File name: Pandora159s1_Wakkerstroom_20240814_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240814T221009.3Z 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_20240814_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: 20240814 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 20240814T100642.5Z 8992.421325 54 1 27.36 2 41.49 359.03 91.06 120.76 0.00 1 0.00 1 0 17 9.433e-03 7.259e-03 2.185e-04 1.305e-04 1.711433e-01 6.561589e-05 1.858848e-03 -6.000000e+00 5.320461e-03 226.35 -2.00 3.06 -2.00 315.53 0.00e+00 5.630933e-05 6.153278e-06 2.273215e-05 -6.000000e+00 2.313541e-04 276.62 -2.00 20.00 -2.00 314.98 0.00e+00 1.334 0.000 302.00 328.00 3 -2.0075e-01 1.6894e-04 1.3294e-02 -6.0000e+00 1.3205e-02 1.4959e-02 1.8844e-04 7.6749e-03 -6.0000e+00 1.4384e-02 -2.2995e-03 1.0798e-04 3.8041e-03 -6.0000e+00 8.5466e-03 -1.4886e-03 4.8882e-05 1.0769e-03 -6.0000e+00 3.6154e-03 1.8498e-01 -4.0348e-04 3.6706e-06 1.3817e-05 -6.0000e+00 2.5220e-04 9.9618e-03 11 8 0 10 0 0 42.60 19.07 0.32 0.00996 0.00693 2625 565 4 8 0 10.310 15.02 19.07 27.04 21.38 21.38 26.7 884.22 -1666 -1658 -2839 -3267 -789 108 1142 1413 494 -1182 -84 1206 60 333 163 -1127 160 68 441 670 -93 1230 1419 623 617 -28 -857 -184 1129 2287 1869 2382 995 -1896 -293 377 -408 517 -119 -1333 -1430 -884 -1117 -1050 -445 -1113 -848 -434 -388 927 863 683 990 581 591 1209 503 605 928 1229 1545 1139 932 235 -962 170 25 822 1575 5 -201 -464 -303 -161 -307 365 314 905 1102 -476 -732 -1400 -2021 -849 -1102 -963 -611 -575 -410 -367 368 260 1085 1866 1225 629 743 147 -759 -467 -289 -72 878 638 -1047 -595 -613 -623 34 -83 -242 -289 -39 189 562 1175 753 664 255 -522 -622 -164 -171 77 812 411 1312 1600 557 405 87 -41 55 344 -303 -417 -10 -191 -594 -201 -214 -350 -75 -454 -480 -827 -875 -182 26 287 362 140 -350 -24 342 19 117 64 -475 68 29 196 305 -43 554 646 299 311 -15 -440 -87 488 944 801 1079 485 -953 -134 168 -200 295 -75 -971 -1123 -660 -852 -801 -335 -906 -667 -327 -281 659 641 540 817 462 479 990 421 501 750 988 1280 1015 894 238 -961 152 20 698 1309 5 -208 -501 -326 -167 -297 314 261 706 892 -437 -692 -1455 -2235 -901 -1255 -1175 -785 -760 -540 -464 426 292 1095 1797 1247 705 852 186 -1017 -610 -351 -80 1002 764 -1289 -770 -828 -817 46 -119 -362 -432 -55 263 710 1384 889 821 341 -705 -864 -224 -245 105 1041 502 1616 1962 679 525 117 -57 76 493 -433 -627 -15 -300 -946 -312 -322 -508 -107 SS 20240814T100709.8Z 8992.421642 54 2 27.29 2 41.49 358.86 90.97 120.71 0.00 1 0.00 1 0 17 9.420e-03 7.248e-03 2.203e-04 1.317e-04 1.712603e-01 6.626611e-05 1.860032e-03 -6.000000e+00 5.312849e-03 226.35 -2.00 3.06 -2.00 315.52 0.00e+00 3.549027e-05 6.205571e-06 2.331820e-05 -6.000000e+00 2.310233e-04 276.62 -2.00 20.00 -2.00 314.97 0.00e+00 1.334 0.000 302.00 328.00 3 -1.8637e-01 1.7057e-04 1.3298e-02 -6.0000e+00 1.3186e-02 1.4780e-02 1.9023e-04 7.6824e-03 -6.0000e+00 1.4363e-02 -2.3123e-03 1.0908e-04 3.8049e-03 -6.0000e+00 8.5344e-03 -1.3687e-03 4.9373e-05 1.0744e-03 -6.0000e+00 3.6102e-03 1.8231e-01 -4.0012e-04 3.7035e-06 1.3968e-05 -6.0000e+00 2.5184e-04 9.9846e-03 11 8 0 10 0 0 43.81 19.07 0.31 0.00998 0.00698 2625 565 4 8 0 10.310 15.02 19.07 27.04 21.38 21.38 26.7 884.22 -1634 -1723 -2817 -3232 -763 114 1153 1423 499 -1203 -66 1206 28 358 156 -1141 185 98 472 670 -76 1240 1456 592 631 -4 -853 -117 1153 2268 1847 2393 973 -1897 -311 380 -339 515 -104 -1326 -1424 -886 -1101 -1050 -438 -1149 -832 -418 -406 903 873 668 989 571 582 1197 491 606 934 1226 1544 1135 929 231 -965 156 35 852 1572 -5 -211 -464 -309 -140 -306 363 314 882 1072 -440 -726 -1385 -2036 -818 -1099 -945 -627 -563 -386 -359 399 264 1061 1872 1235 638 771 157 -755 -453 -298 -100 897 651 -1035 -594 -615 -620 33 -69 -229 -293 -29 176 575 1171 751 673 253 -512 -628 -150 -163 67 824 410 1320 1607 568 397 60 -27 61 357 -288 -406 -5 -191 -602 -199 -217 -356 -81 -443 -497 -816 -860 -193 27 288 362 141 -355 -19 340 9 125 61 -479 78 42 208 303 -35 556 660 283 317 -2 -436 -55 495 931 788 1078 472 -948 -142 169 -165 293 -65 -961 -1113 -713 -836 -797 -356 -931 -651 -313 -293 639 645 525 813 452 470 976 408 499 752 1063 1272 1006 887 232 -959 139 31 720 1300 -5 -218 -499 -331 -144 -294 310 260 684 863 -402 -684 -1433 -2242 -930 -1247 -1148 -802 -741 -506 -452 458 296 1065 1795 1251 712 880 198 -1007 -589 -360 -120 1020 777 -1268 -765 -827 -866 44 -99 -342 -436 -41 244 724 1373 883 829 337 -737 -870 -205 -231 91 1051 499 1617 1961 689 513 80 -37 84 510 -409 -608 -8 -299 -954 -307 -324 -515 -115 SS 20240814T101246.1Z 8992.425533 57 1 27.37 2 41.54 356.82 89.94 120.10 0.00 1 0.00 1 0 17 9.428e-03 7.243e-03 2.194e-04 1.309e-04 1.718620e-01 6.575303e-05 1.866405e-03 -6.000000e+00 5.317135e-03 226.35 -2.00 3.06 -2.00 315.54 0.00e+00 3.971191e-05 6.194394e-06 2.301658e-05 -6.000000e+00 2.312095e-04 276.62 -2.00 20.00 -2.00 314.99 0.00e+00 1.335 0.000 302.00 328.00 3 -1.9680e-01 1.6929e-04 1.3321e-02 -6.0000e+00 1.3196e-02 1.4297e-02 1.8874e-04 7.7068e-03 -6.0000e+00 1.4375e-02 -2.1438e-03 1.0828e-04 3.8184e-03 -6.0000e+00 8.5413e-03 -1.4652e-03 4.9093e-05 1.0798e-03 -6.0000e+00 3.6131e-03 1.8385e-01 -4.0816e-04 3.6812e-06 1.3923e-05 -6.0000e+00 2.5205e-04 9.9793e-03 11 8 0 10 0 0 67.06 19.08 0.31 0.00998 0.00691 2623 564 4 8 0 10.320 15.02 19.08 26.90 21.48 21.38 26.8 883.66 -1699 -1638 -2788 -3261 -872 233 1076 1435 517 -1163 -120 1145 -2 289 131 -1187 153 94 474 638 -11 1252 1500 588 680 34 -879 -138 1104 2314 1817 2427 933 -1886 -342 401 -321 507 -123 -1308 -1430 -893 -1140 -1076 -421 -1165 -823 -436 -354 929 877 699 968 570 571 1190 486 623 941 1246 1538 1152 922 251 -989 163 31 806 1567 -7 -179 -461 -285 -166 -288 353 304 907 1066 -446 -717 -1374 -2037 -833 -1093 -943 -644 -570 -394 -368 374 291 1066 1857 1233 623 754 125 -746 -491 -268 -83 908 618 -1042 -592 -601 -610 35 -68 -251 -267 -28 195 537 1170 740 666 255 -534 -620 -173 -165 58 829 387 1337 1598 585 399 92 -36 59 348 -301 -426 -21 -183 -609 -180 -243 -329 -71 -459 -470 -805 -865 -220 55 268 364 146 -342 -34 322 -1 101 51 -497 65 40 209 288 -5 561 679 281 341 17 -449 -65 474 949 775 1093 453 -943 -156 178 -157 288 -77 -948 -1118 -664 -866 -818 -342 -945 -645 -327 -256 658 649 550 796 452 462 972 405 514 759 998 1270 1023 882 253 -986 146 28 683 1299 -6 -186 -497 -305 -171 -277 302 252 706 861 -409 -677 -1426 -2249 -882 -1243 -1149 -826 -752 -518 -465 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