File name: Pandora101s1_Izana_20231006_L2Fit_fout2c12d20230620p1-8.txt File generation date: 20231007T142403.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v12d20230620.txt Level 1 file used: Pandora101s1_Izana_20231006_L1_smca1c12d20230620p1-8.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: 20231006 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 11 First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1333 305.2742 305.4151 305.5559 305.6968 305.8376 305.9784 306.1192 306.2600 306.4008 306.5416 306.6823 306.8231 306.9638 307.1045 307.2452 307.3859 307.5266 307.6673 307.8080 307.9486 308.0893 308.2299 308.3706 308.5112 308.6518 308.7924 308.9329 309.0735 309.2141 309.3546 309.4951 309.6357 309.7762 309.9167 310.0572 310.1976 310.3381 310.4786 310.6190 310.7594 310.8998 311.0403 311.1807 311.3210 311.4614 311.6018 311.7421 311.8825 312.0228 312.1631 312.3034 312.4437 312.5840 312.7243 312.8645 313.0048 313.1450 313.2852 313.4254 313.5656 313.7058 313.8460 313.9862 314.1263 314.2665 314.4066 314.5467 314.6869 314.8270 314.9670 315.1071 315.2472 315.3872 315.5273 315.6673 315.8073 315.9473 316.0873 316.2273 316.3673 316.5073 316.6472 316.7871 316.9271 317.0670 317.2069 317.3468 317.4867 317.6265 317.7664 317.9062 318.0461 318.1859 318.3257 318.4655 318.6053 318.7451 318.8848 319.0246 319.1643 319.3041 319.4438 319.5835 319.7232 319.8629 320.0025 320.1422 320.2819 320.4215 320.5611 320.7007 320.8403 320.9799 321.1195 321.2591 321.3986 321.5382 321.6777 321.8172 321.9568 322.0962 322.2357 322.3752 322.5147 322.6541 322.7936 322.9330 323.0724 323.2118 323.3512 323.4906 323.6300 323.7693 323.9087 324.0480 324.1873 324.3266 324.4659 324.6052 324.7445 324.8838 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal 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: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20231006T072948.3Z 8679.312364 232 1 12.13 2 84.63 98.70 8.55 271.32 0.00 1 0.00 1 0 25 5.147e-01 3.528e-02 3.325e-01 2.107e-02 9.126682e-01 1.203196e-02 9.393571e-03 -6.000000e+00 2.995471e-01 226.02 -2.00 3.19 -2.00 321.53 0.00e+00 -3.416896e-03 5.516576e-03 2.170189e-03 -6.000000e+00 1.441209e-02 279.35 -2.00 20.00 -2.00 321.06 0.00e+00 9.363 0.008 302.00 328.00 3 3.3601e+00 4.0373e-02 8.4295e-02 -6.0000e+00 7.4581e-01 1.2241e+00 5.0563e-02 4.7882e-02 -6.0000e+00 8.1249e-01 -1.3394e+00 4.3089e-02 2.2859e-02 -6.0000e+00 4.7807e-01 5.3273e-01 2.1405e-02 7.9162e-03 -6.0000e+00 2.0841e-01 4.9273e-06 -7.8734e-04 5.4017e-04 9.1925e-05 -6.0000e+00 1.4371e-02 -2.4768e-02 0.0000e+00 12 9 9 12 5 1 63.60 21.17 0.17 -0.02477 -0.03068 4 5 1 5 0 2424.120 21.17 15.00 14.58 19.04 0.0 958.97 -55588 900000 -73572 900000 -66531 900000 -126442 900000 5784 -61810 900000 -105244 900000 -37542 900000 -20249 125749 -61118 900000 -18839 329984 -72892 69943 63830 -36720 133342 42183 56743 -50577 900000 -21506 900000 -29473 134831 -53483 900000 -2904 83665 42778 50251 51873 76816 126920 46761 80884 13468 116551 957 90025 -4472 53317 3535 43115 23175 41125 50032 -20205 31101 18302 50619 -2999 45022 9229 53988 4069 43741 -7809 34839 7208 20968 8351 5396 7126 -194 11449 -3889 1475 -20686 9074 -11202 8858 -5449 3836 -1685 1555 -2940 -1912 -2836 -917 -643 -769 6180 -9296 77 -7213 433 -1545 2298 -4022 1877 -1745 -1283 -4271 -3797 -2222 -2405 -3098 -5762 1572 -1883 2547 -1337 3438 -2387 3402 -5636 1129 -3485 1941 68 2418 3381 1602 3686 619 2563 -823 3089 -152 3509 -192 624 -368 608 -652 -241 588 -413 357 36 -52 -3774 -1855 900000 -2911 900000 -1851 900000 -6270 900000 119 -1931 900000 -5770 900000 -1594 900000 -959 2578 -4721 900000 -956 6765 -5595 1471 1543 -2366 2734 1211 1312 -3136 900000 -1312 900000 -2474 2764 -5195 900000 -186 2815 2543 3194 3509 4173 4270 3307 4039 1239 4150 104 4448 -588 4509 519 4743 3337 5182 5954 -4744 4277 2654 5163 -520 5492 1800 7532 945 6890 -2039 6515 1974 5670 2735 1833 2254 -60 2817 -994 346 -6361 2505 -4462 3398 -2692 1878 -921 869 -1760 -1173 -1764 -557 -367 -409 2998 -5186 43 -4987 329 -1371 2250 -4400 1938 -1698 -1112 -3500 -3174 -1960 -2233 -3010 -6282 1777 -2497 3639 -2071 5242 -3676 4834 -8560 1641 -5464 3023 108 3664 4872 2258 4937 826 3300 -1063 4252 -250 6248 -385 1303 -813 1428 -1622 -618 1505 -1070 893 87 -116 -8012 SS 20231006T075545.6Z 8679.330388 240 1 34.11 2 79.01 101.93 14.15 273.14 0.00 1 0.00 1 0 17 2.222e-01 6.131e-03 1.253e-02 5.482e-04 5.978191e-01 2.839334e-04 6.281263e-03 -6.000000e+00 1.268914e-01 226.02 -2.00 3.19 -2.00 320.04 0.00e+00 2.218758e-03 9.560762e-05 6.948818e-04 -6.000000e+00 5.549264e-03 279.35 -2.00 20.00 -2.00 319.49 0.00e+00 5.067 0.001 302.00 328.00 3 1.7358e+00 8.2300e-04 4.7528e-02 -6.0000e+00 3.1453e-01 5.8127e-02 1.0163e-03 2.8250e-02 -6.0000e+00 3.4091e-01 -5.7545e-02 9.4763e-04 1.5096e-02 -6.0000e+00 2.0280e-01 1.5147e-02 4.9024e-04 5.6402e-03 -6.0000e+00 8.8043e-02 9.8913e-04 6.2473e-04 1.4630e-05 5.4705e-05 -6.0000e+00 5.9603e-03 -2.5261e-02 0.0000e+00 12 1 1 12 5 1 78.51 21.17 0.26 -0.02526 -0.02057 854 305 1 5 0 39.890 21.17 14.99 14.58 19.43 0.0 962.24 -78356 -80718 -67401 -80112 -79814 -85393 -80964 -63944 -63837 -60285 -61574 -48528 -40226 -28014 -22997 -16317 -15158 -7981 -9543 -9394 -11557 -8351 -10123 -8933 -8997 -9381 -10422 -12432 -9774 -7287 -4607 -1445 -1553 -4523 -4612 -6577 -2705 -1593 52 -36 562 1062 1114 1915 1908 1584 934 1037 1173 2572 2330 2571 2461 2010 1708 1301 430 103 420 885 1368 2194 2643 1375 1019 1170 587 982 1283 455 563 77 295 -289 -581 -862 -1358 -1060 -1034 -1282 -1123 -1818 -1828 -1262 -962 -315 34 387 440 691 655 253 309 236 -200 86 489 189 -174 -293 -609 -402 330 -764 -1303 -850 -590 -172 512 398 331 234 270 167 385 529 221 181 -192 -537 -140 296 62 261 33 -23 782 676 152 95 -168 -108 -35 -124 -176 -202 345 1 -132 -88 -185 -97 -946 -1130 -857 -1092 -1011 -1164 -1181 -909 -1013 -983 -1083 -882 -856 -672 -647 -500 -510 -275 -358 -369 -471 -333 -439 -420 -457 -499 -558 -657 -507 -409 -301 -108 -131 -403 -393 -586 -265 -171 7 -5 93 187 204 353 357 304 184 211 249 583 591 723 755 610 546 434 147 35 137 288 469 835 1135 657 495 545 272 476 705 265 353 50 184 -169 -333 -447 -674 -547 -614 -831 -839 -1425 -1539 -1118 -909 -314 33 379 424 675 593 215 255 206 -200 92 561 244 -238 -389 -740 -465 360 -883 -1527 -1041 -762 -237 727 629 536 390 441 258 590 785 337 291 -310 -893 -227 484 97 397 49 -32 1132 991 239 167 -300 -202 -68 -245 -372 -421 729 3 -279 -185 -367 -192 SS 20231006T075959.4Z 8679.333327 243 1 18.48 2 78.10 102.47 15.06 273.42 0.00 1 0.00 1 0 17 1.715e-01 6.021e-03 5.922e-03 3.121e-04 5.603446e-01 1.604693e-04 5.912086e-03 -6.000000e+00 9.794551e-02 226.02 -2.00 3.19 -2.00 319.81 0.00e+00 1.918726e-03 4.978753e-05 5.107974e-04 -6.000000e+00 4.283046e-03 279.35 -2.00 20.00 -2.00 319.24 0.00e+00 4.708 0.001 302.00 328.00 3 3.0530e-01 4.5756e-04 4.4274e-02 -6.0000e+00 2.4278e-01 4.5694e-02 5.5346e-04 2.6388e-02 -6.0000e+00 2.6314e-01 -4.7848e-02 4.9291e-04 1.3871e-02 -6.0000e+00 1.5653e-01 1.1640e-02 2.5820e-04 5.0545e-03 -6.0000e+00 6.7964e-02 5.6079e-03 7.2607e-04 8.4220e-06 4.9427e-05 -6.0000e+00 4.6000e-03 -2.5863e-02 0.0000e+00 11 1 0 11 4 0 -1.22 21.17 0.27 -0.02586 -0.02041 2553 650 1 5 0 7.220 21.17 15.00 14.58 19.52 0.0 963.95 -62464 -57061 -57627 -58865 -66777 -62553 -62234 -49522 -51152 -48130 -48513 -36984 -30492 -19313 -14670 -10027 -8191 -6355 -5237 -5560 -5922 -6745 -5072 -7119 -5722 -7326 -7070 -9235 -7360 -6037 -3095 -745 -1379 -3398 -3982 -4416 -3000 -545 -16 265 309 889 547 1451 1372 1316 1128 850 900 1960 1830 1971 2069 1453 1577 1124 418 123 244 713 1471 2081 2390 1384 918 1132 258 967 1106 545 431 25 73 -276 -556 -674 -1347 -1043 -1108 -1277 -1087 -1878 -1741 -1183 -977 -279 64 287 429 600 652 280 328 372 -43 49 559 172 -239 -252 -665 -327 331 -656 -1283 -837 -644 -159 510 284 303 230 282 157 443 601 284 150 -212 -554 -233 195 34 321 113 52 879 825 142 163 -224 -77 -4 -134 -180 -183 327 -34 -161 -90 -224 -104 -926 -901 -945 -919 -1049 -956 -1059 -856 -1003 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