File name: Pandora159s1_Wakkerstroom_20211217_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035222.5Z 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_20211217_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: 20211217 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 20211217T043728.6Z 8021.192693 184 1 5.68 2 70.69 106.96 129.39 276.07 0.00 1 0.00 1 0 25 3.693e-02 9.229e-03 3.348e-02 6.016e-03 3.634290e-01 3.016780e-03 3.793881e-03 -6.000000e+00 2.098964e-02 227.88 -2.00 3.06 -2.00 318.20 0.00e+00 1.502155e-03 5.619769e-04 1.557739e-04 -6.000000e+00 9.244306e-04 281.29 -2.00 20.00 -2.00 317.50 0.00e+00 2.991 0.000 302.00 328.00 3 3.9387e+00 8.1147e-03 2.9312e-02 -6.0000e+00 5.2198e-02 6.7033e-02 9.2202e-03 1.6454e-02 -6.0000e+00 5.6709e-02 -5.8953e-03 6.0755e-03 8.1414e-03 -6.0000e+00 3.3748e-02 -4.7978e-03 3.1597e-03 2.5893e-03 -6.0000e+00 1.4324e-02 5.5280e-04 -3.9520e-04 1.6904e-04 2.6000e-05 -6.0000e+00 9.8727e-04 -4.7677e-03 12 9 1 12 1 1 999.00 19.11 0.18 -0.00477 -0.00774 2 6 1 8 0 1832.780 14.99 19.11 16.13 21.38 21.38 18.6 870.01 -13963 -15632 7698 -11626 -11065 -12640 6928 -1892 -6416 -20204 -8963 -3863 -4584 2018 3236 354 3533 -4725 -1603 210 -1283 238 264 -2600 -6070 1617 3110 -5650 180 -1039 4446 -894 -1457 236 879 3740 2514 4192 4025 1846 -1663 -607 -1397 -1646 -1264 -903 996 91 990 -291 221 1018 778 1074 -776 843 1609 56 1159 1897 542 826 904 132 -709 931 1482 1619 1752 -360 -740 -1486 328 -409 -1428 -146 1860 1175 1096 635 -1330 -600 -1376 -635 -952 -377 -1037 -782 -1086 -845 271 788 908 2803 1117 305 887 500 -801 -639 -1095 173 587 10 -1301 -1522 -1097 -474 471 214 -36 -595 -57 -21 261 2262 286 988 595 -314 -722 -63 -22 -569 883 1643 2290 1680 -489 -335 326 -434 -318 640 -525 -581 -37 19 -290 -343 -418 -242 392 -801 -1016 416 -716 -615 -689 334 -112 -441 -1665 -670 -290 -400 196 363 45 470 -717 -249 33 -211 38 44 -469 -1199 309 588 -1104 32 -189 834 -195 -350 58 204 827 609 1160 1315 706 -710 -269 -643 -767 -591 -423 456 42 451 -136 109 536 432 626 -471 518 996 35 708 1142 339 549 645 101 -548 679 1026 1109 1271 -293 -646 -1345 292 -355 -1180 -110 1287 798 783 502 -1176 -570 -1382 -657 -1034 -429 -1228 -943 -1312 -994 301 820 895 2695 1144 339 1064 647 -1093 -866 -1425 210 680 12 -1637 -1998 -1475 -657 674 322 -57 -957 -89 -32 375 3084 394 1396 879 -484 -1130 -97 -34 -839 1253 2248 3021 2243 -698 -504 509 -695 -517 1063 -911 -1043 -66 34 -535 -624 -740 -416 661 SS 20211217T044515.1Z 8021.198092 188 1 20.23 2 69.04 106.25 131.05 275.36 0.00 1 0.00 1 0 25 1.243e-02 6.880e-03 3.094e-03 6.205e-04 3.363480e-01 3.106488e-04 3.529560e-03 -6.000000e+00 7.063715e-03 227.88 -2.00 3.06 -2.00 318.06 0.00e+00 5.466295e-04 5.481164e-05 1.244393e-04 -6.000000e+00 3.111189e-04 281.29 -2.00 20.00 -2.00 317.35 0.00e+00 2.769 0.000 302.00 328.00 3 1.2433e+00 8.3318e-04 2.7153e-02 -6.0000e+00 1.7566e-02 3.0136e-02 9.4340e-04 1.5257e-02 -6.0000e+00 1.9085e-02 -8.1826e-03 6.0724e-04 7.4861e-03 -6.0000e+00 1.1358e-02 -8.5583e-04 3.1337e-04 2.1606e-03 -6.0000e+00 4.8201e-03 1.0392e-02 -4.8221e-04 1.7561e-05 2.3125e-05 -6.0000e+00 3.3228e-04 -4.1607e-03 12 9 1 12 1 1 99.86 19.11 0.24 -0.00416 -0.00778 222 123 2 8 0 85.700 14.99 19.11 16.55 21.38 21.38 18.6 873.03 -2992 -4419 -1998 -6511 -1434 -3439 -878 -1691 -91 -3778 -2403 -346 -733 -131 -1046 -1089 -958 -449 -934 337 -892 850 1297 306 33 -425 -1362 -1020 143 1695 2109 1693 1300 -2056 -955 150 -757 66 79 -1370 -1692 -745 -1265 -1100 -403 -692 -610 -413 -627 891 982 673 1096 756 536 1238 518 356 678 991 1764 1315 1299 643 -773 498 523 805 1810 326 -310 -462 -513 11 -345 529 668 1111 1406 -250 -534 -1198 -2119 -1019 -1119 -1103 -551 -657 -374 -353 505 470 1073 1985 1288 689 706 266 -846 -623 -379 -253 769 774 -1096 -890 -801 -762 -110 -86 -263 -390 -50 174 455 1080 815 555 171 -628 -803 -179 -121 49 779 436 1070 1702 537 314 158 -26 159 369 -262 -343 -25 -43 -487 -261 -142 -327 7 -184 -306 -139 -447 -84 -197 -52 -116 -7 -312 -197 -29 -71 -15 -139 -162 -151 -74 -163 60 -165 154 240 61 7 -95 -306 -216 28 330 442 396 336 -520 -246 37 -207 19 28 -579 -790 -335 -590 -518 -189 -326 -284 -205 -310 441 478 356 616 451 333 783 337 231 428 618 1125 910 917 492 -604 359 379 572 1272 265 -278 -404 -479 10 -286 390 480 763 1020 -195 -474 -1110 -2126 -1061 -1247 -1234 -648 -797 -452 -411 577 491 1024 1969 1283 770 828 349 -1130 -821 -495 -300 905 936 -1374 -1179 -1109 -1041 -158 -133 -410 -623 -78 266 639 1504 1132 760 252 -989 -1218 -281 -184 71 1073 611 1414 2249 774 465 248 -43 250 602 -456 -597 -44 -78 -893 -465 -256 -564 12 SS 20211217T045638.0Z 8021.205996 193 1 51.65 2 66.61 105.22 133.47 274.31 0.00 1 0.00 1 0 25 1.107e-02 6.673e-03 2.174e-03 4.499e-04 3.053307e-01 2.257395e-04 3.229499e-03 -6.000000e+00 6.290799e-03 227.88 -2.00 3.06 -2.00 318.15 0.00e+00 4.908557e-04 4.040115e-05 1.213139e-04 -6.000000e+00 2.770718e-04 281.29 -2.00 20.00 -2.00 317.43 0.00e+00 2.500 0.000 302.00 328.00 3 1.4364e+00 6.0630e-04 2.4597e-02 -6.0000e+00 1.5644e-02 2.9262e-02 6.8752e-04 1.3927e-02 -6.0000e+00 1.6997e-02 -4.9822e-03 4.4336e-04 6.8207e-03 -6.0000e+00 1.0115e-02 -2.7129e-03 2.2848e-04 1.9637e-03 -6.0000e+00 4.2928e-03 1.1100e-02 -4.2486e-04 1.2983e-05 2.1983e-05 -6.0000e+00 2.9592e-04 -4.3615e-03 11 8 0 10 0 0 99.94 19.11 0.22 -0.00436 -0.00755 689 148 2 8 0 71.220 15.00 19.11 17.23 21.48 21.38 18.6 875.29 -3512 -3082 -3712 -4452 -2345 -1488 189 -464 -401 -2494 -1117 106 -558 -655 -361 -1650 -969 -161 -322 166 -593 862 981 382 20 -389 -1101 -454 586 2030 1826 2189 1246 -2145 -675 634 -513 437 -3 -1427 -1559 -1079 -1207 -1042 -307 -967 -691 -342 -439 869 938 750 1091 765 477 1230 530 460 770 1117 1719 1369 1118 671 -619 377 550 800 1886 306 -37 -321 -393 -56 -293 565 679 1143 1260 -166 -524 -1120 -2110 -905 -1087 -1010 -562 -628 -354 -320 453 425 1082 1836 1453 702 724 241 -818 -627 -339 -209 798 778 -1054 -772 -634 -697 -51 -109 -277 -366 -70 147 455 1150 853 621 234 -608 -779 -236 -148 -85 781 420 1129 1704 559 305 159 -25 102 403 -246 -355 1 -28 -551 -211 -96 -284 104 -235 -226 -281 -319 -147 -89 12 -33 -32 -213 -94 9 -55 -76 -48 -246 -151 -26 -55 29 -107 152 177 74 4 -84 -237 -92 110 373 360 474 298 -546 -159 144 -128 128 -1 -599 -719 -520 -600 -523 -152 -484 -340 -165 -209 413 473 409 579 429 278 728 322 278 454 651 1026 884 792 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