File name: Pandora53s1_Potchefstroom-METSI_20230817_L2Fit_fout2c0d20220413p1-8.txt File generation date: 20230817T222831.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c0p1-8 Local principal investigator: Stuart Piketh Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 53 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora53_OF_v5d20210210.txt Instrument calibration file used: Pandora53s1_CF_v103d20220413.txt Level 1 file used: Pandora53s1_Potchefstroom-METSI_20230817_L1_smca1c0d20220413p1-8.txt Full location name: Gerhard Minnebron Mooi River Ecosystem Trails for Scientific Investigations Short location name: Potchefstroom-METSI Country of location: South Africa Location latitude [deg]: -26.4907 Location longitude [deg]: 27.1322 Location altitude [m]: 1440 Local noon date: 20230817 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0881 305.2288 305.3695 305.5101 305.6508 305.7914 305.9321 306.0727 306.2133 306.3539 306.4945 306.6351 306.7757 306.9162 307.0568 307.1973 307.3378 307.4784 307.6189 307.7593 307.8998 308.0403 308.1807 308.3212 308.4616 308.6020 308.7424 308.8828 309.0232 309.1636 309.3040 309.4443 309.5847 309.7250 309.8653 310.0056 310.1459 310.2862 310.4264 310.5667 310.7069 310.8472 310.9874 311.1276 311.2678 311.4080 311.5482 311.6883 311.8285 311.9686 312.1088 312.2489 312.3890 312.5291 312.6692 312.8092 312.9493 313.0893 313.2294 313.3694 313.5094 313.6494 313.7894 313.9294 314.0694 314.2093 314.3493 314.4892 314.6291 314.7690 314.9089 315.0488 315.1887 315.3285 315.4684 315.6082 315.7480 315.8878 316.0276 316.1674 316.3072 316.4470 316.5867 316.7265 316.8662 317.0059 317.1456 317.2853 317.4250 317.5647 317.7044 317.8440 317.9836 318.1233 318.2629 318.4025 318.5421 318.6816 318.8212 318.9608 319.1003 319.2398 319.3794 319.5189 319.6584 319.7978 319.9373 320.0768 320.2162 320.3556 320.4951 320.6345 320.7739 320.9133 321.0526 321.1920 321.3314 321.4707 321.6100 321.7493 321.8887 322.0279 322.1672 322.3065 322.4458 322.5850 322.7242 322.8635 323.0027 323.1419 323.2810 323.4202 323.5594 323.6985 323.8377 323.9768 324.1159 324.2550 324.3941 324.5332 324.6722 324.8113 324.9503 --------------------------------------------------------------------------------------- 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: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: 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 78: 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 79: 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 80: 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 81: 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 82: 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 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Azimuth motor temperature [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20230817T060119.0Z 8629.250914 103 1 8.79 2 73.56 65.25 83.34 70.15 0.00 1 0.00 1 0 25 1.077e-01 9.580e-03 6.689e-02 6.087e-03 4.282816e-01 3.206802e-03 4.476119e-03 -6.000000e+00 6.495482e-02 226.64 -2.00 3.06 -2.00 318.71 0.00e+00 3.331428e-04 7.079654e-04 4.567136e-04 -6.000000e+00 2.855464e-03 278.93 -2.00 20.00 -2.00 318.07 0.00e+00 3.478 0.000 302.00 328.00 3 4.8221e+00 8.7327e-03 3.5160e-02 -6.0000e+00 1.6096e-01 9.4052e-03 9.9844e-03 1.9540e-02 -6.0000e+00 1.7454e-01 -9.7946e-03 7.0870e-03 9.5851e-03 -6.0000e+00 1.0390e-01 -2.6718e-03 3.7106e-03 2.7320e-03 -6.0000e+00 4.3516e-02 1.3345e-04 -1.0570e-03 1.9104e-04 3.5542e-05 -6.0000e+00 3.3994e-03 -3.5693e-02 -3.4797e-04 12 9 9 12 5 5 98.87 16.86 0.38 -0.03569 -0.04364 3 4 1 5 0 2152.450 20.04 15.00 16.86 15.05 40.10 14.6 845.33 2864 -4282 -49417 61947 -13238 39815 35655 10817 26275 -5431 35524 -34942 46833 -2356 -10053 -7111 -1768 5671 -5698 9523 -4969 5355 1870 -1051 579 4585 -1046 -4403 10983 1374 10293 6533 3719 -5065 -2340 328 -5915 -4129 -1684 -2969 -194 -2114 -1033 -1018 -3203 624 1790 -1041 1280 1908 -478 566 396 3346 -1496 673 1226 1377 2232 -21 2943 94 2169 -943 78 -115 1025 1270 849 1890 -263 -469 -2384 1358 -155 277 1838 -2587 98 31 126 -994 -1760 -1271 -1839 -713 -528 -365 -1046 92 295 1205 786 1870 1689 1456 974 108 -150 58 -188 -613 14 140 321 -880 -1477 -376 108 -534 -638 -862 395 -216 813 219 1271 -245 -318 -129 -81 -245 -922 716 -17 251 1040 1119 1087 347 759 10 651 40 -645 473 -67 -722 -895 -240 -261 420 16 78 -140 -2587 1124 -455 811 807 352 818 -243 1140 -2345 1698 -158 -838 -655 -169 541 -630 969 -587 595 218 -134 78 622 -151 -639 1366 188 1402 1038 653 -1015 -452 62 -1262 -1012 -472 -942 -67 -778 -392 -394 -1277 241 685 -411 501 770 -207 259 196 1679 -811 370 685 769 1219 -12 1635 57 1376 -641 54 -79 668 828 584 1410 -212 -390 -2027 1088 -120 201 1231 -1767 69 24 106 -899 -1716 -1273 -1942 -781 -599 -421 -1216 104 318 1229 781 1821 1723 1581 1145 137 -201 77 -245 -762 16 168 393 -1126 -1976 -519 155 -797 -997 -1383 628 -334 1198 317 1794 -358 -478 -201 -127 -384 -1413 1068 -25 359 1440 1561 1577 531 1212 17 1095 69 -1159 865 -126 -1377 -1716 -453 -483 756 28 SS 20230817T061127.8Z 8629.257961 106 1 7.98 2 71.51 63.81 81.25 68.96 0.00 1 0.00 1 0 25 3.099e-02 6.943e-03 2.062e-02 3.626e-03 3.847667e-01 1.908742e-03 4.020943e-03 -6.000000e+00 1.869211e-02 226.64 -2.00 3.06 -2.00 318.10 0.00e+00 7.790592e-04 3.496030e-04 1.606320e-04 -6.000000e+00 8.215961e-04 278.93 -2.00 20.00 -2.00 317.46 0.00e+00 3.114 0.000 302.00 328.00 3 4.2640e+00 5.1041e-03 3.1442e-02 -6.0000e+00 4.6321e-02 -1.4429e-03 5.7692e-03 1.7343e-02 -6.0000e+00 5.0224e-02 -6.8970e-03 3.7490e-03 8.5335e-03 -6.0000e+00 2.9898e-02 -3.5874e-03 1.9217e-03 2.5067e-03 -6.0000e+00 1.2524e-02 3.3337e-04 -8.5184e-04 1.1425e-04 3.2143e-05 -6.0000e+00 9.7799e-04 -3.5114e-02 -2.7738e-04 12 9 1 12 5 5 68.76 16.88 0.30 -0.03511 -0.04151 6 8 1 5 0 1114.640 20.14 15.00 16.88 15.55 40.80 14.6 849.16 -1541 -11392 -22395 4131 -10527 -9325 124 -1804 2191 -2956 6053 -4922 14120 -190 2212 -5242 -1473 -1619 -1037 -1483 -828 3567 1846 1492 -3576 -539 -2720 -2211 1757 532 973 3895 554 -1381 -98 -1461 -1870 -1373 -813 -716 -1477 -1360 -221 -702 1372 -888 -800 -1376 244 488 899 1641 811 1493 223 130 1330 1503 639 460 1356 1200 1870 313 1240 550 118 264 1408 710 -529 -221 -771 -614 -421 236 383 362 788 155 -874 -1515 -1834 -1131 -1347 -1118 -982 -277 -723 144 996 483 626 1047 1841 834 688 421 -575 -190 -291 -759 218 296 -491 -534 -812 -610 -587 -82 -291 -398 50 -26 368 660 570 420 198 148 -37 -783 -513 390 503 678 1139 797 883 663 -83 55 155 171 -123 19 178 -504 -581 2 -296 -313 -152 -74 -678 -1544 212 -586 -500 6 -106 137 -207 405 -396 1077 -20 263 -699 -205 -241 -162 -243 -138 578 314 270 -724 -110 -570 -447 332 103 202 875 131 -345 -24 -361 -503 -427 -280 -287 -622 -611 -102 -332 640 -426 -382 -660 116 238 465 858 459 893 141 80 828 934 396 284 856 814 1301 237 951 410 84 188 1056 567 -467 -194 -684 -550 -351 188 280 271 585 123 -795 -1472 -1850 -1205 -1464 -1240 -1146 -331 -871 167 1121 505 640 1048 1931 936 831 543 -770 -255 -373 -939 262 358 -606 -702 -1083 -824 -843 -122 -446 -628 78 -40 526 922 787 599 288 227 -56 -1186 -782 567 726 933 1561 1100 1247 980 -128 88 250 287 -212 33 321 -906 -1049 3 -519 -543 -257 SS 20230817T062209.7Z 8629.265390 113 1 50.63 2 69.37 62.23 79.06 67.67 0.00 1 0.00 1 0 25 1.126e-02 6.059e-03 2.030e-03 5.377e-04 3.486050e-01 2.829412e-04 3.647791e-03 -6.000000e+00 6.798416e-03 226.64 -2.00 3.06 -2.00 317.52 0.00e+00 3.336214e-04 4.382831e-05 1.061244e-04 -6.000000e+00 2.986086e-04 278.93 -2.00 20.00 -2.00 316.87 0.00e+00 2.811 0.000 302.00 328.00 3 2.8338e+00 7.4725e-04 2.8369e-02 -6.0000e+00 1.6848e-02 -7.4195e-03 8.3978e-04 1.5591e-02 -6.0000e+00 1.8263e-02 -1.0025e-02 5.1384e-04 7.6734e-03 -6.0000e+00 1.0872e-02 1.1140e-04 2.5444e-04 2.2013e-03 -6.0000e+00 4.5575e-03 1.8856e-03 -1.2386e-04 1.6962e-05 2.9170e-05 -6.0000e+00 3.5540e-04 -3.7732e-02 -1.8707e-04 12 1 1 12 4 4 99.95 16.92 0.25 -0.03773 -0.03866 231 43 1 5 0 219.130 20.14 14.98 16.92 15.91 41.10 14.6 851.13 -3015 -3124 -4833 -4698 -3902 -4328 -1523 -1241 -1328 -2576 -1190 -400 -249 73 -505 -1037 -972 -398 148 -325 -298 655 602 -288 154 -105 -1029 -550 361 829 925 1780 482 -962 -990 -1106 -931 124 -18 -830 -1075 -752 -863 -658 -634 -413 -467 -300 -224 442 842 933 1283 767 744 741 662 613 891 983 1194 1398 1247 457 243 336 66 397 1087 611 -44 -283 -446 -319 -110 166 447 409 494 -75 -521 -1152 -1607 -1298 -1394 -1011 -700 -489 -624 -223 336 560 810 1236 1130 904 432 -47 -430 -199 -448 -530 272 382 -500 -648 -741 -717 -238 -108 -222 -428 -177 -84 386 787 769 631 214 -304 -383 -208 -358 55 761 585 1166 1164 807 769 430 244 41 239 -44 -245 -13 -334 -496 -312 -223 -423 -212 -249 -286 -426 -435 -334 -361 -130 -118 -140 -267 -126 -45 -32 11 -86 -199 -186 -80 31 -71 -67 148 139 -71 40 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