File name: Pandora159s1_Wakkerstroom_20220111_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035241.8Z 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_20220111_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: 20220111 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 20220111T053021.8Z 8046.229419 93 1 16.57 2 62.41 101.62 163.40 153.21 0.00 1 0.00 1 0 25 1.283e-02 7.736e-03 8.925e-03 3.049e-03 2.555226e-01 1.525277e-03 2.713586e-03 -6.000000e+00 7.286562e-03 227.65 -2.00 3.06 -2.00 317.19 0.00e+00 7.498519e-04 2.135938e-04 5.851760e-05 -6.000000e+00 3.225446e-04 282.36 -2.00 20.00 -2.00 316.46 0.00e+00 2.148 0.000 302.00 328.00 3 4.6182e+00 4.0185e-03 2.0913e-02 -6.0000e+00 1.8104e-02 3.6096e-02 4.5219e-03 1.1579e-02 -6.0000e+00 1.9667e-02 -6.6947e-03 2.7002e-03 5.6770e-03 -6.0000e+00 1.1714e-02 -4.6021e-03 1.3242e-03 1.6906e-03 -6.0000e+00 4.9803e-03 6.6044e-04 -5.6900e-04 8.6485e-05 1.8619e-05 -6.0000e+00 3.4289e-04 -6.5144e-03 12 9 1 12 1 1 78.71 19.41 0.39 -0.00651 -0.01079 7 5 1 8 0 2049.140 14.99 19.41 25.01 21.69 21.69 19.7 914.23 -4224 -682 -3935 1841 -3665 -2579 -4049 3768 286 -1209 -3750 -359 -2183 -1460 67 -1140 -398 45 105 -210 1176 484 1277 -124 832 553 -241 -478 -1093 2010 213 3165 2176 -646 -1393 801 -1282 875 969 -1259 -1605 -822 -1285 -1203 -1384 -1515 814 -1276 700 91 1816 616 1605 70 960 1891 167 906 987 1763 1492 1239 63 626 -833 -101 576 746 1853 -255 11 307 -288 -456 -20 171 113 864 710 -936 -317 -1219 -2694 -593 -1201 -304 -1007 -450 -846 -271 -54 367 443 1715 1382 223 375 241 -428 -311 -574 -535 604 230 -1413 -746 2375 -963 -206 140 21 -189 -86 234 227 1412 629 592 423 -991 -663 -274 -499 110 868 315 880 1286 704 85 279 57 55 145 -442 -400 83 151 -669 22 -32 -380 -91 -524 -89 -539 225 -424 -281 -472 458 40 -177 -558 -53 -364 -277 14 -266 -96 11 27 -56 317 130 347 -36 250 172 -75 -141 -307 542 61 953 710 -221 -455 250 -438 337 438 -660 -910 -482 -774 -731 -840 -919 478 -748 397 52 1065 389 1052 48 675 1339 122 655 702 1239 1078 951 52 541 -729 -83 439 555 1440 -223 11 296 -278 -429 -18 141 85 621 528 -776 -286 -1200 -2813 -633 -1347 -357 -1240 -565 -1067 -332 -62 396 446 1664 1400 246 446 309 -575 -414 -732 -641 688 269 -1776 -976 3132 -1341 -295 210 32 -298 -133 342 312 1836 818 797 598 -1481 -1005 -412 -737 157 1198 421 1129 1644 948 121 411 86 83 225 -717 -673 142 261 -1170 37 -53 -624 -147 SS 20220111T054945.5Z 8046.242888 103 1 6.00 2 58.18 99.85 161.18 140.15 0.00 1 0.00 1 0 25 1.166e-02 7.754e-03 5.330e-03 2.661e-03 2.236650e-01 1.339434e-03 2.406649e-03 -6.000000e+00 6.623535e-03 227.65 -2.00 3.06 -2.00 316.15 0.00e+00 3.283949e-04 1.466337e-04 6.299046e-05 -6.000000e+00 2.931863e-04 282.36 -2.00 20.00 -2.00 315.47 0.00e+00 1.890 0.000 302.00 328.00 3 3.8703e+00 3.4761e-03 1.8371e-02 -6.0000e+00 1.6457e-02 1.2700e-02 3.8870e-03 1.0118e-02 -6.0000e+00 1.7877e-02 -3.5238e-03 2.2455e-03 4.9702e-03 -6.0000e+00 1.0648e-02 -1.8425e-03 1.0453e-03 1.4231e-03 -6.0000e+00 4.5273e-03 1.8313e-03 -4.5729e-04 7.4631e-05 1.7199e-05 -6.0000e+00 3.1167e-04 -6.8193e-03 12 9 1 12 1 1 6.14 19.41 0.34 -0.00682 -0.01026 6 13 1 8 0 831.120 14.99 19.41 25.68 21.69 21.58 19.7 916.45 -2217 199 -3799 -2112 -2412 2467 -2334 2244 778 -1251 -1283 1200 3048 -1290 94 -1638 416 -1691 1618 -621 -102 543 1270 121 261 108 -1234 296 976 3830 1385 3771 2011 -1015 -1273 1282 -295 589 -366 -1612 -1574 -578 -480 -1457 -186 -1437 -775 -1263 -360 945 994 509 184 822 33 1739 321 903 238 1526 1282 1023 1019 22 -665 351 341 543 2108 -130 -221 -624 -307 -385 -142 -34 823 1054 1068 13 -556 -1370 -2381 -636 -1462 -643 -777 -595 -479 -44 314 334 1018 1253 1449 693 1046 219 -635 -756 107 -288 726 751 -1344 -675 -509 -878 -53 155 -443 7 -316 270 -150 1162 644 517 258 -510 -765 -167 -290 -35 1006 513 1180 1692 967 76 274 -66 282 535 -305 -365 -121 -18 -536 -378 -241 -313 -143 -448 42 -849 -438 -452 422 -437 450 174 -294 -298 275 752 -369 29 -558 144 -610 584 -235 -39 205 483 48 109 46 -532 120 373 1399 535 1518 868 -455 -544 525 -130 291 -209 -1034 -1077 -405 -342 -1050 -133 -1035 -545 -875 -243 631 686 370 139 640 27 1390 262 734 192 1215 1043 874 918 21 -628 311 287 444 1778 -121 -218 -635 -312 -383 -135 -30 677 831 864 11 -531 -1397 -2549 -693 -1667 -763 -958 -746 -602 -54 367 368 1051 1263 1505 768 1233 276 -835 -987 134 -343 830 876 -1672 -870 -672 -1192 -74 223 -659 10 -462 377 -199 1469 814 671 351 -725 -1109 -240 -411 -49 1341 667 1478 2103 1254 104 383 -93 404 782 -462 -572 -192 -30 -869 -608 -378 -482 -217 SS 20220111T055455.3Z 8046.246474 106 1 15.83 2 57.05 99.38 160.47 137.18 0.00 1 0.00 1 0 25 9.669e-03 7.194e-03 1.887e-03 9.203e-04 2.141970e-01 4.630616e-04 2.291519e-03 -6.000000e+00 5.493524e-03 227.65 -2.00 3.06 -2.00 316.23 0.00e+00 4.081016e-04 5.163647e-05 5.568174e-05 -6.000000e+00 2.431666e-04 282.36 -2.00 20.00 -2.00 315.55 0.00e+00 1.833 0.000 302.00 328.00 3 2.8675e+00 1.2033e-03 1.7732e-02 -6.0000e+00 1.3649e-02 1.1892e-03 1.3462e-03 9.6742e-03 -6.0000e+00 1.4827e-02 -1.4162e-04 7.7925e-04 4.7502e-03 -6.0000e+00 8.8311e-03 -2.1548e-03 3.6293e-04 1.3744e-03 -6.0000e+00 3.7549e-03 5.3364e-03 -3.5082e-04 2.5961e-05 1.6164e-05 -6.0000e+00 2.5850e-04 -6.8444e-03 12 9 1 12 1 1 99.10 19.41 0.31 -0.00684 -0.00948 56 39 1 8 0 274.230 15.00 19.41 25.62 21.69 21.69 19.6 916.19 -1668 -1477 -3159 -3433 -565 -89 -9 1869 -256 -924 -458 859 35 87 71 -1294 36 83 399 840 369 594 1796 28 844 309 -615 -472 1090 2293 2044 2521 1410 -1338 -720 446 -424 611 -197 -1323 -1671 -957 -1214 -1262 -486 -1276 -898 -571 -686 521 918 481 831 722 522 1257 418 580 764 1047 1605 1362 841 601 -983 84 148 839 1837 89 -317 -273 -398 -162 -223 336 532 950 1203 -510 -828 -1228 -2118 -1031 -1003 -936 -582 -631 -361 -377 194 283 696 1881 1410 689 792 297 -669 -434 -290 -276 739 714 -1005 -722 -466 -657 -160 -42 -328 -316 -164 186 320 1178 726 555 215 -451 -869 -9 -147 15 821 524 1143 1768 466 292 129 -85 97 374 -202 -495 111 -25 -561 -214 -216 -441 -40 -331 -317 -698 -707 -100 -15 -2 362 -56 -213 -103 193 9 25 23 -419 12 28 140 302 136 216 652 11 342 130 -259 -186 393 864 737 974 591 -587 -294 175 -181 302 -109 -856 -1097 -651 -849 -889 -339 -891 -610 -404 -471 352 647 338 613 558 415 1011 345 475 612 831 1305 1189 746 566 -934 73 125 679 1562 82 -319 -286 -418 -164 -211 304 431 721 943 -456 -776 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