File name: Pandora159s1_Wakkerstroom_20240802_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240802T221302.2Z 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_20240802_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: 20240802 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 20240802T060947.0Z 8980.256794 95 1 49.60 2 72.71 58.81 64.10 32.21 0.00 1 0.00 1 0 25 7.101e-02 7.930e-03 6.633e-02 4.202e-03 4.182895e-01 2.117198e-03 4.312991e-03 -6.000000e+00 3.999042e-02 226.01 -2.00 3.06 -2.00 319.85 0.00e+00 2.464842e-03 6.262697e-04 6.463157e-04 -6.000000e+00 1.741818e-03 276.68 -2.00 20.00 -2.00 319.25 0.00e+00 3.318 0.000 302.00 328.00 3 4.3975e+00 6.0473e-03 3.3178e-02 -6.0000e+00 9.9171e-02 5.6073e-04 7.1780e-03 2.0070e-02 -6.0000e+00 1.0806e-01 -1.8212e-02 5.9347e-03 9.5190e-03 -6.0000e+00 6.4229e-02 1.4134e-03 3.1018e-03 3.7190e-03 -6.0000e+00 2.7181e-02 2.6096e-04 -6.9607e-04 1.2259e-04 3.4337e-05 -6.0000e+00 1.8985e-03 1.2145e-02 11 9 0 11 8 0 99.00 18.59 0.34 0.01215 0.00691 22 5 4 8 0 2254.360 15.00 18.59 17.02 21.06 20.96 25.9 834.81 -21395 -41927 6570 20144 -16281 25390 -1811 17442 -19518 -14210 10289 -482 -10696 -32065 -12549 -6274 -3101 -8576 10912 -6103 -2624 5590 -6485 -2969 1221 -607 -9575 -835 2938 10366 -10251 3572 -1938 7490 6049 2507 -2409 8383 1111 -3458 -241 -1811 -1572 -1067 -479 -554 -1061 -653 338 2168 1118 1103 931 -815 176 918 -270 2348 -615 1454 520 1143 396 1813 654 2122 685 1125 1811 -1029 552 716 -510 -43 -8 1041 -83 1210 1664 570 -2145 -1599 -2613 -820 -1275 -750 -413 196 175 144 211 733 1600 1914 1855 461 214 510 -512 -444 -588 -196 996 -64 -1893 -713 -786 -497 -243 -8 -444 56 -263 44 331 1765 734 46 5 -951 -894 6 -418 68 964 38 1589 1219 980 473 97 198 28 942 -426 -266 242 -561 -670 -292 -164 108 236 -456 -1226 125 320 -333 341 -34 308 -547 -397 231 -13 -379 -1694 -655 -350 -181 -565 633 -435 -185 363 -491 -232 98 -52 -884 -68 224 765 -1035 358 -227 827 644 274 -304 1131 194 -735 -55 -441 -397 -272 -123 -144 -278 -171 88 577 326 352 318 -301 67 357 -108 912 -240 556 209 496 192 939 347 1051 328 539 939 -621 358 479 -343 -28 -5 551 -41 581 867 344 -1506 -1241 -2190 -710 -1177 -736 -424 205 183 145 198 636 1291 1550 1631 458 239 631 -677 -578 -723 -219 1042 -70 -2259 -884 -1018 -674 -349 -13 -736 95 -437 69 485 2440 1030 68 8 -1568 -1489 10 -660 103 1396 54 2118 1672 1464 769 167 353 52 1789 -863 -563 519 -1229 -1471 -625 -336 212 455 SS 20240802T063444.9Z 8980.274131 104 1 49.29 2 68.07 54.87 61.41 26.98 0.00 1 0.00 1 0 25 3.324e-02 7.297e-03 3.202e-02 4.078e-03 3.405527e-01 2.029589e-03 3.538053e-03 -6.000000e+00 1.872063e-02 226.01 -2.00 3.06 -2.00 319.12 0.00e+00 1.375629e-03 4.732443e-04 1.908202e-04 -6.000000e+00 8.153886e-04 276.68 -2.00 20.00 -2.00 318.50 0.00e+00 2.655 0.000 302.00 328.00 3 4.8903e+00 5.5976e-03 2.6472e-02 -6.0000e+00 4.6425e-02 -3.6640e-03 6.4462e-03 1.5479e-02 -6.0000e+00 5.0587e-02 -8.2059e-03 4.6353e-03 7.6279e-03 -6.0000e+00 3.0067e-02 -2.8183e-03 2.4377e-03 2.5058e-03 -6.0000e+00 1.2724e-02 2.9895e-04 -6.9803e-04 1.1955e-04 2.5728e-05 -6.0000e+00 8.8875e-04 1.2091e-02 11 9 0 11 8 0 98.49 18.60 0.42 0.01209 0.00685 27 6 4 8 0 1825.220 15.00 18.60 17.90 21.06 21.06 26.0 839.34 -6199 -5477 -21124 -731 982 -9367 201 -8679 -7013 10741 9689 4063 5399 8050 -4215 -9045 7123 -1851 3077 -2570 1926 -6747 -99 -1492 -1898 -335 4687 352 -1393 1673 -1064 3677 -566 -1661 -927 8623 472 2433 593 -2800 326 -2742 -1034 -999 -733 -2378 2 -1770 782 -649 -64 1431 2186 38 370 1062 -89 -234 343 574 2359 1135 595 1457 -1356 1647 1937 1718 1682 -1366 631 -700 116 -532 914 -13 770 665 242 726 -109 -613 -2373 -663 -1500 -719 -955 82 -422 -44 149 1001 1790 1565 1991 607 817 -146 -525 -216 -380 -348 1020 103 -846 -1132 -579 -800 -339 22 -303 -515 -429 244 3 1708 582 720 -11 -304 -70 -591 -40 197 764 -34 1177 1706 753 -375 220 67 -36 273 -64 -378 -98 -45 -463 -153 -130 -229 331 -246 -238 -1101 -29 35 -361 8 -402 -355 480 439 205 312 538 -368 -916 658 -197 328 -302 220 -835 -12 -192 -260 -47 626 46 -178 212 -150 551 -97 -295 -154 1298 84 504 150 -843 104 -948 -363 -354 -260 -862 1 -630 270 -233 -24 584 936 17 176 516 -44 -116 167 278 1163 615 353 921 -882 977 1074 947 1009 -953 471 -544 89 -395 622 -8 433 367 142 487 -83 -514 -2144 -619 -1511 -763 -1070 93 -481 -49 153 939 1540 1348 1823 625 933 -186 -704 -287 -475 -399 1100 115 -1027 -1456 -776 -1119 -496 35 -505 -874 -703 375 4 2314 800 1026 -17 -489 -113 -953 -62 296 1098 -48 1544 2264 1085 -588 363 114 -62 489 -120 -753 -199 -92 -962 -310 -253 -430 609 SS 20240802T070737.6Z 8980.296963 124 1 49.45 2 62.31 49.01 58.58 19.50 0.00 1 0.00 1 0 25 1.231e-02 6.789e-03 6.115e-03 1.464e-03 2.748230e-01 7.213901e-04 2.916953e-03 -6.000000e+00 6.935989e-03 226.01 -2.00 3.06 -2.00 317.97 0.00e+00 1.987673e-04 1.216469e-04 7.514885e-05 -6.000000e+00 3.020802e-04 276.68 -2.00 20.00 -2.00 317.32 0.00e+00 2.142 0.000 302.00 328.00 3 3.9168e+00 1.9215e-03 2.1340e-02 -6.0000e+00 1.7200e-02 -7.9261e-03 2.1771e-03 1.2352e-02 -6.0000e+00 1.8742e-02 -1.4792e-04 1.3815e-03 6.1321e-03 -6.0000e+00 1.1139e-02 -5.1370e-03 7.0761e-04 1.7506e-03 -6.0000e+00 4.7148e-03 1.3193e-03 -4.6754e-04 4.2151e-05 1.9517e-05 -6.0000e+00 3.2923e-04 1.1171e-02 11 8 0 10 0 0 99.94 18.61 0.28 0.01117 0.00766 66 14 4 8 0 749.110 15.00 18.61 17.65 21.06 21.06 25.9 837.47 -3820 -3072 -5341 -4321 -2107 1080 -687 1976 335 -2386 -2499 2278 -515 -241 356 -1362 420 -467 193 256 -1066 752 1633 855 366 -742 -1523 636 667 2370 2057 3044 1137 -1970 -126 1171 -1673 -63 -464 -2127 -1322 -1328 -1028 -1185 -180 -1048 -556 -559 -307 1247 1070 748 705 384 657 1087 329 619 844 1196 1593 1257 993 182 -776 226 288 1150 1647 -179 122 -405 -42 107 -182 228 576 713 1099 -174 -504 -1175 -2106 -760 -1017 -723 -521 -540 -363 -104 375 505 1537 1866 1452 735 766 310 -724 -786 -349 -302 550 450 -1205 -658 -893 -551 -49 -177 -284 -150 -52 116 462 1182 604 729 53 -731 -686 -29 -231 -93 860 407 1489 1663 560 447 130 -25 113 376 -354 -437 114 -116 -624 -185 -177 -297 183 -314 -273 -491 -365 -156 75 -52 165 32 -240 -250 226 -59 -32 54 -230 73 -85 36 50 -214 147 324 182 83 -176 -359 138 135 469 437 699 289 -524 -31 279 -450 -20 -175 -948 -636 -668 -529 -615 -92 -541 -280 -275 -148 600 548 413 413 237 417 703 218 406 540 759 1042 891 705 139 -590 171 202 786 1212 -139 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