File name: Pandora159s1_Wakkerstroom_20211124_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033937.4Z 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 v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20211124_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: 20211124 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 20211124T052041.6Z 7998.222703 221 1 7.55 2 60.33 99.26 76.48 309.08 0.00 1 0.00 1 0 25 1.047e-02 7.582e-03 4.645e-03 1.985e-03 2.589953e-01 9.993704e-04 2.759079e-03 -6.000000e+00 5.951836e-03 228.14 -2.00 3.06 -2.00 316.55 0.00e+00 1.257179e-03 1.192129e-04 1.441487e-04 -6.000000e+00 2.608387e-04 280.27 -2.00 20.00 -2.00 315.89 0.00e+00 2.012 0.000 302.00 328.00 3 3.3940e+00 2.6096e-03 2.0134e-02 -6.0000e+00 1.4816e-02 4.9413e-02 2.9223e-03 1.1821e-02 -6.0000e+00 1.6099e-02 -6.1234e-03 1.7064e-03 5.7464e-03 -6.0000e+00 9.5725e-03 -1.2259e-03 8.1122e-04 1.9022e-03 -6.0000e+00 4.0545e-03 2.4513e-03 -4.0567e-04 5.5586e-05 2.0583e-05 -6.0000e+00 2.7985e-04 -1.3734e-03 12 9 1 12 1 1 98.66 18.96 0.34 -0.00137 -0.00442 11 17 1 8 0 614.450 14.99 18.96 18.83 21.27 21.27 18.1 884.13 -2471 -1648 -3090 -3748 -2970 1305 -535 140 -758 -2018 429 1362 69 281 679 -24 467 -245 371 464 -347 1248 1493 -222 777 -146 125 185 953 1818 2034 2769 990 -1169 224 1480 -278 21 -420 -1320 -1806 -1441 -1317 -1016 -148 -853 -670 -1297 -626 559 1085 588 711 132 470 1410 287 473 619 1019 1321 1169 806 547 -1600 211 163 1006 1803 217 36 -558 1 -520 141 348 670 1164 1292 80 -759 -1344 -2009 -1088 -1443 -1118 -246 -394 -367 -213 611 503 1062 1972 1738 751 660 -18 -1145 -389 -374 -250 890 536 -926 -747 -591 -725 -369 163 -458 -308 -224 97 318 1312 918 805 273 -672 -723 -135 -307 -73 618 159 1266 1811 488 275 55 -166 476 442 -251 -323 -68 -224 -568 -183 -209 -271 37 -397 -285 -551 -630 -449 182 -80 23 -137 -383 79 255 15 67 182 -7 140 -76 119 152 -117 411 498 -78 285 -56 47 66 323 604 707 1030 397 -483 87 559 -114 10 -225 -793 -1154 -950 -887 -688 -100 -575 -446 -851 -403 359 721 413 518 100 362 1096 227 373 481 787 1040 971 710 502 -1488 184 134 809 1512 200 35 -563 1 -511 131 302 540 907 1039 70 -726 -1372 -2149 -1193 -1652 -1333 -302 -493 -460 -261 711 551 1097 1985 1817 843 791 -23 -1527 -512 -473 -299 1027 632 -1159 -967 -785 -990 -518 237 -690 -466 -331 138 427 1688 1179 1063 377 -972 -1060 -196 -438 -102 832 209 1597 2281 644 380 78 -240 693 658 -389 -516 -110 -369 -937 -297 -334 -421 56 SS 20211124T053057.6Z 7998.229833 226 1 22.70 2 58.08 98.29 78.20 307.61 0.00 1 0.00 1 0 25 1.076e-02 7.340e-03 1.923e-03 7.798e-04 2.437294e-01 3.910963e-04 2.601821e-03 -6.000000e+00 6.121401e-03 228.14 -2.00 3.06 -2.00 316.74 0.00e+00 1.387065e-03 4.900903e-05 1.509993e-04 -6.000000e+00 2.682556e-04 280.27 -2.00 20.00 -2.00 316.07 0.00e+00 1.884 0.000 302.00 328.00 3 2.6058e+00 1.0248e-03 1.8911e-02 -6.0000e+00 1.5238e-02 4.5741e-02 1.1494e-03 1.1200e-02 -6.0000e+00 1.6557e-02 -8.7483e-03 6.7105e-04 5.4256e-03 -6.0000e+00 9.8449e-03 5.1861e-05 3.2077e-04 1.8907e-03 -6.0000e+00 4.1704e-03 6.1415e-03 -2.7279e-04 2.1965e-05 1.9509e-05 -6.0000e+00 2.8779e-04 -2.1761e-03 12 9 1 12 1 1 99.96 18.96 0.29 -0.00218 -0.00423 123 61 1 8 0 174.340 15.00 18.96 18.99 21.27 21.27 18.2 886.65 -3013 -2823 -2348 -4485 -577 -1756 1989 -142 613 -2597 15 -200 -280 -114 220 -1421 -557 388 -330 1056 -455 1356 993 1010 305 156 -738 -234 1129 2152 2365 2390 1772 -1641 -103 403 121 379 259 -1558 -1538 -1062 -1173 -1017 -519 -875 -955 -455 -734 991 770 837 976 676 455 1126 665 400 830 936 1554 1011 830 178 -999 47 317 785 1838 23 -244 -380 -537 -128 -440 576 440 1311 1290 -161 -697 -1167 -2142 -1045 -1119 -1100 -564 -706 -250 -458 538 327 1110 1979 1447 785 671 275 -850 -630 -401 -37 800 914 -996 -619 -756 -629 -90 -108 -279 -388 -62 87 467 1098 883 526 297 -696 -839 -262 -76 88 835 498 1187 1764 475 419 116 20 -1 495 -255 -375 -41 -18 -593 -328 -115 -422 38 -466 -474 -398 -722 -79 -232 266 -22 103 -467 3 -35 -55 -26 57 -409 -165 118 -105 342 -152 439 327 348 102 54 -254 -82 366 677 784 860 635 -619 -39 148 44 162 133 -869 -932 -669 -759 -662 -336 -567 -606 -280 -442 587 480 558 687 500 346 866 521 312 631 707 1204 846 702 161 -906 39 258 618 1529 21 -238 -387 -544 -124 -399 499 344 962 989 -141 -640 -1185 -2336 -1100 -1260 -1328 -716 -866 -326 -576 619 367 1123 1917 1488 896 794 361 -1122 -817 -517 -43 946 1043 -1258 -824 -987 -855 -127 -163 -418 -588 -96 125 648 1417 1135 709 404 -1021 -1264 -388 -109 121 1151 656 1467 2165 629 597 163 29 -2 747 -410 -598 -68 -29 -1002 -540 -181 -683 59 SS 20211124T060048.4Z 7998.250560 240 1 3.96 2 51.50 95.43 83.40 303.60 0.00 1 0.00 1 0 17 1.081e-02 7.920e-03 6.687e-03 3.986e-03 2.099326e-01 2.020350e-03 2.259630e-03 -6.000000e+00 6.148648e-03 228.14 -2.00 3.06 -2.00 315.52 0.00e+00 1.302691e-03 1.919091e-04 9.406297e-05 -6.000000e+00 2.694618e-04 280.27 -2.00 20.00 -2.00 314.92 0.00e+00 1.603 0.000 302.00 328.00 3 4.2377e+00 5.2126e-03 1.6153e-02 -6.0000e+00 1.5306e-02 5.6774e-02 5.8106e-03 9.6311e-03 -6.0000e+00 1.6631e-02 -1.1171e-02 3.3283e-03 4.6718e-03 -6.0000e+00 9.8890e-03 2.2085e-03 1.5029e-03 1.6261e-03 -6.0000e+00 4.1887e-03 1.5949e-03 -4.4972e-04 1.1107e-04 1.7839e-05 -6.0000e+00 2.8910e-04 -1.5937e-03 12 9 1 12 1 1 999.00 18.96 0.18 -0.00159 -0.00497 2 9 1 8 0 1223.070 15.00 18.96 20.04 21.27 21.27 18.2 891.44 -53 -3540 -3838 -1634 -141 64 1484 2481 834 -1119 1483 1062 341 411 -336 -2124 -333 994 -654 263 -8 1361 1286 2136 1038 -949 -1092 695 477 1514 1116 4224 2308 -513 -450 511 11 -517 -284 -1680 -1838 -879 -1143 -621 -824 -926 -963 -802 -540 511 299 1354 264 118 -82 1329 370 363 1461 320 1713 319 1047 -1 -692 385 754 457 2206 -375 -100 -379 -159 -329 -519 661 555 910 1545 -230 -881 -963 -1880 -1582 -871 -808 -480 -727 -435 -219 678 339 1574 1387 1801 808 940 611 -833 -738 -947 -86 328 205 -1063 -1034 -502 -421 -220 157 -100 -439 53 -71 130 853 904 806 540 -934 -753 -123 251 136 1357 -69 731 1480 409 233 -140 388 312 325 -352 -135 -65 -104 -518 -230 -48 -506 -185 -14 -1023 -1117 -439 -34 15 350 637 235 -329 419 305 107 143 -130 -882 -140 422 -289 118 -4 608 580 989 502 -474 -543 324 212 655 501 1953 1138 -262 -218 241 5 -291 -181 -1188 -1374 -671 -889 -484 -642 -721 -738 -600 -397 371 225 1054 213 99 -70 1127 318 312 1229 271 1466 289 989 -1 -680 356 657 391 1937 -362 -102 -396 -166 -336 -508 601 471 743 1290 -208 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