File name: Pandora159s1_Wakkerstroom_20231011_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20231012T002500.4Z 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 v1.8.49 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20231011_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: 20231011 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 20231011T071324.9Z 8684.300983 160 1 49.26 2 41.56 67.79 39.66 6.86 0.00 1 0.00 1 0 17 1.859e-02 9.889e-03 1.181e-02 4.831e-03 1.918101e-01 2.415388e-03 2.080827e-03 -6.000000e+00 1.056803e-02 227.98 -2.00 3.06 -2.00 316.96 0.00e+00 2.250609e-03 3.087987e-04 2.208580e-04 -6.000000e+00 4.597281e-04 278.34 -2.00 20.00 -2.00 316.30 0.00e+00 1.335 0.000 302.00 328.00 3 5.6152e+00 6.3445e-03 1.4074e-02 -6.0000e+00 2.6314e-02 2.4380e-02 7.1154e-03 9.3889e-03 -6.0000e+00 2.8603e-02 4.4138e-03 4.1653e-03 4.3500e-03 -6.0000e+00 1.6991e-02 -4.3696e-03 1.9824e-03 2.1943e-03 -6.0000e+00 7.1881e-03 5.1562e-04 -1.4921e-04 1.3978e-04 2.0515e-05 -6.0000e+00 4.9709e-04 -2.7455e-03 12 8 8 10 0 0 99.97 19.84 0.40 -0.00275 -0.00387 214 46 4 8 0 230.130 15.00 19.84 26.17 21.98 21.88 26.3 895.64 -5277 4056 -3150 -2633 -7636 3882 -764 484 3401 -4699 603 -1091 5850 -2111 4235 -3940 486 -1025 1664 -704 83 819 1205 2272 -1702 3168 -3869 3375 -2331 3389 -561 3138 360 -1311 678 -310 2694 231 3419 -2934 -590 -2018 -586 -2768 310 -1299 -575 -1034 -216 1105 -250 1199 -294 2454 19 2693 -205 1828 -135 1543 2083 957 771 466 -182 -767 1144 -144 3234 -1005 -436 -740 -68 44 -367 805 -83 2055 236 255 -1602 -66 -3113 -480 -1554 -651 -856 -484 -435 -456 649 -40 1882 1246 2518 -184 1785 128 -337 -1103 434 -202 572 1079 -1711 -215 -529 -571 -602 793 -993 442 -514 298 374 736 854 153 1156 -972 -668 -964 603 -272 1177 -167 1714 1524 949 689 86 463 -347 567 -558 12 -457 136 -798 -144 -104 -165 -21 -910 692 -579 -449 -1216 524 -113 78 583 -893 106 -198 1098 -485 1031 -1121 136 -300 488 -218 26 250 371 717 -582 1058 -1366 1045 -716 963 -173 1000 126 -470 223 -100 912 93 1580 -1644 -349 -1260 -369 -1798 196 -832 -356 -626 -126 632 -151 760 -198 1671 13 1901 -150 1306 -97 1087 1509 748 649 415 -162 -629 843 -104 2383 -868 -408 -719 -66 41 -323 633 -60 1358 165 198 -1409 -62 -3211 -503 -1752 -781 -1086 -628 -567 -573 753 -43 1780 1142 2387 -196 2056 164 -457 -1481 542 -234 628 1223 -2147 -283 -724 -814 -896 1225 -1633 719 -812 433 496 915 1058 199 1595 -1464 -1033 -1481 891 -389 1585 -217 2069 1843 1215 944 123 672 -513 861 -902 20 -798 240 -1433 -252 -177 -271 -34 SS 20231011T073434.9Z 8684.315682 171 1 49.27 2 37.28 62.98 39.35 358.84 0.00 1 0.00 1 0 17 1.178e-02 7.335e-03 7.714e-03 3.642e-03 1.869681e-01 1.827310e-03 2.019397e-03 -6.000000e+00 6.697003e-03 227.98 -2.00 3.06 -2.00 316.44 0.00e+00 5.412292e-04 2.080148e-04 2.613062e-05 -6.000000e+00 2.913311e-04 278.34 -2.00 20.00 -2.00 315.80 0.00e+00 1.256 0.000 302.00 328.00 3 6.0915e+00 4.7673e-03 1.3325e-02 -6.0000e+00 1.6675e-02 5.1026e-02 5.3352e-03 8.4770e-03 -6.0000e+00 1.8126e-02 -2.2926e-03 3.0876e-03 4.1812e-03 -6.0000e+00 1.0767e-02 -2.4980e-03 1.4387e-03 1.2351e-03 -6.0000e+00 4.5552e-03 3.4472e-04 -3.6941e-04 1.0406e-04 1.4435e-05 -6.0000e+00 3.1501e-04 -2.7739e-03 11 8 0 10 0 0 99.98 19.85 0.53 -0.00277 -0.00555 21 5 1 8 0 2322.990 15.00 19.85 26.58 21.98 21.88 26.2 896.80 -3289 -3039 -2141 -5811 545 -407 655 3029 758 -1681 1292 1361 -443 1222 -1911 -762 -1588 -851 462 2931 374 2117 826 602 -592 1363 -541 126 1174 820 1669 778 3089 -1905 -2065 636 527 517 -113 -455 -1814 -294 -1337 -526 -844 -280 -509 -742 -145 612 1297 185 1956 211 736 2185 359 -492 621 -32 268 1020 1436 955 -530 -500 519 476 1667 -413 -69 66 -224 -102 -135 630 -720 1149 1303 -549 -831 -1572 -1780 -826 -1386 -741 -179 -934 7 -707 454 135 775 1274 1180 909 1107 286 -671 -622 -285 -463 554 595 -1622 -892 48 -604 425 578 -78 368 -275 78 667 595 435 613 -58 -353 -880 21 -219 -166 989 1042 1165 851 626 -162 310 63 -174 376 -649 -335 328 258 -393 -68 -209 -689 -51 -666 -659 -462 -1205 94 -67 112 568 160 -375 273 289 -105 320 -578 -244 -528 -286 158 1007 133 736 293 224 -234 541 -216 47 401 274 572 285 1174 -770 -781 228 204 232 -60 -278 -1212 -201 -943 -370 -590 -194 -346 -487 -92 383 835 128 1388 159 563 1671 283 -388 478 -24 211 850 1273 894 -496 -431 407 360 1314 -372 -67 66 -227 -99 -125 524 -546 809 945 -448 -751 -1552 -1857 -891 -1590 -901 -227 -1229 9 -902 534 146 761 1201 1157 973 1292 365 -904 -827 -356 -540 614 681 -2032 -1174 65 -850 615 877 -123 583 -422 112 876 736 535 781 -80 -514 -1325 30 -317 -233 1311 1316 1400 1018 790 -219 432 88 -248 553 -1004 -543 540 435 -669 -113 -339 -1090 -79 SS 20231011T073926.9Z 8684.319061 173 1 2.40 2 36.32 61.76 39.37 356.99 0.00 1 0.00 1 0 17 9.732e-03 7.928e-03 3.474e-03 2.444e-03 1.744014e-01 1.246388e-03 1.887237e-03 -6.000000e+00 5.531334e-03 227.98 -2.00 3.06 -2.00 314.80 0.00e+00 9.059395e-04 1.019216e-04 9.827020e-05 -6.000000e+00 2.406236e-04 278.34 -2.00 20.00 -2.00 314.28 0.00e+00 1.240 0.000 302.00 328.00 3 3.1987e+00 3.1940e-03 1.2828e-02 -6.0000e+00 1.3773e-02 1.1932e-02 3.5486e-03 7.9354e-03 -6.0000e+00 1.4971e-02 -1.1578e-03 2.0300e-03 3.8754e-03 -6.0000e+00 8.8932e-03 1.8673e-04 8.9179e-04 1.3103e-03 -6.0000e+00 3.7623e-03 6.5529e-03 -2.8695e-04 6.7857e-05 1.5517e-05 -6.0000e+00 2.6018e-04 -2.7202e-03 12 9 1 12 1 1 99.46 19.85 0.29 -0.00272 -0.00488 5 35 1 8 0 300.520 15.01 19.85 26.70 21.98 21.88 26.2 897.24 -330 -861 -1553 -3597 -1071 -1670 1559 1901 938 -900 -156 903 357 368 -29 -899 -429 -221 594 1262 -458 1904 1453 707 117 507 -768 -354 596 2043 1491 2553 1617 -1657 -618 230 -580 267 334 -1485 -1669 -731 -1211 -1706 -449 -711 -1026 -700 -1379 1192 1056 800 748 848 594 1135 650 329 565 1035 1353 1086 1448 254 -1341 55 32 530 1496 -32 -252 -562 -471 51 -332 486 55 875 693 -236 -672 -1090 -2224 -1160 -1122 -1381 -602 -528 -193 -298 335 647 1120 1701 1572 581 934 442 -810 -314 -272 -539 1186 751 -804 -868 -577 -539 -132 -134 -442 -246 205 166 316 1316 1056 282 263 -624 -789 -318 -426 6 1098 565 981 1474 465 98 -116 205 213 45 -296 -397 137 -166 -502 -101 -178 -400 -7 -116 -322 -581 -1292 -345 -515 487 648 344 -343 -58 336 142 160 -14 -448 -216 -113 308 668 -247 999 772 387 67 293 -443 -195 309 1027 771 1365 903 -957 -338 123 -329 166 232 -1144 -1351 -600 -1013 -1440 -375 -591 -845 -561 -1089 916 832 656 634 737 525 1004 581 295 499 914 1210 1014 1412 257 -1353 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