File name: Pandora101s1_Izana_20231223_L2Fit_fout2c12d20230620p1-8.txt File generation date: 20240117T091837.3Z 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 v1.8.59 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v12d20230620.txt Level 1 file used: Pandora101s1_Izana_20231223_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: 20231223 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 20231223T082423.2Z 8757.350268 166 1 7.59 2 85.06 119.99 128.90 332.71 0.00 1 0.00 1 0 25 4.712e-01 2.398e-02 4.175e-01 1.787e-02 1.096251e+00 1.013433e-02 1.145048e-02 -6.000000e+00 2.674056e-01 223.10 -2.00 3.19 -2.00 322.08 0.00e+00 3.214317e-03 5.114410e-03 7.618089e-03 -6.000000e+00 1.169794e-02 273.59 -2.00 20.00 -2.00 321.69 0.00e+00 9.996 0.010 302.00 328.00 3 2.0527e+00 3.6288e-02 1.0013e-01 -6.0000e+00 6.6090e-01 1.4813e+00 4.8841e-02 7.3600e-02 -6.0000e+00 7.1963e-01 -1.7634e+00 4.5972e-02 3.7936e-02 -6.0000e+00 4.2767e-01 6.9839e-01 2.2295e-02 1.1072e-02 -6.0000e+00 1.8557e-01 9.8453e-06 -1.0580e-03 4.2379e-04 2.2212e-04 -6.0000e+00 1.2691e-02 -2.1164e-02 0.0000e+00 12 9 9 12 5 1 7.40 21.17 0.32 -0.02116 -0.02911 10 18 1 5 0 690.200 21.17 15.00 14.61 6.08 0.4 849.33 144901 -70605 900000 -93224 -1790 -149745 -62265 -142662 -58275 -142426 -102849 -56814 -53163 -13778 83855 57065 28112 900000 24391 -34220 -65173 37282 -45324 -10892 -100082 70 -49711 -57659 36414 -6049 225431 73883 105014 -6144 -8303 -16483 137242 -1376 100211 57132 5056 25197 28301 10319 10456 29146 4790 91126 10624 36371 16900 65212 34171 49559 24704 46989 49880 24602 19628 13836 30016 8668 26059 29533 36506 22961 42278 12436 28706 14130 20756 11661 8307 9517 2745 5793 -6618 -108 11195 8495 550 5059 993 7817 -3547 3557 410 -1085 -1927 -5408 -971 -7056 -7877 -2092 -1215 -4199 3284 -5813 -342 -3606 -1966 -4584 -3357 -4203 -4535 -3326 -5500 -2415 -309 -548 770 13 289 582 330 652 -645 180 -313 1793 2184 3885 750 1927 1394 894 2334 -431 673 624 628 -2 497 -124 -543 -468 -24 125 -142 -503 -100 -1154 2524 -2013 900000 -2658 -31 -5692 -1085 -5196 -1015 -5188 -2606 -1080 -1263 -284 1461 994 579 900000 541 -1301 -3096 649 -1651 -293 -6657 2 -1811 -2100 634 -169 3927 1416 1829 -263 -329 -679 2391 -61 2095 2090 304 1277 1528 588 580 1472 317 2699 690 2218 1285 3749 2652 3885 2347 4011 4084 2221 1881 1326 2510 920 2724 3414 4163 3018 5229 2048 4592 2954 4306 2641 1815 1824 487 890 -1142 -20 2199 2112 177 1795 401 3107 -1657 1611 198 -531 -921 -2518 -404 -3028 -3531 -1007 -700 -3026 2403 -5417 -326 -3497 -1695 -3494 -2483 -3175 -3670 -2797 -4639 -2195 -321 -679 1083 20 456 905 498 965 -996 290 -488 2928 3332 5408 1034 2559 1811 1129 2924 -631 1183 1190 1350 -5 1260 -318 -1490 -1320 -66 349 -386 -1267 -243 -2580 SS 20231223T083356.5Z 8757.356904 169 1 51.58 2 83.25 121.23 129.75 335.28 0.00 1 0.00 1 0 17 8.143e-01 1.368e-02 3.044e-02 8.347e-04 9.570240e-01 4.577512e-04 9.728718e-03 -6.000000e+00 4.596809e-01 223.10 -2.00 3.19 -2.00 321.73 0.00e+00 7.448867e-03 2.342176e-04 2.542451e-03 -6.000000e+00 1.985896e-02 273.59 -2.00 20.00 -2.00 321.34 0.00e+00 7.806 0.005 302.00 328.00 3 1.6512e-01 1.5946e-03 7.5175e-02 -6.0000e+00 1.1342e+00 4.7513e-01 2.4889e-03 4.8893e-02 -6.0000e+00 1.2332e+00 -6.5321e-01 2.8382e-03 3.1395e-02 -6.0000e+00 7.3272e-01 2.6722e-01 1.3145e-03 1.5231e-02 -6.0000e+00 3.1844e-01 4.4828e-04 5.5496e-05 2.0067e-05 1.9108e-04 -6.0000e+00 2.1828e-02 -2.3230e-02 0.0000e+00 12 9 8 11 4 0 7.60 21.17 0.33 -0.02323 -0.02281 2108 537 1 5 0 22.680 21.17 15.01 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-557 -368 -435 -466 -587 -434 -157 9 288 319 561 363 420 349 507 430 681 771 1092 1198 1547 1709 1786 1747 1685 1525 1033 987 667 960 1224 1809 1830 1898 1745 1587 1731 1914 2090 1992 1707 1190 711 127 -335 -911 -637 -489 41 167 -70 -321 -9 -199 281 335 516 493 229 13 -683 -1090 -1441 -1582 -1117 -581 -676 -742 -695 -1198 -876 -681 -1774 -2388 -1942 -1733 -1133 -371 -292 13 166 183 -27 168 330 50 247 101 244 1483 2088 1455 1118 653 634 1533 1132 591 1078 624 669 237 -374 -854 -479 844 -120 -622 -380 -980 -1501 SS 20231223T084454.6Z 8757.364521 172 1 51.78 2 81.21 122.71 130.63 338.31 0.00 1 0.00 1 0 17 6.405e-01 1.043e-02 1.229e-02 3.746e-04 8.062585e-01 1.997478e-04 8.320310e-03 -6.000000e+00 3.615817e-01 223.10 -2.00 3.19 -2.00 321.08 0.00e+00 5.619516e-03 8.813167e-05 1.932666e-03 -6.000000e+00 1.562047e-02 273.59 -2.00 20.00 -2.00 320.67 0.00e+00 6.205 0.002 302.00 328.00 3 1.1924e-01 6.3334e-04 6.0485e-02 -6.0000e+00 8.9215e-01 1.9154e-01 9.0034e-04 3.9371e-02 -6.0000e+00 9.7001e-01 -2.5280e-01 1.0021e-03 2.5191e-02 -6.0000e+00 5.7635e-01 9.9389e-02 4.8494e-04 1.1950e-02 -6.0000e+00 2.5049e-01 1.7482e-03 4.4414e-04 9.3812e-06 1.3077e-04 -6.0000e+00 1.7169e-02 -2.3481e-02 0.0000e+00 12 9 8 11 4 0 12.12 21.17 0.28 -0.02348 -0.02014 4482 1142 1 5 0 10.670 21.17 15.00 14.61 7.97 0.3 866.44 -221978 -200861 -209036 -208057 -217732 -217979 -206406 -201859 -177095 -190160 -166690 -168305 -122335 -114784 -79791 -77922 -58485 -58794 -49408 -50518 -51639 -48855 -51222 -42395 -46029 -38201 -48511 -42412 -48546 -30217 -24228 -9709 -10981 -9155 -13581 -13363 -9791 -4832 2309 2969 5282 3693 7556 4402 6733 3769 6053 4474 7371 7096 8746 8936 9166 8280 6955 6607 3649 3648 2018 3051 3134 5429 5675 5569 4522 4627 2950 3165 3374 2842 2650 1432 1467 182 16 -1900 -2244 -2308 -1252 -1356 -832 -1934 -1997 -1537 -1234 -435 -159 357 308 531 3 -357 -1124 -930 -1163 -418 145 35 -230 -287 -648 -507 33 -1246 -1691 -1423 -807 -350 347 174 386 197 328 85 282 411 139 101 -197 -168 301 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