File name: Pandora159s1_Wakkerstroom_20210120_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T024443.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes 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_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210120_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: 20210120 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 20210120T035057.3Z 7690.160386 31 1 48.64 2 85.02 110.05 157.25 166.78 0.00 1 0.00 1 0 33 1.235e+00 1.614e-01 5.558e-01 1.067e-01 7.476103e-01 6.419587e-02 8.032901e-03 -6.000000e+00 7.623727e-01 227.62 -2.00 3.06 -2.00 321.33 0.00e+00 1.462834e-02 1.918316e-02 7.336336e-04 -6.000000e+00 4.066121e-02 282.59 -2.00 20.00 -2.00 320.63 0.00e+00 9.882 0.006 302.00 328.00 3 2.4478e+00 1.9270e-01 8.8465e-02 -6.0000e+00 1.8851e+00 1.6634e+00 2.2702e-01 4.6834e-02 -6.0000e+00 2.0762e+00 -1.6834e+00 1.3121e-01 1.6382e-02 -6.0000e+00 1.2285e+00 5.8557e-01 7.2039e-02 1.3899e-02 -6.0000e+00 5.1713e-01 5.0410e-06 6.2957e-05 3.2536e-03 1.6086e-04 -6.0000e+00 3.7619e-02 6.0576e-03 12 8 8 10 0 0 -86.92 18.56 1.51 0.00606 0.00653 12 3 4 8 0 4000.000 15.00 18.56 17.21 20.67 21.48 14.8 895.35 137360 9657 900000 900000 900000 235659 900000 84773 -108347 -63970 449663 900000 -21572 900000 -79260 900000 201759 900000 -17045 900000 900000 -16868 900000 33938 900000 -27585 900000 -19500 900000 242137 900000 86039 -61110 4 900000 -32882 -64911 900000 38511 900000 23255 900000 900000 900000 -28339 26026 30449 -24670 900000 900000 900000 53544 900000 131835 634732 4195 900000 625609 218493 -60261 105066 900000 21146 900000 -6052 223704 18820 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-12921 16615 -8876 -740 -25445 7553 3498 -7459 3305 -5382 -8323 3775 6395 -9872 13492 -22697 900000 -24319 24899 -8406 -10294 -3992 10710 4051 -11291 15462 5242 -3433 -7285 16127 -15937 10024 -2023 10775 6141 91 15388 11836 8716 10720 19627 -1597 15089 -9248 -10380 -8886 14981 1319 -21063 6345 -4164 3833 -5036 SS 20210120T040512.7Z 7690.170285 34 1 49.33 2 82.03 108.53 156.39 158.40 0.00 1 0.00 1 0 25 5.260e-01 1.601e-02 3.195e-01 8.571e-03 7.051322e-01 4.742008e-03 6.824228e-03 -6.000000e+00 3.011561e-01 227.62 -2.00 3.06 -2.00 321.72 0.00e+00 4.170378e-03 2.581009e-03 1.873376e-03 -6.000000e+00 1.457993e-02 282.59 -2.00 20.00 -2.00 321.19 0.00e+00 6.753 0.002 302.00 328.00 3 2.1669e+00 1.7552e-02 6.5430e-02 -6.0000e+00 7.4786e-01 1.9391e-01 2.4939e-02 3.9593e-02 -6.0000e+00 8.1427e-01 -3.0896e-01 2.5308e-02 1.7810e-02 -6.0000e+00 4.8543e-01 1.2288e-01 1.1730e-02 7.6116e-03 -6.0000e+00 2.0643e-01 1.2485e-04 -1.1592e-03 2.4705e-04 7.4882e-05 -6.0000e+00 1.4224e-02 5.4340e-03 12 8 8 10 0 0 10.60 18.56 0.38 0.00543 -0.00328 57 12 4 8 0 865.070 15.00 18.56 18.63 20.67 21.48 14.8 903.93 -216815 900000 5013 49625 -237569 -109764 -210629 -196383 -115245 -199512 900000 -170783 119182 -145619 -33067 -42965 900000 -6857 -13489 -64277 -66796 92850 -52087 64463 -7919 900000 -26412 -17505 -20253 9120 -7405 9926 29502 20377 -364 -35097 57113 -17286 29958 -31663 67175 -13387 30064 -1655 29560 -3106 14799 14842 1803 15496 -9932 16527 6852 23932 2757 9572 5850 10889 5592 -2268 6802 -3084 19467 4289 5796 3431 6907 -1764 10859 1999 6141 1551 4314 -2642 1446 8246 -7681 8720 -6137 7795 -1013 293 -3956 1512 -769 391 292 -561 1326 -331 3021 -2547 2628 -3377 1694 -1875 41 -1900 -621 -754 -544 322 -46 175 -3384 670 -4755 -217 -1116 165 -1672 -145 -814 16 190 1670 1996 513 -18 -1219 312 96 1154 -587 2065 480 1825 2855 648 302 -429 1172 -392 1306 -679 246 -963 149 -428 -253 -189 -405 127 -3219 900000 42 414 -4740 -917 -3419 -3126 -963 -3899 900000 -3041 995 -3396 -324 -559 900000 -78 -178 -1448 -1568 775 -1113 538 -127 900000 -539 -318 -377 142 -162 222 630 507 -11 -1416 1048 -768 1039 -2331 2147 -992 1544 -118 1588 -233 973 1017 146 1182 -1094 1572 791 2532 375 1292 826 1477 774 -334 947 -517 3047 869 1223 729 1403 -407 2468 574 1862 512 1362 -840 400 1946 -1963 1981 -1808 2397 -401 131 -1994 781 -426 228 180 -358 841 -206 1692 -1415 1341 -1912 1035 -1389 34 -1853 -653 -796 -536 286 -37 144 -3096 624 -4939 -232 -1304 216 -2484 -226 -1284 25 273 2268 2728 748 -28 -1995 497 147 1709 -856 2830 645 2339 3804 1007 527 -832 2388 -854 2987 -1669 631 -2551 396 -1141 -646 -459 -924 279 SS 20210120T041138.0Z 7690.174745 37 1 49.93 2 80.68 107.86 155.87 154.84 0.00 1 0.00 1 0 25 3.115e-01 7.924e-03 2.509e-01 4.066e-03 6.362843e-01 2.188260e-03 6.229258e-03 -6.000000e+00 1.777782e-01 227.62 -2.00 3.06 -2.00 321.32 0.00e+00 2.997309e-03 1.087455e-03 1.958967e-03 -6.000000e+00 7.971822e-03 282.59 -2.00 20.00 -2.00 320.75 0.00e+00 5.878 0.001 302.00 328.00 3 1.8582e+00 7.5897e-03 5.7438e-02 -6.0000e+00 4.4240e-01 2.4840e-02 1.0616e-02 3.5133e-02 -6.0000e+00 4.8120e-01 -4.6426e-02 1.1029e-02 1.5787e-02 -6.0000e+00 2.8545e-01 7.2231e-03 5.2288e-03 6.7234e-03 -6.0000e+00 1.2097e-01 3.6214e-04 -8.3477e-04 1.1706e-04 5.8956e-05 -6.0000e+00 8.5783e-03 5.6898e-03 11 8 0 10 0 0 86.43 18.56 0.42 0.00569 -0.00058 113 24 4 8 0 437.920 15.00 18.56 19.28 20.67 21.48 14.9 907.29 -85278 51506 -114361 900000 -129917 -49368 -165264 900000 -81765 -85382 30596 -105422 29078 -115963 -44463 -75808 4379 -52164 27798 22601 -2218 19646 -10986 -6065 -27676 22946 -43421 -10183 -54441 4209 -19957 -2398 -12875 14162 -7957 4740 -3236 -3247 -1078 -9637 8506 -9683 1939 993 8908 -2727 3856 1922 3502 5961 -2622 7666 -2935 3028 -2601 2117 249 2793 -2010 5171 2458 2770 2047 1033 2304 494 3348 1097 4019 469 916 -1023 383 -108 1780 1725 267 2510 -1435 1612 -1300 -551 -3079 -499 -1876 -345 -317 -253 171 -568 679 -277 2150 481 1503 -303 926 198 -608 -13 143 235 1040 671 -2433 -218 -998 -474 -1149 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