File name: Pandora159s1_Wakkerstroom_20240306_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240306T221728.4Z 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 v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20240306_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: 20240306 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 20240306T105253.9Z 8831.453401 7 1 54.13 2 24.17 333.48 56.80 254.75 0.00 1 0.00 1 0 17 9.414e-03 7.527e-03 1.505e-04 1.059e-04 1.250315e-01 5.364470e-05 1.368678e-03 -6.000000e+00 5.334385e-03 227.45 -2.00 3.06 -2.00 314.78 0.00e+00 8.625583e-04 4.433188e-06 8.149213e-05 -6.000000e+00 2.364237e-04 282.28 -2.00 20.00 -2.00 314.21 0.00e+00 1.096 0.000 302.00 328.00 3 3.1154e-01 1.3746e-04 1.0558e-02 -6.0000e+00 1.3248e-02 -1.2974e-02 1.5271e-04 5.8060e-03 -6.0000e+00 1.4404e-02 1.4405e-03 8.7290e-05 2.8030e-03 -6.0000e+00 8.5797e-03 -1.5954e-03 3.8310e-05 1.0407e-03 -6.0000e+00 3.6405e-03 1.4924e-01 -2.9561e-04 2.9645e-06 1.1640e-05 -6.0000e+00 2.5180e-04 8.2312e-03 11 8 0 10 0 0 99.07 20.31 0.32 0.00823 0.00601 3895 838 2 8 0 12.640 15.01 20.31 34.34 22.40 22.29 28.6 929.36 -1222 -1271 -2369 -2961 -233 667 1602 1761 870 -934 100 1455 283 522 197 -1169 101 89 397 671 -85 1145 1403 610 639 -24 -790 -103 1215 2358 1919 2435 1114 -1806 -211 544 -288 438 -279 -1529 -1643 -1052 -1305 -1236 -611 -1304 -988 -577 -526 801 823 620 953 520 507 1115 419 477 847 1114 1467 1065 831 197 -1035 141 95 947 1675 61 -213 -442 -280 -118 -318 374 394 1014 1207 -422 -761 -1394 -2053 -780 -1047 -953 -606 -554 -397 -381 358 219 1029 1889 1249 660 743 144 -780 -503 -245 -50 921 687 -1008 -580 -605 -673 4 -92 -242 -302 -80 129 484 1110 692 615 229 -553 -693 -191 -172 114 915 464 1277 1610 538 378 77 -18 88 384 -262 -412 3 -152 -564 -177 -224 -369 -99 -458 -503 -937 -1074 -72 213 483 592 322 -359 37 525 112 229 95 -608 52 47 213 368 -48 620 762 347 377 -15 -472 -57 609 1121 938 1245 608 -1011 -107 268 -156 275 -192 -1216 -1403 -851 -1079 -1023 -499 -1062 -840 -466 -407 602 641 512 818 464 460 1017 359 405 763 1001 1360 978 819 203 -1052 128 84 799 1493 57 -219 -473 -298 -122 -307 348 326 781 957 -378 -700 -1405 -2196 -860 -1241 -1126 -754 -710 -508 -469 434 240 1003 1889 1210 701 867 172 -984 -619 -303 -57 999 783 -1274 -716 -780 -900 6 -133 -339 -423 -113 167 610 1303 813 758 284 -745 -966 -264 -231 146 1185 572 1475 1843 656 487 103 -23 112 502 -366 -606 5 -235 -823 -271 -333 -533 -140 SS 20240306T105811.0Z 8831.457072 9 1 54.01 2 24.72 330.60 57.90 254.37 0.00 1 0.00 1 0 17 9.387e-03 7.091e-03 4.518e-04 2.858e-04 1.251274e-01 1.441012e-04 1.368366e-03 -6.000000e+00 5.319338e-03 227.45 -2.00 3.06 -2.00 315.38 0.00e+00 1.080983e-03 1.329274e-05 9.859410e-05 -6.000000e+00 2.357527e-04 282.28 -2.00 20.00 -2.00 314.75 0.00e+00 1.101 0.000 302.00 328.00 3 1.6495e+00 3.7088e-04 1.0605e-02 -6.0000e+00 1.3210e-02 -1.3598e-02 4.1313e-04 5.8941e-03 -6.0000e+00 1.4363e-02 3.3853e-03 2.3604e-04 2.8165e-03 -6.0000e+00 8.5554e-03 -2.5227e-03 1.0543e-04 1.1649e-03 -6.0000e+00 3.6304e-03 3.8933e-02 -2.2660e-04 8.0767e-06 1.2091e-05 -6.0000e+00 2.5107e-04 7.8881e-03 11 8 0 10 0 0 99.99 20.32 0.28 0.00789 0.00619 3478 748 2 8 0 14.160 15.01 20.32 34.71 22.40 22.29 28.9 932.82 -1238 -1199 -2495 -2836 -172 877 1806 1825 935 -1051 183 1379 377 389 316 -1284 146 18 392 666 -181 1151 1307 532 500 -26 -988 -19 1215 2489 1913 2499 1124 -1799 -106 545 -187 395 -217 -1620 -1602 -1100 -1236 -1321 -626 -1292 -985 -537 -573 791 773 692 868 543 479 1093 389 489 826 1147 1472 1104 907 198 -1000 77 115 851 1753 17 -158 -406 -238 -127 -298 336 320 953 1134 -423 -840 -1355 -2056 -732 -1069 -870 -532 -476 -315 -342 354 129 975 1765 1197 614 813 136 -736 -510 -257 -96 891 652 -1004 -566 -618 -634 -12 -53 -228 -205 -55 100 395 1053 586 541 205 -554 -686 -180 -168 31 846 360 1212 1522 518 332 45 -71 3 363 -286 -385 17 -84 -516 -119 -179 -355 -96 -403 -412 -860 -894 -46 221 473 533 301 -351 58 432 129 149 134 -583 66 8 183 319 -88 544 621 263 258 -14 -516 -9 531 1032 818 1117 536 -881 -47 235 -88 217 -143 -1118 -1185 -837 -960 -1028 -481 -991 -728 -415 -424 570 577 546 713 463 416 953 314 430 712 986 1306 956 843 193 -957 72 98 689 1495 16 -153 -409 -239 -123 -298 299 254 703 862 -363 -803 -1417 -2075 -761 -1195 -1044 -673 -619 -410 -428 405 146 987 1693 1206 678 894 165 -944 -638 -299 -114 1003 772 -1198 -710 -809 -862 -17 -79 -349 -312 -79 132 518 1283 715 693 258 -758 -972 -253 -229 41 1138 462 1454 1811 656 445 63 -100 5 531 -405 -575 25 -131 -820 -185 -270 -521 -137 SS 20240306T111415.5Z 8831.468235 17 1 54.16 2 26.69 322.56 61.22 253.21 0.00 1 0.00 1 0 17 9.420e-03 7.574e-03 1.433e-04 1.017e-04 1.279035e-01 5.172995e-05 1.403359e-03 -6.000000e+00 5.337730e-03 227.45 -2.00 3.06 -2.00 314.77 0.00e+00 8.204437e-04 4.263709e-06 8.231404e-05 -6.000000e+00 2.365682e-04 282.28 -2.00 20.00 -2.00 314.19 0.00e+00 1.119 0.000 302.00 328.00 3 2.5079e-01 1.3239e-04 1.0789e-02 -6.0000e+00 1.3256e-02 -8.0533e-03 1.4705e-04 5.9288e-03 -6.0000e+00 1.4413e-02 5.3275e-04 8.4195e-05 2.8711e-03 -6.0000e+00 8.5850e-03 -1.4856e-03 3.6887e-05 1.0430e-03 -6.0000e+00 3.6429e-03 1.5451e-01 -2.9312e-04 2.8454e-06 1.1967e-05 -6.0000e+00 2.5194e-04 7.9275e-03 11 8 0 10 0 0 99.78 20.35 0.31 0.00793 0.00572 3444 741 2 8 0 14.300 15.01 20.35 34.23 22.40 22.29 28.5 928.24 -1220 -1286 -2348 -2903 -206 688 1635 1740 881 -981 96 1471 239 445 211 -1123 156 145 453 657 -56 1187 1414 584 586 5 -833 -36 1250 2413 1924 2464 1125 -1821 -189 537 -291 399 -280 -1537 -1614 -1027 -1269 -1230 -591 -1277 -980 -541 -521 804 814 625 949 544 525 1121 422 474 854 1103 1456 1036 838 189 -1028 162 124 943 1695 57 -229 -437 -295 -128 -325 389 386 1031 1198 -431 -760 -1398 -2036 -805 -1068 -938 -605 -544 -378 -392 357 188 1037 1869 1252 646 746 161 -757 -482 -223 -59 908 667 -1034 -613 -647 -680 -58 -111 -258 -324 -85 137 488 1124 716 616 256 -560 -684 -209 -172 102 918 456 1305 1602 541 373 96 -18 84 392 -277 -415 -7 -146 -591 -189 -217 -387 -123 -472 -526 -960 -1087 -66 206 510 605 338 -391 37 550 98 203 106 -556 77 73 231 344 -30 613 733 317 330 3 -476 -21 652 1195 980 1313 640 -1064 -101 277 -164 240 -201 -1178 -1329 -868 -1096 -1064 -505 -1087 -804 -422 -422 633 664 498 787 469 460 989 379 422 744 959 1305 998 803 190 -1016 154 106 771 1463 57 -229 -455 -307 -128 -328 350 336 834 997 -374 -734 -1480 -2124 -866 -1235 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