File name: Pandora159s1_Wakkerstroom_20241020_L2Fit_fwvt1c7d20231113p1-8.txt File generation date: 20250129T133627.3Z Data description: Level 2 spectral fitting results file Data file version: fwvt1c7p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v7d20231113.txt Level 1 file used: Pandora159s1_Wakkerstroom_20241020_L1_smca1c7d20231113p1-8.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: 20241020 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: new FC bc steadily increasing wrms First and last pixel inside fitting window: 1644 1794 Nominal wavelengths inside fitting window [nm]: 492.0151 492.1360 492.2568 492.3777 492.4985 492.6193 492.7401 492.8609 492.9817 493.1024 493.2231 493.3438 493.4645 493.5852 493.7059 493.8265 493.9471 494.0677 494.1883 494.3089 494.4295 494.5500 494.6705 494.7910 494.9115 495.0320 495.1525 495.2729 495.3933 495.5137 495.6341 495.7545 495.8748 495.9952 496.1155 496.2358 496.3561 496.4764 496.5966 496.7169 496.8371 496.9573 497.0775 497.1976 497.3178 497.4379 497.5580 497.6781 497.7982 497.9183 498.0383 498.1584 498.2784 498.3984 498.5184 498.6383 498.7583 498.8782 498.9981 499.1180 499.2379 499.3578 499.4776 499.5974 499.7172 499.8370 499.9568 500.0766 500.1963 500.3160 500.4357 500.5554 500.6751 500.7948 500.9144 501.0340 501.1536 501.2732 501.3928 501.5123 501.6319 501.7514 501.8709 501.9904 502.1098 502.2293 502.3487 502.4681 502.5875 502.7069 502.8263 502.9456 503.0649 503.1842 503.3035 503.4228 503.5421 503.6613 503.7805 503.8997 504.0189 504.1381 504.2572 504.3764 504.4955 504.6146 504.7337 504.8527 504.9718 505.0908 505.2098 505.3288 505.4478 505.5667 505.6857 505.8046 505.9235 506.0424 506.1613 506.2801 506.3990 506.5178 506.6366 506.7554 506.8741 506.9929 507.1116 507.2303 507.3490 507.4677 507.5863 507.7050 507.8236 507.9422 508.0608 508.1794 508.2979 508.4164 508.5350 508.6535 508.7719 508.8904 509.0088 509.1273 509.2457 509.3641 509.4824 509.6008 509.7191 509.8375 509.9558 --------------------------------------------------------------------------------------- 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 102-252: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 253-403: 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 20241020T034121.0Z 9059.153715 190 1 16.75 2 85.83 99.66 74.26 311.27 0.00 1 0.00 1 0 22 5.263e-03 5.200e-03 2.851e-04 2.847e-04 6.926994e+03 1.708617e+01 4.933507e+02 -6.000000e+00 2.708928e+02 278.74 -2.00 20.00 -2.00 505.37 0.00e+00 3.108790e-03 7.595947e-06 1.726778e-04 -6.000000e+00 1.428280e-04 278.74 -2.00 20.00 -2.00 500.82 0.00e+00 7.691337e-01 5.383943e-03 5.474435e-02 -6.000000e+00 1.014179e-01 228.10 -2.00 3.06 -2.00 502.36 0.00e+00 11.217 0.008 489.00 513.00 1 2.6590e+00 4.1019e-04 1.4492e-02 -6.0000e+00 7.7415e-03 -4.6920e-02 1.0624e-04 1.4295e-03 -6.0000e+00 2.0415e-03 3.3415e-02 1.2487e-03 2.2000e-05 8.0012e-05 -6.0000e+00 4.2243e-04 -2.3044e-03 -2.7655e-05 12 9 9 12 1 1 98.84 19.37 2.07 -0.00230 0.00636 115 74 1 2 0 144.390 15.00 19.37 17.40 21.69 21.58 26.5 835.63 -1119 -1046 -547 -56 476 688 829 1007 897 785 412 263 -28 -319 -509 -509 -333 -98 211 412 366 220 285 350 391 537 529 464 72 -402 -887 -855 -695 -341 162 517 311 46 -120 -306 -299 -183 101 176 436 473 481 426 247 -124 -485 -1026 -1130 -1112 -774 -203 169 398 284 327 274 447 492 575 442 333 92 -52 -259 -468 -704 -704 -451 -261 -90 -107 -251 -614 -643 -802 -710 -608 -503 -460 -484 -145 -160 -272 -402 -181 -168 123 390 683 665 471 292 35 -504 -945 -1133 -1149 -856 -402 -21 128 -101 -367 -543 -492 -306 111 387 574 668 855 972 986 882 596 375 177 95 211 302 431 417 300 361 349 278 82 -59 -366 -426 -422 -230 157 321 341 306 343 231 334 449 315 46 -365 -791 -938 -785 -1015 -958 -516 -54 454 668 822 1014 882 786 406 256 -27 -304 -481 -482 -318 -95 207 411 366 221 285 352 397 548 540 473 72 -389 -858 -828 -681 -336 162 527 314 46 -119 -301 -294 -181 101 179 450 481 488 428 252 -124 -474 -1004 -1087 -1069 -762 -202 173 402 288 330 276 453 504 591 453 337 92 -53 -261 -465 -690 -690 -447 -262 -89 -107 -246 -606 -626 -777 -687 -594 -497 -456 -473 -143 -159 -269 -397 -178 -166 122 398 687 663 471 285 34 -482 -887 -1050 -1073 -820 -392 -21 130 -102 -366 -547 -495 -306 113 399 582 683 875 1004 1033 930 622 386 179 97 216 305 438 425 307 367 357 286 83 -60 -369 -428 -425 -233 163 328 353 321 362 246 349 471 331 49 -381 -806 -968 -796 SQ 20241020T035621.1Z 9059.164133 193 1 44.24 2 82.54 97.99 76.73 309.07 0.00 1 0.00 1 0 15 3.624e-03 3.569e-03 1.020e-03 1.017e-03 4.168951e+03 5.955229e+01 3.045308e+02 -6.000000e+00 1.865737e+02 278.74 -2.00 20.00 -2.00 505.32 0.00e+00 1.645984e-03 2.697923e-05 9.237510e-05 -6.000000e+00 9.833301e-05 278.74 -2.00 20.00 -2.00 500.54 0.00e+00 6.069082e-01 1.941939e-02 3.220426e-02 -6.000000e+00 6.979183e-02 228.10 -2.00 3.06 -2.00 502.13 0.00e+00 7.150 0.002 489.00 513.00 1 6.1832e+00 1.4782e-03 9.0383e-03 -6.0000e+00 5.3280e-03 -1.3853e-02 3.8659e-04 8.7021e-04 -6.0000e+00 1.4040e-03 1.6373e-03 4.3220e-05 7.9164e-05 4.6221e-05 -6.0000e+00 2.9085e-04 -1.1864e-03 8.4893e-06 12 1 1 12 1 1 99.97 19.36 1.49 -0.00119 -0.00089 24 6 1 2 0 1769.620 14.99 19.36 18.14 21.69 21.58 26.3 839.11 -863 -743 -496 -80 278 412 390 707 473 694 130 186 -70 -382 -523 -393 -47 -312 179 328 290 89 271 411 243 408 381 141 -85 -409 -624 -386 -368 -209 -38 345 241 96 -16 -48 -241 -16 -7 34 397 283 202 187 360 -39 -199 -735 -782 -872 -627 -176 117 210 213 133 9 569 420 456 232 190 -112 -144 -95 -323 -214 -466 -158 -268 70 68 191 -551 -385 -417 -450 -380 -212 -333 -299 -81 248 -24 -320 -148 117 89 195 253 599 339 173 260 -235 -796 -823 -746 -521 -160 108 49 -173 -354 -472 -454 -168 75 342 315 423 553 552 546 335 497 354 120 -98 36 126 194 370 107 180 -59 99 45 -120 -135 -246 -456 -149 185 386 328 223 150 195 79 255 272 12 -247 -613 -489 -541 -810 -704 -484 -77 276 416 402 739 497 720 133 188 -70 -376 -510 -383 -46 -314 185 347 307 94 287 435 260 438 408 151 -90 -414 -613 -378 -364 -214 -38 357 248 98 -17 -51 -251 -17 -7 35 410 294 210 192 365 -39 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6.5338e-04 -6.0000e+00 2.3449e-03 2.4117e-04 6.5290e-04 3.2184e-04 3.3491e-05 -6.0000e+00 4.8576e-04 -1.6710e-03 1.2620e-05 12 8 8 10 0 0 99.15 19.36 1.80 -0.00167 0.00286 13 3 1 2 0 3750.650 15.00 19.36 18.43 21.69 21.58 26.3 839.76 -824 -1063 -159 -392 340 815 -271 6 252 161 517 158 -724 -193 -474 194 -187 -360 420 -528 304 -161 -209 127 273 685 295 377 73 -898 62 -796 308 -590 382 140 -810 366 -45 -217 -435 700 -314 447 497 308 516 760 713 -297 301 -776 -436 -150 -99 -134 -266 716 488 -4 155 593 -441 612 79 8 -117 381 65 -32 -147 -181 25 -115 -429 -1298 -484 -1101 390 -912 295 -752 820 -99 382 656 987 75 -575 -61 -415 428 65 747 -42 179 1165 496 -495 -564 -738 -255 167 -77 -4 558 -311 174 -54 -712 857 -1415 -62 -400 291 732 142 493 1238 581 439 84 -388 189 -210 358 582 -263 -1529 -3269 336 -287 898 -434 322 -278 331 -750 1093 343 -516 242 50 621 586 700 -779 313 -662 110 -980 -771 -1008 -154 -394 349 849 -290 7 272 172 541 164 -747 -195 -475 193 -189 -372 442 -570 326 -173 -225 136 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