File name: Pandora159s1_Wakkerstroom_20210825_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T032544.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210825_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: 20210825 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 20210825T082245.5Z 7907.349138 4 1 52.09 2 44.89 35.57 117.78 253.31 0.00 1 0.00 1 0 25 9.733e-03 7.322e-03 2.216e-04 1.213e-04 1.807620e-01 6.079729e-05 1.957975e-03 -6.000000e+00 5.501581e-03 226.71 -2.00 3.06 -2.00 315.85 0.00e+00 1.097767e-04 6.125753e-06 3.384512e-05 -6.000000e+00 2.390748e-04 276.86 -2.00 20.00 -2.00 315.26 0.00e+00 1.410 0.000 302.00 328.00 3 1.3217e-01 1.5724e-04 1.4062e-02 -6.0000e+00 1.3665e-02 -3.9327e-03 1.7571e-04 8.1317e-03 -6.0000e+00 1.4876e-02 1.9853e-03 1.0117e-04 4.0206e-03 -6.0000e+00 8.8375e-03 -2.5608e-03 4.6229e-05 1.1365e-03 -6.0000e+00 3.7404e-03 1.2285e-01 -2.4023e-04 3.4355e-06 1.4322e-05 -6.0000e+00 2.6018e-04 3.0655e-03 11 8 0 10 0 0 8.41 15.56 0.32 0.00307 0.00126 3376 726 2 8 0 14.240 14.96 15.56 23.74 18.52 18.52 20.1 923.45 -1741 -1861 -2814 -3602 -856 81 1092 1432 759 -1011 -27 1337 227 414 211 -1189 -17 9 267 549 -137 1047 1428 643 712 169 -692 -4 1283 2450 1988 2433 1242 -1734 -211 604 -223 510 -199 -1455 -1597 -993 -1186 -1147 -509 -1148 -903 -514 -571 739 822 605 946 562 506 1068 431 454 791 1076 1488 1118 927 319 -965 221 186 940 1724 124 -193 -430 -377 -158 -313 442 587 1162 1345 -297 -657 -1275 -2003 -844 -1082 -1008 -672 -620 -451 -410 369 285 1031 1897 1330 709 764 168 -796 -551 -298 -121 896 711 -997 -642 -611 -687 -43 -107 -248 -308 -83 111 442 1136 759 632 214 -596 -730 -190 -168 108 913 473 1298 1692 569 404 138 4 108 406 -240 -393 -21 -137 -582 -226 -233 -374 -94 -408 -467 -712 -844 -190 17 238 351 188 -262 -7 333 63 128 73 -448 -6 4 107 225 -57 427 588 280 325 80 -324 -2 507 924 781 1013 557 -807 -90 249 -101 269 -116 -985 -1171 -751 -918 -890 -390 -879 -670 -365 -392 498 578 453 742 461 425 906 373 390 664 897 1276 951 852 310 -931 192 159 771 1496 115 -194 -451 -394 -159 -294 400 476 882 1056 -265 -606 -1295 -2171 -945 -1208 -1207 -848 -805 -585 -511 421 317 1030 1805 1334 784 866 211 -1061 -718 -363 -145 1018 844 -1217 -826 -820 -960 -58 -153 -371 -462 -118 156 564 1348 969 785 287 -866 -1020 -281 -242 148 1178 583 1612 2087 698 529 188 6 152 590 -347 -599 -32 -219 -942 -357 -357 -553 -145 SS 20210825T082904.5Z 7907.353524 7 1 51.96 2 44.09 33.67 119.08 252.42 0.00 1 0.00 1 0 25 9.704e-03 7.327e-03 2.113e-04 1.177e-04 1.786604e-01 5.919917e-05 1.941471e-03 -6.000000e+00 5.484984e-03 226.71 -2.00 3.06 -2.00 315.78 0.00e+00 1.264145e-04 5.880535e-06 3.466438e-05 -6.000000e+00 2.383517e-04 276.86 -2.00 20.00 -2.00 315.20 0.00e+00 1.391 0.000 302.00 328.00 3 9.6718e-02 1.5285e-04 1.3888e-02 -6.0000e+00 1.3624e-02 -2.8050e-03 1.7058e-04 8.0456e-03 -6.0000e+00 1.4831e-02 1.6683e-03 9.8189e-05 3.9817e-03 -6.0000e+00 8.8108e-03 -2.3950e-03 4.4906e-05 1.1305e-03 -6.0000e+00 3.7292e-03 1.2972e-01 -2.5421e-04 3.3224e-06 1.4304e-05 -6.0000e+00 2.5939e-04 2.8812e-03 11 8 0 10 0 0 33.21 16.41 0.31 0.00288 0.00097 3490 751 2 8 0 13.760 15.03 16.41 24.82 19.33 19.33 19.3 925.17 -1668 -1781 -2874 -3583 -926 116 1014 1466 729 -964 -18 1402 227 457 260 -1142 -33 -21 270 515 -187 1056 1487 629 772 159 -655 -18 1269 2414 1979 2461 1191 -1693 -245 655 -247 510 -175 -1423 -1564 -992 -1213 -1195 -495 -1182 -873 -544 -538 744 843 653 903 555 493 1137 431 463 780 1093 1481 1137 929 317 -938 214 176 915 1713 118 -170 -455 -362 -167 -315 448 563 1115 1324 -307 -668 -1285 -2018 -844 -1094 -986 -648 -626 -445 -399 345 296 1031 1898 1334 712 757 175 -751 -551 -284 -123 887 692 -981 -659 -636 -662 -46 -82 -235 -281 -78 145 449 1122 741 623 202 -584 -732 -202 -163 76 906 478 1287 1666 594 396 158 0 110 401 -238 -386 -29 -113 -592 -219 -245 -386 -98 -401 -458 -747 -862 -211 25 227 368 185 -256 -5 357 64 145 92 -439 -13 -8 110 215 -80 439 623 278 358 76 -312 -8 510 926 789 1040 543 -799 -106 274 -113 272 -103 -976 -1161 -760 -951 -939 -384 -917 -655 -391 -373 507 598 494 715 459 418 973 347 371 661 919 1281 975 861 311 -912 187 152 756 1496 109 -172 -480 -381 -170 -298 409 460 852 1046 -275 -619 -1312 -2198 -949 -1227 -1186 -820 -817 -579 -499 396 331 1034 1812 1343 789 861 220 -1003 -721 -345 -148 1011 824 -1200 -850 -856 -928 -62 -117 -352 -421 -112 205 574 1333 880 774 271 -849 -1025 -279 -234 104 1171 589 1600 2056 729 517 216 1 155 582 -344 -588 -45 -180 -957 -346 -374 -570 -141 SS 20210825T083412.3Z 7907.357087 9 1 52.15 2 43.48 32.09 120.13 251.68 0.00 1 0.00 1 0 25 9.706e-03 7.318e-03 2.073e-04 1.165e-04 1.766089e-01 5.842975e-05 1.917482e-03 -6.000000e+00 5.486378e-03 226.71 -2.00 3.06 -2.00 315.76 0.00e+00 1.383388e-04 5.783864e-06 3.376198e-05 -6.000000e+00 2.384105e-04 276.86 -2.00 20.00 -2.00 315.18 0.00e+00 1.376 0.000 302.00 328.00 3 9.1647e-02 1.5088e-04 1.3737e-02 -6.0000e+00 1.3627e-02 -3.2015e-03 1.6854e-04 7.9527e-03 -6.0000e+00 1.4834e-02 2.1723e-03 9.6888e-05 3.9316e-03 -6.0000e+00 8.8130e-03 -2.6161e-03 4.4104e-05 1.1131e-03 -6.0000e+00 3.7303e-03 1.3242e-01 -2.5863e-04 3.2944e-06 1.4159e-05 -6.0000e+00 2.5945e-04 2.6958e-03 11 8 0 10 0 0 37.83 16.92 0.31 0.00270 0.00075 3563 766 2 8 0 13.470 15.06 16.92 25.43 19.75 19.75 18.8 927.65 -1605 -1823 -2888 -3580 -919 135 1064 1485 811 -989 5 1364 269 471 254 -1159 -2 -18 246 546 -122 1067 1480 686 725 130 -669 10 1270 2422 1983 2439 1238 -1693 -294 602 -207 467 -158 -1432 -1569 -979 -1200 -1198 -505 -1200 -877 -510 -565 737 829 643 905 558 492 1103 434 446 803 1074 1492 1133 920 322 -934 198 190 920 1715 131 -199 -450 -375 -155 -285 453 568 1120 1310 -298 -664 -1277 -2012 -828 -1086 -992 -662 -618 -418 -424 347 290 1014 1901 1341 704 759 180 -787 -537 -270 -131 858 693 -992 -643 -623 -690 -40 -81 -232 -298 -70 133 442 1108 749 614 211 -579 -726 -203 -164 94 913 477 1284 1663 578 415 141 0 109 409 -245 -387 -32 -136 -592 -218 -236 -388 -75 -391 -476 -761 -873 -212 29 241 377 208 -266 1 351 77 151 91 -450 -1 -7 101 230 -53 447 626 306 340 63 -321 4 514 935 796 1037 567 -803 -128 253 -95 251 -93 -987 -1170 -753 -944 -945 -393 -934 -661 -368 -393 504 590 487 718 463 417 945 350 357 681 905 1292 973 853 315 -908 174 164 760 1497 121 -201 -475 -394 -157 -270 413 464 855 1033 -267 -615 -1301 -2186 -929 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