File name: Pandora159s1_Wakkerstroom_20201203_L2Fit_fwvt1c6d20191220p1-8.txt File generation date: 20240926T171756.9Z Data description: Level 2 spectral fitting results file Data file version: fwvt1c6p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v6d20191220.txt Level 1 file used: Pandora159s1_Wakkerstroom_20201203_L1_smca1c6d20191220p1-8.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: 20201203 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: Update session 4 based on session2 for SO2 First and last pixel inside fitting window: 1645 1794 Nominal wavelengths inside fitting window [nm]: 492.0904 492.2112 492.3321 492.4529 492.5737 492.6945 492.8153 492.9361 493.0568 493.1775 493.2982 493.4189 493.5396 493.6603 493.7809 493.9015 494.0221 494.1427 494.2633 494.3839 494.5044 494.6249 494.7454 494.8659 494.9864 495.1069 495.2273 495.3477 495.4681 495.5885 495.7089 495.8293 495.9496 496.0699 496.1902 496.3105 496.4308 496.5510 496.6713 496.7915 496.9117 497.0319 497.1521 497.2722 497.3924 497.5125 497.6326 497.7527 497.8727 497.9928 498.1128 498.2328 498.3528 498.4728 498.5928 498.7127 498.8327 498.9526 499.0725 499.1924 499.3122 499.4321 499.5519 499.6717 499.7915 499.9113 500.0310 500.1508 500.2705 500.3902 500.5099 500.6296 500.7492 500.8689 500.9885 501.1081 501.2277 501.3473 501.4668 501.5864 501.7059 501.8254 501.9449 502.0643 502.1838 502.3032 502.4226 502.5420 502.6614 502.7808 502.9001 503.0194 503.1388 503.2580 503.3773 503.4966 503.6158 503.7350 503.8543 503.9734 504.0926 504.2118 504.3309 504.4500 504.5691 504.6882 504.8073 504.9263 505.0454 505.1644 505.2834 505.4023 505.5213 505.6402 505.7592 505.8781 505.9970 506.1158 506.2347 506.3535 506.4724 506.5912 506.7099 506.8287 506.9475 507.0662 507.1849 507.3036 507.4223 507.5409 507.6596 507.7782 507.8968 508.0154 508.1340 508.2525 508.3711 508.4896 508.6081 508.7266 508.8450 508.9635 509.0819 509.2003 509.3187 509.4371 509.5555 509.6738 509.7921 509.9104 --------------------------------------------------------------------------------------- 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: Water vapor slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor 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: Water vapor effective temperature [K] Column 28: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for water vapor [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Nitrogen dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen 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: Nitrogen dioxide effective temperature [K] Column 39: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for nitrogen dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 45: 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 46: 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 47: 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 48: 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 49: Ozone effective temperature [K] Column 50: 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 51: 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 52: 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 53: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 54: 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 55: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 56: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 57: Lower limit used for wavelength scaling [nm] Column 58: Upper limit used for wavelength scaling [nm] Column 59: Order of smoothing polynomial Column 60: Smoothing polynomial coefficient, order 0 Column 61: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 62: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 63: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 64: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 65: Smoothing polynomial coefficient, order 1 Column 66: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 67: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 68: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 69: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 70: Mean value of measured data inside fitting window [same units as measurements] Column 71: Wavelength change polynomial coefficient, order 0 Column 72: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 76: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 77: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 78: 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 79: 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 80: 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 81: 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 82: 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 83: 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 84: Atmospheric variability [%], 999=no atmospheric variability was determined Column 85: Wavelength effective temperature [°C], 999=no effective temperature given Column 86: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 87: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 88: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 89: Number of bright count cycles Column 90: Number of dark count cycles Column 91: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 92: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 93: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 94: Integration time [ms] Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Temperature at electronics board 1 [°C], 999=no temperature signal Column 99: Temperature at electronics board 2 [°C], 999=no temperature signal Column 100: Humidity in head sensor [%], -9=no humidity signal Column 101: Pressure in head sensor [hPa], -9=no pressure signal Columns 102-251: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 252-401: 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 --------------------------------------------------------------------------------------- SQ 20201203T052907.9Z 7642.228564 240 1 41.84 2 58.65 100.50 94.06 296.47 0.00 1 0.00 1 0 15 2.249e-03 2.223e-03 7.528e-04 7.496e-04 1.486145e+03 4.133517e+01 1.151811e+02 -6.000000e+00 1.166550e+02 280.71 -2.00 20.00 -2.00 505.24 0.00e+00 5.848969e-04 1.999204e-05 3.358085e-05 -6.000000e+00 6.137978e-05 280.71 -2.00 20.00 -2.00 500.33 0.00e+00 1.498181e-01 1.453191e-02 1.094072e-02 -6.000000e+00 4.350681e-02 228.03 -2.00 3.06 -2.00 501.93 0.00e+00 1.915 0.000 489.00 513.00 1 6.2947e+00 1.1098e-03 2.5433e-03 -6.0000e+00 3.3191e-03 7.4383e-03 2.9426e-04 2.8309e-04 -6.0000e+00 8.8252e-04 2.8397e-03 1.7590e-04 5.9083e-05 1.6939e-05 -6.0000e+00 1.8107e-04 8.6086e-03 -3.1581e-05 12 1 1 12 1 1 99.98 18.73 1.93 0.00861 0.00983 63 16 1 2 0 651.070 15.00 18.73 18.08 21.17 21.06 13.1 903.57 -724 -346 -190 160 380 172 356 223 427 265 334 -31 -226 -210 -247 -219 -169 23 -55 157 63 38 202 155 260 173 275 49 -21 -287 -129 -181 -94 -149 249 316 -13 -140 -51 -271 -146 63 10 127 191 220 161 235 -102 -94 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71 142 58 -276 -366 -356 -212 SQ 20201203T053907.2Z 7642.235499 244 1 6.30 2 56.46 99.60 95.98 295.43 0.00 1 0.00 1 0 15 2.244e-03 2.223e-03 1.060e-04 1.058e-04 1.381830e+03 5.737699e+00 1.051080e+02 -6.000000e+00 1.163915e+02 280.71 -2.00 20.00 -2.00 505.27 0.00e+00 6.058122e-04 2.826414e-06 3.539881e-05 -6.000000e+00 6.124096e-05 280.71 -2.00 20.00 -2.00 500.48 0.00e+00 6.075265e-02 2.032399e-03 1.089900e-02 -6.000000e+00 4.340708e-02 228.03 -2.00 3.06 -2.00 502.07 0.00e+00 1.804 0.000 489.00 513.00 1 7.5432e-01 1.5493e-04 2.4414e-03 -6.0000e+00 3.3115e-03 -2.8703e-03 4.1149e-05 2.7059e-04 -6.0000e+00 8.8046e-04 7.3762e-01 6.1087e-05 8.3335e-06 1.6524e-05 -6.0000e+00 1.8066e-04 8.3989e-03 -2.7627e-05 10 0 0 10 0 0 98.71 18.73 1.97 0.00840 0.00882 1021 220 2 2 0 5.560 15.00 18.73 18.76 21.17 21.06 13.3 908.68 -538 -400 -157 148 307 298 413 445 325 249 166 117 -40 -187 -210 -137 -53 -29 81 165 64 80 123 107 218 224 285 35 -28 -274 -352 -289 -178 -73 189 277 54 -6 -181 -177 -156 4 59 135 191 181 189 141 -14 -185 -454 -631 -548 -521 -257 -77 58 76 73 86 124 171 195 208 141 98 35 14 -183 -273 -325 -212 -16 -51 47 -20 -93 -219 -301 -239 -258 -223 -198 -152 -62 46 -58 -83 -118 -75 24 133 224 231 211 94 61 -175 -354 -435 -441 -347 -156 -118 27 5 -224 -256 -287 -223 -54 102 187 258 341 365 412 313 248 163 47 45 127 71 178 196 94 147 255 111 72 15 -79 -186 -114 -62 66 177 194 151 161 170 149 202 173 62 -261 -353 -411 -321 -529 -387 -158 148 314 311 440 477 347 260 171 119 -41 -184 -208 -136 -54 -30 86 171 66 83 128 111 228 234 296 36 -29 -271 -345 -285 -180 -75 199 290 56 -7 -190 -184 -162 4 60 140 200 190 196 144 -14 -187 -445 -605 -519 -500 -255 -80 58 77 74 87 126 174 199 212 143 97 35 14 -182 -266 -315 -207 -16 -51 46 -19 -92 -211 -288 -228 -248 -218 -194 -150 -60 45 -56 -81 -115 -74 24 133 229 237 212 94 59 -166 -338 -409 -414 -332 -149 -118 27 5 -224 -250 -278 -218 -54 104 185 258 342 368 417 318 250 161 47 45 125 71 178 196 94 146 253 111 71 15 -75 -175 -106 -59 64 171 189 149 160 169 149 204 175 63 -256 -335 -395 -308 SQ 20201203T053914.1Z 7642.235580 244 2 6.16 2 56.44 99.59 96.01 295.42 0.00 1 0.00 1 0 15 2.249e-03 2.229e-03 1.040e-04 1.038e-04 1.372642e+03 5.624917e+00 1.044706e+02 -6.000000e+00 1.166536e+02 280.71 -2.00 20.00 -2.00 505.26 0.00e+00 6.127882e-04 2.770730e-06 3.567669e-05 -6.000000e+00 6.137882e-05 280.71 -2.00 20.00 -2.00 500.45 0.00e+00 6.505500e-02 1.994393e-03 1.086771e-02 -6.000000e+00 4.350447e-02 228.03 -2.00 3.06 -2.00 502.04 0.00e+00 1.803 0.000 489.00 513.00 1 7.2241e-01 1.5207e-04 2.4409e-03 -6.0000e+00 3.3190e-03 -3.2688e-03 4.0389e-05 2.6986e-04 -6.0000e+00 8.8243e-04 7.6134e-01 6.0190e-05 8.1636e-06 1.6343e-05 -6.0000e+00 1.8107e-04 8.3311e-03 -2.6534e-05 10 0 0 10 0 0 97.56 18.73 1.97 0.00833 0.00875 1021 220 2 2 0 5.560 15.00 18.73 18.76 21.17 21.06 13.3 908.68 -536 -382 -184 132 287 301 413 444 318 272 159 122 -45 -209 -209 -143 -59 -10 75 177 87 84 118 105 219 243 275 49 -12 -280 -356 -301 -202 -62 216 273 48 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