File name: Pandora159s1_Wakkerstroom_20211220_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035238.2Z 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 v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20211220_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: 20211220 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 20211220T082410.6Z 8024.350122 315 1 2.53 2 21.31 84.60 147.38 276.86 0.00 1 0.00 1 0 25 1.119e-02 9.141e-03 5.845e-03 4.674e-03 1.312983e-01 2.405466e-03 1.461031e-03 -6.000000e+00 6.360450e-03 227.85 -2.00 3.06 -2.00 314.01 0.00e+00 3.832921e-04 1.724653e-04 5.378577e-05 -6.000000e+00 2.803040e-04 281.42 -2.00 20.00 -2.00 313.53 0.00e+00 1.073 0.000 302.00 328.00 3 4.4912e+00 6.1233e-03 1.0584e-02 -6.0000e+00 1.5816e-02 2.6316e-02 6.7777e-03 6.0166e-03 -6.0000e+00 1.7182e-02 3.8053e-03 3.8916e-03 2.9658e-03 -6.0000e+00 1.0226e-02 -3.5940e-03 1.6769e-03 9.0355e-04 -6.0000e+00 4.3414e-03 2.2642e-03 -5.0146e-04 1.2905e-04 1.2418e-05 -6.0000e+00 2.9918e-04 -5.1185e-03 12 9 1 12 1 1 999.00 19.11 0.30 -0.00512 -0.00889 1 9 2 8 0 1176.960 15.00 19.11 26.79 21.48 21.48 19.2 923.84 -931 -2944 -1548 -3190 -794 -48 112 2869 -238 -613 -2062 2632 200 1559 1277 -1039 -54 243 1073 1606 -926 135 1362 1041 2280 34 -268 -145 1810 1176 2605 2780 1757 391 371 -652 -633 -134 65 -2302 -2586 -1341 -1349 -623 -814 -1170 -2087 177 -925 822 94 208 938 -52 1502 927 693 -151 920 1065 2009 787 1127 272 -922 41 396 717 2326 24 -888 337 -964 -587 -105 -20 283 533 1336 -227 -883 -1556 -1958 -1453 -555 -1387 -62 -1177 -272 -41 543 284 998 1905 1258 1164 841 507 -682 -255 19 337 -315 962 -741 -720 -1142 -828 111 -271 -255 -311 -57 139 -123 698 -453 1016 -91 -139 -640 498 11 210 444 1144 1335 1488 849 247 784 -371 49 227 -515 -375 160 355 -423 -530 50 -961 -447 -430 -1446 -749 -1475 -329 -19 46 1238 -113 -296 -985 1209 98 818 718 -618 -32 146 650 989 -585 84 844 662 1481 23 -178 -92 1073 680 1510 1666 1095 247 223 -387 -395 -92 49 -1940 -2287 -1202 -1225 -564 -736 -1054 -1856 151 -776 674 79 181 833 -47 1378 858 647 -142 847 978 1871 765 1139 284 -958 41 364 638 2111 24 -928 359 -1037 -620 -106 -19 251 452 1142 -208 -867 -1615 -2101 -1597 -630 -1646 -75 -1471 -338 -51 633 312 1029 1892 1280 1246 951 605 -844 -313 22 379 -347 1076 -877 -884 -1436 -1063 144 -363 -349 -428 -77 177 -148 806 -524 1196 -112 -178 -845 651 14 265 543 1356 1528 1690 995 300 970 -465 62 290 -682 -512 221 496 -597 -742 69 -1304 -599 SS 20211220T095838.6Z 8024.415725 357 1 52.20 2 3.93 354.81 167.30 268.47 0.00 1 0.00 1 0 17 9.883e-03 7.314e-03 1.364e-03 8.408e-04 1.239245e-01 4.230411e-04 1.356016e-03 -6.000000e+00 5.617725e-03 227.85 -2.00 3.06 -2.00 315.53 0.00e+00 1.672822e-04 4.001420e-05 2.923052e-05 -6.000000e+00 2.475648e-04 281.43 -2.00 20.00 -2.00 314.89 0.00e+00 1.002 0.000 302.00 328.00 3 3.3832e+00 1.0920e-03 9.9080e-03 -6.0000e+00 1.3969e-02 1.5614e-02 1.2150e-03 5.6437e-03 -6.0000e+00 1.5175e-02 4.6341e-03 6.9600e-04 2.7740e-03 -6.0000e+00 9.0321e-03 -3.9188e-03 3.1197e-04 7.9274e-04 -6.0000e+00 3.8347e-03 7.4114e-03 -1.7722e-04 2.3836e-05 1.0198e-05 -6.0000e+00 2.6422e-04 -5.5781e-03 11 8 0 10 0 0 99.99 19.13 0.31 -0.00558 -0.00691 1290 277 2 8 0 37.790 15.01 19.13 24.03 21.48 21.48 19.4 911.79 -1147 -1269 -2978 -2492 -844 1228 749 2413 925 -633 -378 2073 232 520 400 -1128 58 -386 578 174 11 712 1625 310 639 208 -782 -82 1041 2933 1737 2960 1221 -1348 -636 1307 -19 883 -116 -1335 -1706 -1074 -1152 -1493 -418 -1462 -1053 -753 -390 564 978 577 991 565 518 1223 391 552 704 1265 1371 1259 736 369 -1083 105 247 913 2017 137 -259 -556 -259 -275 -112 215 701 988 1550 -124 -675 -1105 -1974 -714 -1064 -945 -776 -623 -389 -281 264 257 916 1874 1429 589 711 164 -834 -716 -164 -205 952 758 -772 -655 -401 -676 -81 -19 -268 -312 -161 149 272 1144 525 730 268 -396 -659 -129 -143 52 949 405 1236 1519 674 324 233 -143 132 503 -249 -337 -98 -18 -592 -87 -229 -276 -92 -359 -422 -1000 -764 -223 298 191 675 289 -207 -119 628 77 190 161 -489 25 -170 257 79 5 322 733 147 315 106 -393 -38 438 1267 770 1359 546 -621 -297 578 -9 447 -71 -944 -1305 -844 -923 -1202 -330 -1155 -801 -545 -269 377 672 420 750 445 415 986 321 450 563 1002 1117 1094 688 362 -1053 91 212 742 1706 121 -250 -562 -261 -270 -103 194 560 730 1161 -104 -635 -1137 -1969 -733 -1172 -1117 -969 -803 -501 -349 301 291 923 1770 1403 634 837 213 -1047 -882 -206 -239 1046 869 -980 -880 -559 -981 -110 -27 -398 -463 -227 211 349 1353 618 896 356 -572 -989 -193 -207 72 1234 502 1430 1730 811 415 310 -193 178 699 -368 -526 -157 -29 -986 -142 -363 -424 -138 SS 20211220T101359.0Z 8024.426377 365 1 49.31 2 5.47 314.86 170.54 265.94 0.00 1 0.00 1 0 17 9.525e-03 7.320e-03 1.990e-03 1.342e-03 1.281346e-01 6.819355e-04 1.391916e-03 -6.000000e+00 5.414124e-03 227.85 -2.00 3.06 -2.00 315.00 0.00e+00 1.052680e-04 5.827189e-05 2.028438e-05 -6.000000e+00 2.385868e-04 281.43 -2.00 20.00 -2.00 314.41 0.00e+00 1.005 0.000 302.00 328.00 3 4.9569e+00 1.7527e-03 1.0017e-02 -6.0000e+00 1.3463e-02 3.8099e-02 1.9478e-03 5.7860e-03 -6.0000e+00 1.4625e-02 -2.3303e-03 1.1134e-03 2.8531e-03 -6.0000e+00 8.7046e-03 -1.2509e-03 4.9068e-04 8.0833e-04 -6.0000e+00 3.6958e-03 1.5125e-03 -2.5852e-04 3.7779e-05 1.0677e-05 -6.0000e+00 2.5464e-04 -5.8333e-03 11 8 0 10 0 0 99.98 19.15 0.12 -0.00583 -0.00778 65 14 1 8 0 758.420 15.01 19.15 25.39 21.48 21.48 19.4 918.63 -1116 -1962 -2078 -3021 -194 950 799 1859 1073 -412 -1096 1852 -38 382 -138 -1255 -177 194 192 990 -221 1134 1589 856 740 -88 -585 -240 1446 1790 1884 2598 1667 -1675 -508 1272 -299 1033 -90 -1365 -1558 -634 -1556 -1048 -739 -778 -949 -967 -481 746 1037 692 1078 691 679 820 516 549 752 940 1317 1234 661 211 -943 162 34 689 1571 150 -237 -429 -407 -21 -386 638 620 1080 1300 -275 -853 -1261 -2013 -1131 -1002 -1052 -483 -685 -186 -436 208 173 753 1898 1478 439 647 350 -618 -410 -325 -130 718 571 -993 -758 140 -874 46 113 -300 -257 -23 155 325 1039 784 694 268 -300 -646 -72 -229 157 848 417 957 1722 558 357 122 -164 15 494 -187 -315 0 -244 -443 -335 -100 -384 -157 -391 -734 -774 -1051 -58 266 234 598 381 -152 -394 643 -14 157 -63 -607 -86 95 95 500 -114 572 805 451 408 -50 -328 -125 690 818 872 1245 845 -878 -246 588 -151 587 -61 -1044 -1275 -529 -1334 -895 -626 -652 -778 -760 -363 548 783 548 884 587 587 716 455 483 651 811 1160 1147 653 217 -967 152 29 563 1331 143 -243 -457 -434 -22 -381 569 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