File name: Pandora121s1_Izana_20241115_L2Fit_fout2c51d20221209p1-8.txt File generation date: 20241116T011712.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c51p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 121 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora121_OF_v2d20210519.txt Instrument calibration file used: Pandora121s1_CF_v51d20221209.txt Level 1 file used: Pandora121s1_Izana_20241115_L1_smca1c51d20221209p1-8.txt Full location name: Izana Atmospheric Research Center Short location name: Izana Country of location: Spain Location latitude [deg]: 28.3090 Location longitude [deg]: -16.4994 Location altitude [m]: 2360 Local noon date: 20241115 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: Analab+Fld after lab cal First and last pixel inside fitting window: 224 365 Nominal wavelengths inside fitting window [nm]: 305.1019 305.2431 305.3842 305.5254 305.6665 305.8076 305.9487 306.0899 306.2309 306.3720 306.5131 306.6542 306.7952 306.9362 307.0773 307.2183 307.3593 307.5003 307.6412 307.7822 307.9232 308.0641 308.2050 308.3460 308.4869 308.6278 308.7687 308.9095 309.0504 309.1913 309.3321 309.4729 309.6137 309.7546 309.8953 310.0361 310.1769 310.3177 310.4584 310.5992 310.7399 310.8806 311.0213 311.1620 311.3027 311.4433 311.5840 311.7247 311.8653 312.0059 312.1465 312.2871 312.4277 312.5683 312.7089 312.8494 312.9900 313.1305 313.2710 313.4115 313.5520 313.6925 313.8330 313.9734 314.1139 314.2543 314.3948 314.5352 314.6756 314.8160 314.9564 315.0967 315.2371 315.3775 315.5178 315.6581 315.7984 315.9387 316.0790 316.2193 316.3596 316.4998 316.6401 316.7803 316.9205 317.0607 317.2009 317.3411 317.4813 317.6215 317.7616 317.9018 318.0419 318.1820 318.3221 318.4622 318.6023 318.7424 318.8824 319.0225 319.1625 319.3025 319.4425 319.5825 319.7225 319.8625 320.0025 320.1424 320.2824 320.4223 320.5622 320.7021 320.8420 320.9819 321.1218 321.2617 321.4015 321.5413 321.6812 321.8210 321.9608 322.1006 322.2404 322.3801 322.5199 322.6596 322.7994 322.9391 323.0788 323.2185 323.3582 323.4979 323.6375 323.7772 323.9168 324.0565 324.1961 324.3357 324.4753 324.6149 324.7544 324.8940 --------------------------------------------------------------------------------------- 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: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: 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 78: 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 79: 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 80: 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 81: 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 82: 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 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Azimuth motor temperature [°C], 999=no temperature signal Column 98: Zenith motor temperature [°C], 999=no temperature signal Column 99: Temperature at electronics board 1 [°C], 999=no temperature signal Column 100: Temperature at electronics board 2 [°C], 999=no temperature signal Column 101: Humidity in head sensor [%], -9=no humidity signal Column 102: Pressure in head sensor [hPa], -9=no pressure signal Columns 103-244: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 245-386: 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 --------------------------------------------------------------------------------------- SU 20241115T082006.4Z 9085.347297 226 1 44.67 2 80.46 117.30 106.48 303.20 0.00 1 0.00 1 0 17 3.367e-01 5.139e-03 7.316e-02 9.738e-04 6.984413e-01 5.232581e-04 7.136871e-03 -6.000000e+00 1.887021e-01 223.91 -2.00 3.19 -2.00 321.17 0.00e+00 2.891250e-03 2.397839e-04 6.329176e-04 -6.000000e+00 8.180503e-03 275.87 -2.00 20.00 -2.00 320.72 0.00e+00 5.765 0.002 302.00 328.00 3 2.0224e-01 1.7187e-03 5.4903e-02 -6.0000e+00 4.6617e-01 7.6595e-03 2.4711e-03 3.4595e-02 -6.0000e+00 5.0729e-01 2.5479e-02 2.7742e-03 1.9590e-02 -6.0000e+00 3.0167e-01 -2.6195e-02 1.3316e-03 8.0119e-03 -6.0000e+00 1.3044e-01 2.5369e-03 -4.0100e-04 2.6501e-05 8.2378e-05 -6.0000e+00 8.8036e-03 -1.4671e-03 8.4240e-06 10 0 0 10 0 0 71.79 15.94 0.16 -0.00147 -0.00448 791 163 2 8 0 56.460 15.00 15.94 8.48 42.90 39.30 20.87 20.87 24.1 717.52 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-123 -269 -80 -57 317 535 462 41 32 -121 6 638 577 574 619 341 372 14 -194 -354 -458 -167 -438 -323 -565 -1240 -871 -563 32 249 576 784 476 482 -44 -139 -8 25 22 891 1198 397 -31 -746 -731 -307 -135 -1812 -1371 -1239 -827 107 457 545 61 443 -432 -112 409 490 447 17 -722 -165 671 1092 760 513 -617 643 1180 229 -323 -587 -788 -631 -336 -249 -870 1276 848 -47 211 -365 -495 SU 20241115T083149.0Z 9085.355428 231 1 45.31 2 78.19 118.92 108.49 304.98 0.00 1 0.00 1 0 25 1.303e-01 5.304e-03 2.510e-02 5.635e-04 5.894222e-01 2.917733e-04 6.142582e-03 -6.000000e+00 7.303118e-02 223.91 -2.00 3.19 -2.00 320.56 0.00e+00 2.146351e-03 1.121519e-04 3.996104e-04 -6.000000e+00 3.165921e-03 275.87 -2.00 20.00 -2.00 320.06 0.00e+00 4.741 0.001 302.00 328.00 3 1.7210e-01 8.8558e-04 4.5240e-02 -6.0000e+00 1.8042e-01 8.5501e-03 1.1497e-03 2.8075e-02 -6.0000e+00 1.9633e-01 2.0522e-02 1.1770e-03 1.5119e-02 -6.0000e+00 1.1675e-01 -2.2735e-02 5.9351e-04 5.6547e-03 -6.0000e+00 5.0484e-02 6.0986e-03 -3.9181e-04 1.5531e-05 5.4319e-05 -6.0000e+00 3.4070e-03 -1.8128e-03 2.9872e-06 10 0 0 10 0 0 -1.24 15.96 0.18 -0.00181 -0.00476 1245 257 4 8 0 35.830 15.00 15.96 9.63 42.10 38.60 20.87 20.96 24.3 722.48 -42773 -58684 -35074 -52639 -45552 -49470 -37227 -37163 -37044 -32616 -36102 -25579 -28415 -10384 -16280 -10433 -6184 -5745 -3380 -7081 -5348 -6703 -2731 -7708 -5724 -4939 -7054 -4155 -8943 -2026 -4974 1316 80 -2729 -4698 -5564 -3853 -3122 -1365 -2403 -1892 -2284 -1907 -1633 -704 -303 -792 -321 -1420 174 849 466 1339 863 684 471 -20 -610 -597 -137 878 1601 2176 2153 73 333 -265 277 1727 1384 1545 1239 1060 940 352 -211 -992 -1196 -358 -794 -759 -1224 -2052 -1262 -823 4 298 563 933 636 675 -37 36 132 130 50 801 949 136 -193 -734 -857 -287 -98 -1572 -1209 -1087 -855 11 255 398 28 319 -126 -58 264 173 219 -24 -448 -97 411 641 463 538 -397 623 873 219 -29 -224 -364 -286 -92 -129 -323 483 299 9 75 -215 -358 -235 -435 -218 -370 -275 -315 -235 -274 -309 -280 -337 -252 -368 -144 -300 -194 -123 -126 -78 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2.2561e-02 -6.0000e+00 2.5046e-01 2.3654e-02 8.0304e-03 1.1262e-02 -6.0000e+00 1.4894e-01 -1.9303e-02 4.2117e-03 4.1091e-03 -6.0000e+00 6.4364e-02 1.1680e-04 -8.6604e-04 1.4765e-04 3.8870e-05 -6.0000e+00 4.3498e-03 -3.0487e-04 -1.1512e-04 12 8 8 10 0 0 99.95 16.00 0.21 -0.00030 -0.00681 25 5 1 8 0 1799.660 15.00 16.00 10.51 44.10 38.60 20.87 20.96 24.0 723.99 -22611 120653 -28884 -45658 -24199 -49939 24528 -19094 105972 -22009 6477 -34811 10064 9333 268 14333 -3351 10011 -4701 10374 -5641 -2210 8174 -5186 14118 -3895 4085 -3725 8546 2963 2722 1580 1455 8059 -3523 2316 -6299 1828 -1846 -29613 343 -1045 5185 -2700 5379 -1864 1701 -704 -101 -428 198 3239 1623 3854 2799 324 2096 145 2785 1276 1773 414 4113 224 -1240 -193 -1173 436 1598 2701 1406 1848 1549 1146 311 -847 -233 -984 978 -2361 -275 -1986 -2695 -1721 -1388 19 -112 1274 337 2082 518 -497 851 -560 1054 -100 750 361 166 -577 -1724 -1237 -1126 -179 -1994 -681 -1383 -783 378 26 855 244 551 -336 985 -408 39 197 -186 -145 -96 821 425 574 271 -163 1189 864 994 -413 -121 -715 -214 -155 181 -76 412 678 -379 110 -746 -528 -339 609 -529 -921 -369 -974 271 -365 718 -526 123 -1081 240 273 10 536 -157 443 -255 508 -330 -126 449 -361 884 -306 293 -271 531 205 216 145 146 785 -362 229 -756 247 -318 -7694 74 -241 1158 -655 1207 -452 397 -170 -25 -112 56 983 527 1308 1002 124 801 56 1034 478 694 177 1889 115 -640 -93 -551 209 855 1627 921 1232 1007 701 173 -439 -113 -490 539 -1525 -198 -1614 -2346 -1531 -1319 19 -117 1325 347 1985 473 -424 686 -479 992 -105 887 464 221 -759 -2094 -1352 -1220 -200 -2434 -858 -1847 -1078 560 42 1429 414 914 -525 1448 -590 57 300 -303 -243 -157 1289 647 855 387 -223 1569 1227 1566 -701 -216 -1329 -403 -309 382 -162 892 1480 -822 232 -1496 -1009 SU 20241115T093405.0Z 9085.398669 269 1 12.95 2 66.80 128.76 118.31 315.84 0.00 1 0.00 1 0 17 2.935e-02 8.647e-03 2.087e-02 4.544e-03 3.297267e-01 2.261411e-03 3.630864e-03 -6.000000e+00 1.644980e-02 223.91 -2.00 3.19 -2.00 317.83 0.00e+00 6.768604e-04 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