917 -68 136 66 -746 256 -198 14 14 213 409 652 496 -1055 -51 -473 625 -28 1258 -285 -260 -850 472 -792 -140 -227 762 -123 -878 -693 -995 -357 -1156 -322 -1223 -349 -357 -17 1490 304 -21 495 947 846 301 488 739 562 1263 -112 2071 566 -167 1117 -129 724 1323 684 -427 -231 241 -314 -129 1010 120 377 -744 1235 -804 -733 -2892 -1866 -842 -1441 -251 -714 -64 -1075 219 908 1207 754 2000 262 729 -111 -474 563 -441 -159 662 1358 -1852 -1501 -1036 -634 1069 39 -932 -628 272 -1077 904 848 618 812 169 -1494 -1248 752 -724 330 1185 738 1628 2488 304 444 -15 108 -288 702 -383 266 255 -377 -294 -847 670 -1335 -430 SS 20231220T051134.9Z 8754.216377 102 1 53.08 2 63.64 104.07 150.59 154.29 0.00 1 0.00 1 0 25 1.060e-02 6.583e-03 2.423e-03 5.648e-04 2.758212e-01 2.797481e-04 2.926080e-03 -6.000000e+00 6.017294e-03 227.85 -2.00 3.06 -2.00 318.21 0.00e+00 1.733700e-03 5.056449e-05 2.198192e-04 -6.000000e+00 2.653281e-04 281.42 -2.00 20.00 -2.00 317.47 0.00e+00 2.240 0.000 302.00 328.00 3 1.7116e+00 7.5155e-04 2.2148e-02 -6.0000e+00 1.4962e-02 1.3530e-02 8.5399e-04 1.2925e-02 -6.0000e+00 1.6264e-02 3.8099e-03 5.3932e-04 6.1784e-03 -6.0000e+00 9.6795e-03 -5.7964e-03 2.7519e-04 2.3034e-03 -6.0000e+00 4.1020e-03 1.0864e-02 -3.7906e-04 1.6424e-05 2.2420e-05 -6.0000e+00 2.8354e-04 5.8330e-03 11 8 0 10 0 0 99.98 19.85 0.23 0.00583 0.00298 1436 309 2 8 0 34.370 15.00 19.85 23.68 21.98 21.88 27.1 879.44 -2259 -2058 -3119 -4180 -1329 -1123 1139 -217 436 -2985 735 -35 793 -706 239 -1555 -446 -244 -427 749 -823 1219 643 638 -340 -303 -1427 -114 655 2502 1960 2371 1277 -2347 -143 -169 -610 5 -145 -1784 -1437 -1132 -1187 -1250 -549 -955 -817 -328 -555 1109 1034 886 986 688 495 1144 486 490 808 1146 1682 1103 1221 414 -686 205 411 916 1859 200 8 -328 -406 88 -271 663 463 1231 1191 -142 -749 -1169 -2125 -812 -1092 -908 -582 -515 -229 -277 634 474 1361 1942 1410 725 830 251 -722 -485 -319 -147 787 786 -1084 -558 -675 -595 -8 -32 -246 -320 -89 132 456 1079 726 477 153 -742 -780 -305 -206 -80 785 392 1202 1691 489 449 108 21 63 388 -298 -341 3 -46 -530 -146 -132 -269 124 -179 -179 -278 -351 -97 -78 83 -18 40 -291 68 -3 87 -92 36 -238 -77 -40 -74 133 -164 236 128 133 -76 -70 -328 -24 131 490 413 546 323 -627 -35 -41 -161 2 -50 -716 -625 -514 -555 -591 -258 -451 -379 -148 -247 492 486 448 528 388 288 675 293 293 473 665 1007 718 866 315 -524 143 266 577 1250 155 7 -290 -357 74 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