File name: Pandora159s1_Wakkerstroom_20231212_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240122T135520.2Z 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 v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20231212_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: 20231212 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 20231212T094518.6Z 8746.406465 5 1 54.62 2 4.62 22.47 6.07 279.93 0.00 1 0.00 1 0 17 9.844e-03 7.123e-03 9.833e-04 5.665e-04 1.334859e-01 2.833055e-04 1.451890e-03 -6.000000e+00 5.589837e-03 227.93 -2.00 3.06 -2.00 315.85 0.00e+00 4.623877e-05 2.860132e-05 1.903956e-05 -6.000000e+00 2.460449e-04 281.08 -2.00 20.00 -2.00 315.19 0.00e+00 1.003 0.000 302.00 328.00 3 2.5056e+00 7.3318e-04 1.0174e-02 -6.0000e+00 1.3904e-02 3.2175e-03 8.1850e-04 6.0512e-03 -6.0000e+00 1.5112e-02 6.4130e-03 4.6942e-04 2.9792e-03 -6.0000e+00 8.9916e-03 -4.5332e-03 2.1250e-04 8.3593e-04 -6.0000e+00 3.8096e-03 1.7466e-02 -1.4473e-04 1.6069e-05 1.0456e-05 -6.0000e+00 2.6327e-04 4.2426e-03 11 8 0 10 0 0 99.99 17.88 0.26 0.00424 0.00316 3570 768 2 8 0 13.720 15.14 17.88 27.34 20.46 20.46 31.3 907.14 -1286 -1500 -2692 -3014 -487 1107 1287 2123 537 -645 -90 2079 561 515 185 -1389 25 -21 326 356 -232 970 1461 407 717 -121 -668 -29 1344 2738 2173 2647 1030 -1725 -217 1052 -220 734 -244 -1502 -1736 -1053 -1341 -1314 -579 -1351 -881 -663 -395 602 964 585 1041 525 592 1232 573 542 845 1256 1415 1174 815 326 -999 257 43 1030 1757 123 -98 -447 -227 -91 -221 361 788 1073 1499 -253 -559 -1277 -1946 -697 -1060 -927 -643 -518 -406 -378 204 237 860 1887 1307 658 789 147 -729 -580 -241 -140 950 625 -955 -605 -510 -602 9 -5 -220 -248 -143 113 315 1158 615 643 175 -477 -620 -93 -135 113 931 465 1272 1540 563 355 128 -116 132 353 -217 -350 28 -86 -517 -106 -205 -302 -89 -362 -448 -806 -826 -114 242 296 543 153 -191 -25 575 170 174 69 -557 10 -8 134 151 -100 406 614 180 330 -58 -312 -12 525 1110 905 1154 438 -752 -95 443 -102 358 -143 -1021 -1271 -792 -1029 -1009 -437 -1017 -638 -458 -261 387 641 412 763 401 460 964 456 428 654 965 1121 996 743 311 -940 216 36 819 1472 107 -93 -444 -225 -87 -217 316 613 777 1112 -212 -522 -1308 -2117 -782 -1162 -1090 -796 -661 -517 -462 229 263 854 1770 1285 709 933 191 -914 -781 -302 -161 1042 720 -1217 -812 -713 -874 14 -8 -327 -368 -221 160 404 1374 730 799 235 -695 -935 -139 -196 156 1212 576 1475 1768 687 460 172 -158 181 500 -326 -555 46 -143 -871 -175 -328 -468 -136 SS 20231212T095203.2Z 8746.411148 8 1 53.54 2 4.29 2.86 7.51 277.25 0.00 1 0.00 1 0 17 9.384e-03 7.517e-03 1.433e-04 1.016e-04 1.341711e-01 5.157267e-05 1.462711e-03 -6.000000e+00 5.328667e-03 227.93 -2.00 3.06 -2.00 314.75 0.00e+00 7.047817e-05 4.239199e-06 2.005292e-05 -6.000000e+00 2.345493e-04 281.08 -2.00 20.00 -2.00 314.19 0.00e+00 1.003 0.000 302.00 328.00 3 3.2768e-01 1.3213e-04 1.0180e-02 -6.0000e+00 1.3254e-02 2.6069e-03 1.4679e-04 6.0637e-03 -6.0000e+00 1.4406e-02 3.4560e-04 8.3889e-05 2.9954e-03 -6.0000e+00 8.5715e-03 -1.6006e-03 3.6745e-05 8.4268e-04 -6.0000e+00 3.6316e-03 1.5441e-01 -2.8845e-04 2.8356e-06 1.1364e-05 -6.0000e+00 2.5096e-04 4.2324e-03 11 8 0 10 0 0 93.20 18.17 0.32 0.00423 0.00206 3616 778 2 8 0 13.560 15.12 18.17 28.64 20.77 20.67 29.6 907.96 -1262 -1363 -2370 -2990 -345 631 1469 1764 917 -901 89 1464 332 492 215 -1144 65 86 401 664 -55 1165 1462 566 617 23 -811 -92 1228 2313 1927 2428 1141 -1726 -214 600 -277 463 -284 -1529 -1635 -1051 -1265 -1231 -592 -1269 -984 -565 -573 746 780 613 945 564 522 1132 434 481 831 1115 1467 1069 855 255 -965 155 130 873 1653 87 -234 -449 -327 -145 -304 399 467 1018 1218 -382 -722 -1351 -2017 -831 -1093 -1012 -636 -604 -431 -417 305 169 958 1845 1263 642 743 151 -750 -447 -226 -76 877 688 -1003 -611 -578 -680 -49 -119 -259 -300 -61 161 480 1119 722 633 267 -512 -677 -173 -160 120 925 476 1245 1603 542 410 123 -18 96 381 -268 -402 -33 -155 -578 -207 -213 -412 -158 -478 -546 -950 -1102 -109 186 452 606 349 -358 34 545 135 222 107 -611 35 46 203 343 -29 650 820 306 348 14 -465 -53 640 1141 974 1284 645 -1003 -113 307 -155 276 -203 -1170 -1346 -889 -1092 -1062 -504 -1075 -803 -439 -461 584 632 486 780 485 457 998 390 428 724 966 1306 1020 876 255 -949 147 111 770 1417 85 -251 -466 -338 -156 -306 357 404 818 1004 -328 -691 -1418 -2088 -887 -1252 -1246 -770 -752 -536 -534 358 179 975 1773 1272 709 836 187 -985 -573 -270 -84 988 812 -1218 -782 -770 -878 -65 -167 -377 -435 -83 217 585 1268 879 750 343 -713 -911 -231 -223 159 1150 564 1485 1890 680 506 158 -23 126 515 -386 -569 -47 -230 -870 -304 -305 -571 -229 SS 20231212T100632.4Z 8746.421208 16 1 10.02 2 5.27 323.66 10.64 273.62 0.00 1 0.00 1 0 25 9.566e-03 7.941e-03 8.319e-04 6.512e-04 1.346762e-01 3.342124e-04 1.479825e-03 -6.000000e+00 5.432821e-03 227.93 -2.00 3.06 -2.00 314.15 0.00e+00 1.394911e-04 2.462589e-05 2.778602e-05 -6.000000e+00 2.391229e-04 281.08 -2.00 20.00 -2.00 313.67 0.00e+00 1.004 0.000 302.00 328.00 3 2.6552e+00 8.5212e-04 1.0213e-02 -6.0000e+00 1.3513e-02 1.7870e-02 9.4361e-04 6.1030e-03 -6.0000e+00 1.4687e-02 -6.7282e-04 5.4123e-04 3.0143e-03 -6.0000e+00 8.7385e-03 -1.3106e-03 2.3355e-04 8.5677e-04 -6.0000e+00 3.7032e-03 1.4954e-02 -3.0170e-04 1.8058e-05 1.2048e-05 -6.0000e+00 2.5582e-04 2.9544e-03 12 9 1 12 1 1 99.71 18.48 0.26 0.00295 0.00069 64 72 1 8 0 147.330 15.09 18.48 29.40 20.96 20.96 27.9 907.97 -1063 -1460 -2352 -2946 -189 656 1283 1827 802 -790 34 1583 366 597 473 -1129 37 -40 274 642 -93 1220 1472 470 554 -48 -940 -105 1284 2568 1919 2627 980 -1702 -330 776 -347 475 -113 -1603 -1651 -1125 -1412 -1318 -681 -1278 -943 -517 -503 762 909 703 884 521 469 1133 294 524 807 1118 1328 892 775 288 -993 205 183 851 1780 91 -294 -503 -361 -127 -392 433 487 1074 1322 -332 -705 -1289 -2055 -802 -1175 -1095 -696 -633 -442 -455 369 232 1052 1954 1297 662 733 127 -730 -505 -263 -10 870 662 -1021 -655 -542 -673 -129 -158 -256 -320 -74 139 551 1127 683 684 294 -590 -694 -241 -75 130 967 495 1266 1629 554 360 88 20 149 401 -247 -351 -93 -175 -586 -231 -212 -394 -233 -472 -689 -1110 -1278 -76 246 502 796 358 -368 15 690 174 315 256 -656 22 -24 164 394 -58 739 896 300 345 -31 -596 -65 726 1475 1052 1503 601 -1072 -190 429 -211 311 -83 -1371 -1429 -1002 -1282 -1197 -609 -1138 -808 -448 -417 614 758 620 766 470 431 1047 277 488 736 1013 1239 843 785 305 -1041 203 164 770 1591 88 -310 -524 -375 -135 -390 405 432 882 1113 -297 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