File name: Pandora159s1_Wakkerstroom_20240115_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240116T084621.1Z 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_20240115_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: 20240115 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 20240115T035836.8Z 8780.165704 51 1 49.37 2 82.51 110.06 130.32 130.13 0.00 1 0.00 1 0 25 6.474e-01 1.425e-02 3.807e-01 8.817e-03 7.803810e-01 4.950916e-03 7.577809e-03 -6.000000e+00 3.708315e-01 227.62 -2.00 3.06 -2.00 321.88 0.00e+00 1.742143e-02 2.817215e-03 5.630103e-03 -6.000000e+00 1.710529e-02 282.52 -2.00 20.00 -2.00 321.38 0.00e+00 7.127 0.002 302.00 328.00 3 1.7685e+00 1.8809e-02 8.4647e-02 -6.0000e+00 9.2168e-01 3.4356e-01 2.8308e-02 8.1842e-02 -6.0000e+00 1.0036e+00 -3.5200e-01 3.0199e-02 2.0579e-02 -6.0000e+00 5.9416e-01 1.2636e-01 1.3738e-02 2.1769e-02 -6.0000e+00 2.5115e-01 1.1460e-04 -2.0522e-03 2.4406e-04 1.6255e-04 -6.0000e+00 1.7456e-02 1.1216e-02 12 9 8 11 8 0 89.05 20.02 0.45 0.01122 -0.00421 52 11 4 8 0 949.290 15.00 20.02 21.03 22.19 21.98 27.4 865.32 -275884 -245038 -211229 -172188 -114433 900000 -161616 -200716 900000 -125259 -206417 -108976 -158533 900000 -151453 127085 -90441 87001 -54550 151291 -51629 -73622 -43578 -27528 900000 -96098 -51113 -113602 -52038 -11071 900000 115055 137089 -18262 31254 20314 40555 2935 -15705 35810 -6688 29534 15434 2406 47505 28307 34350 16949 7080 5770 14748 13894 16572 8501 971 -5456 9322 -6538 185 -3 -4370 -396 19980 892 -3560 8776 334 6153 15028 6021 -120 5382 2765 1043 2261 2521 5472 5620 2390 -3654 3111 -1029 1567 -1850 419 -4128 -349 -382 -79 1562 2609 274 3245 -308 -201 -553 -1061 -947 -2597 -820 983 264 87 2580 -2626 -2363 6112 -2857 -1510 -499 -2103 -966 146 -266 -255 1475 1771 -21 244 -689 -368 795 -104 377 358 938 391 1628 -6 794 550 685 -174 287 433 -444 471 -473 -619 -309 261 -629 112 -4140 -3308 -2245 -1479 -983 900000 -1388 -1735 900000 -1076 -2143 -936 -1735 900000 -2927 1092 -1426 747 -755 1300 -742 -1277 -568 -315 900000 -2215 -776 -3173 -854 -144 900000 988 1178 -517 526 374 665 80 -614 988 -308 1037 665 123 1648 1245 1502 930 457 412 1083 1153 1474 881 113 -693 1037 -833 22 0 -560 -55 2656 163 -731 1594 66 1197 2968 1491 -35 1518 781 280 545 546 1091 1173 596 -1172 1101 -436 706 -913 215 -2349 -201 -226 -47 872 1353 137 1525 -158 -119 -386 -874 -899 -2739 -854 947 228 69 1971 -2252 -2138 5406 -2969 -1715 -637 -3051 -1484 224 -402 -366 2020 2449 -31 380 -1117 -581 1188 -150 528 487 1224 500 2167 -10 1398 1073 1426 -384 673 1081 -1167 1251 -1284 -1675 -801 631 -1434 244 SS 20240115T040459.3Z 8780.170131 54 1 49.59 2 81.18 109.40 129.29 128.69 0.00 1 0.00 1 0 25 3.809e-01 7.903e-03 2.438e-01 3.833e-03 6.895488e-01 2.094773e-03 6.711338e-03 -6.000000e+00 2.187602e-01 227.62 -2.00 3.06 -2.00 321.50 0.00e+00 9.132630e-03 1.096885e-03 2.188007e-03 -6.000000e+00 1.042939e-02 282.52 -2.00 20.00 -2.00 320.96 0.00e+00 6.177 0.001 302.00 328.00 3 1.5165e+00 7.4579e-03 6.2729e-02 -6.0000e+00 5.4506e-01 8.8703e-02 1.0888e-02 4.3441e-02 -6.0000e+00 5.9369e-01 -7.4943e-02 1.1734e-02 1.8051e-02 -6.0000e+00 3.4985e-01 1.9356e-02 5.4737e-03 1.3159e-02 -6.0000e+00 1.4787e-01 3.6318e-04 -1.3405e-03 1.0775e-04 9.9316e-05 -6.0000e+00 1.0476e-02 1.0784e-02 11 9 0 11 8 0 65.78 20.02 0.42 0.01078 0.00071 105 23 4 8 0 469.890 14.99 20.02 21.49 22.19 22.09 27.5 867.94 -131928 -141092 44303 -134332 900000 -216503 900000 -191014 900000 -99908 900000 -114475 45064 -88320 -31274 -327 -47887 21336 -43463 -5766 -38550 63118 -44872 4316 -24600 -6743 -8526 -4569 -32256 -17062 -874 -2159 41073 -13420 7493 11927 7371 -221 9502 -14240 -2049 2473 2372 -2467 -1610 2656 -7773 2431 -886 4484 -2125 3415 2775 4544 257 -354 -1842 -2608 598 -2775 2804 -177 3071 2942 1417 988 2581 2652 2439 1335 656 1149 279 848 -454 -819 -1913 3924 616 571 -792 -478 -2970 -574 -1302 -1484 128 -250 15 0 2191 263 2249 1550 1268 924 117 946 -737 -288 -142 154 433 1083 -1406 -389 -3988 -534 230 -483 -676 -182 -81 128 890 1056 854 214 48 -674 -436 -46 180 -200 206 614 1194 1748 -83 438 -214 400 -248 501 -463 -414 136 -172 -479 -142 6 -10 556 -508 -716 165 -685 900000 -2260 900000 -1864 900000 -473 900000 -788 168 -847 -225 -2 -573 147 -618 -61 -571 349 -735 47 -379 -92 -120 -62 -589 -305 -17 -50 741 -436 193 293 210 -8 383 -847 -121 152 155 -176 -118 194 -652 195 -78 404 -229 392 351 614 38 -55 -298 -421 91 -438 440 -32 615 670 347 239 608 650 666 426 230 416 101 285 -142 -231 -515 1036 191 212 -348 -238 -1650 -332 -804 -978 88 -175 10 0 1348 156 1264 915 848 717 106 970 -828 -323 -149 145 374 939 -1336 -387 -4316 -600 281 -664 -1028 -289 -130 198 1295 1481 1213 320 76 -1111 -706 -71 269 -293 291 835 1559 2388 -130 767 -409 806 -527 1116 -1104 -1031 344 -442 -1229 -351 14 -22 1191 SS 20240115T041841.6Z 8780.179648 59 1 51.30 2 78.30 108.00 127.02 125.75 0.00 1 0.00 1 0 25 1.267e-01 5.990e-03 5.123e-02 1.387e-03 5.495235e-01 7.204335e-04 5.505872e-03 -6.000000e+00 7.179568e-02 227.62 -2.00 3.06 -2.00 320.68 0.00e+00 7.216884e-03 2.919124e-04 1.621575e-03 -6.000000e+00 3.183545e-03 282.53 -2.00 20.00 -2.00 320.06 0.00e+00 4.779 0.001 302.00 328.00 3 1.1513e+00 2.2553e-03 4.8130e-02 -6.0000e+00 1.7836e-01 5.6714e-02 2.9019e-03 3.2118e-02 -6.0000e+00 1.9391e-01 -3.4711e-02 2.7820e-03 1.3611e-02 -6.0000e+00 1.1550e-01 2.8277e-03 1.3854e-03 1.0179e-02 -6.0000e+00 4.8989e-02 1.7856e-03 -9.4239e-04 3.9396e-05 6.7920e-05 -6.0000e+00 3.3880e-03 1.0001e-02 10 0 0 10 0 0 23.26 20.02 0.29 0.01000 0.00292 287 62 2 8 0 172.130 14.99 20.02 22.76 22.19 21.98 27.6 874.85 -25455 -62981 -32011 -28803 -41336 -54245 -33344 -46534 -58598 -14387 -46762 -21028 -18512 -75 -17357 -3045 -2706 -3199 -6608 -2816 -4103 -1466 -704 -6071 -106 -10321 -5839 -7799 1451 -2127 -130 2118 3218 -334 -2142 413 -4826 -1360 -3933 -808 -3762 -2951 -2745 -76 -272 -1078 202 371 391 -56 2498 1329 2124 799 2205 213 264 -230 779 703 1367 1029 918 816 -450 1494 602 1578 1931 490 102 -124 -52 -193 -463 278 290 507 891 -578 -339 -1304 -1793 -1249 -1160 -943 -579 -448 -36 354 1267 1064 1453 1843 1089 865 712 366 -572 -157 -100 90 1020 387 -1380 -906 -658 -751 -23 -314 -290 -295 21 256 398 1196 630 262 -303 -891 -935 -196 -212 -186 473 239 1268 1692 364 185 117 79 158 226 -248 -372 139 -209 -436 -124 64 -33 285 -156 -645 -261 -221 -330 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