File name: Pandora101s1_Izana_20240811_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240812T011801.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c22p1-8 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_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20240811_L1_smca1c22d20230904p1-8.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: 20240811 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: Based on session 12 fieldcal with sens applied First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1209 305.2618 305.4026 305.5434 305.6843 305.8251 305.9659 306.1066 306.2474 306.3882 306.5289 306.6697 306.8104 306.9511 307.0918 307.2325 307.3732 307.5139 307.6545 307.7952 307.9358 308.0764 308.2170 308.3576 308.4982 308.6388 308.7794 308.9199 309.0605 309.2010 309.3415 309.4820 309.6225 309.7630 309.9035 310.0440 310.1844 310.3249 310.4653 310.6057 310.7461 310.8865 311.0269 311.1673 311.3076 311.4480 311.5883 311.7287 311.8690 312.0093 312.1496 312.2898 312.4301 312.5704 312.7106 312.8509 312.9911 313.1313 313.2715 313.4117 313.5519 313.6920 313.8322 313.9723 314.1125 314.2526 314.3927 314.5328 314.6729 314.8129 314.9530 315.0931 315.2331 315.3731 315.5131 315.6531 315.7931 315.9331 316.0731 316.2130 316.3530 316.4929 316.6329 316.7728 316.9127 317.0526 317.1924 317.3323 317.4722 317.6120 317.7518 317.8916 318.0315 318.1712 318.3110 318.4508 318.5906 318.7303 318.8701 319.0098 319.1495 319.2892 319.4289 319.5686 319.7082 319.8479 319.9875 320.1272 320.2668 320.4064 320.5460 320.6856 320.8252 320.9647 321.1043 321.2438 321.3833 321.5229 321.6624 321.8019 321.9413 322.0808 322.2203 322.3597 322.4991 322.6386 322.7780 322.9174 323.0568 323.1961 323.3355 323.4749 323.6142 323.7535 323.8928 324.0321 324.1714 324.3107 324.4500 324.5893 324.7285 324.8677 --------------------------------------------------------------------------------------- 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 20240811T065109.0Z 8989.285521 42 1 40.57 2 87.18 74.36 160.76 50.42 0.00 1 0.00 1 0 25 7.763e-01 5.410e-02 4.199e-01 3.146e-02 1.091654e+00 1.819552e-02 1.451365e-02 -6.000000e+00 4.447270e-01 227.69 -2.00 3.19 -2.00 321.78 0.00e+00 -9.177325e-02 6.224722e-03 6.411168e-03 -6.000000e+00 2.146012e-02 282.04 -2.00 20.00 -2.00 321.15 0.00e+00 14.107 0.029 302.00 328.00 3 1.2240e+00 5.8617e-02 1.6684e-01 -6.0000e+00 1.1042e+00 1.9125e+00 7.4638e-02 2.0800e-01 -6.0000e+00 1.1974e+00 -2.0732e+00 5.5700e-02 3.6406e-02 -6.0000e+00 7.0941e-01 7.7352e-01 2.8428e-02 9.1801e-02 -6.0000e+00 3.0822e-01 1.3217e-06 -9.0523e-04 7.4684e-04 1.0273e-03 -6.0000e+00 2.0671e-02 2.1952e-03 0.0000e+00 12 9 9 12 1 1 10.37 21.06 2.05 0.00220 -0.00461 20 6 1 5 0 1931.570 21.06 14.99 14.62 28.22 1.3 796.19 221753 8159 -23942 900000 -38268 900000 56726 114566 177097 900000 203260 126053 327458 69075 200132 110970 270561 54067 1252 97086 -40182 182928 50397 341905 -54865 900000 103115 126330 40451 45135 94274 49781 -8809 22774 -50335 113403 11542 25329 203326 160748 91095 75562 93420 98303 43304 36109 -16655 41784 119882 -30783 -10580 -184 13883 57771 55899 71979 127832 84132 62732 13701 -21457 15291 32983 -5590 7341 28529 21552 8207 11017 3982 2125 29373 21935 26579 19996 -2789 7411 -8444 7390 -11950 7839 15107 7373 5240 4336 3017 11422 -2142 -3328 -8687 1188 -3910 8665 7301 -6026 4517 -1714 -8516 -5297 -4877 -12379 -5127 2619 -7882 -10637 -5492 -2751 -3465 -2458 -1405 2105 3167 1440 -1258 4057 81 -1894 -5176 982 119 1650 1364 2769 8832 2579 3948 4973 -501 2791 -37 -610 -585 -3048 929 -107 2145 2212 1120 -79 267 -7337 523 6797 477 -1534 900000 -1919 900000 2371 4469 5428 900000 6230 7024 10036 4042 6134 3401 8293 2410 87 2976 -3807 5607 3089 10479 -22931 900000 7757 4928 2480 2138 2889 2219 -736 1333 -5610 3476 868 2329 6232 7883 9137 8422 8017 6327 3849 2877 -1991 2689 3674 -4717 -1524 -27 2000 6197 7196 9266 10187 9799 7498 2142 -4209 2109 4145 -1114 1283 3935 3369 1660 2566 1147 677 7292 5580 5784 3984 -607 1386 -1915 1608 -3699 2354 4954 2915 2281 2033 1498 5321 -1123 -1673 -4260 495 -1702 3506 3379 -3694 2852 -1308 -7831 -4984 -4439 -11079 -3771 1670 -5870 -8802 -4511 -2327 -3229 -2614 -1740 2891 4679 2242 -1997 5894 119 -2873 -8440 1565 189 2442 1898 3683 10828 3280 4768 5929 -711 4568 -73 -1219 -1272 -7387 2368 -297 6060 6293 3210 -221 684 -18317 1105 SS 20240811T070331.3Z 8989.294113 46 1 47.85 2 84.55 75.78 158.70 56.15 0.00 1 0.00 1 0 17 6.437e-01 1.553e-02 7.340e-02 2.165e-03 9.409904e-01 1.221207e-03 9.531629e-03 -6.000000e+00 3.652319e-01 227.69 -2.00 3.19 -2.00 322.00 0.00e+00 4.806493e-03 6.989243e-04 2.227366e-03 -6.000000e+00 1.600845e-02 282.04 -2.00 20.00 -2.00 321.56 0.00e+00 9.254 0.008 302.00 328.00 3 9.1584e-01 4.7029e-03 8.4726e-02 -6.0000e+00 9.0831e-01 6.7299e-01 6.9520e-03 4.9340e-02 -6.0000e+00 9.8375e-01 -9.2660e-01 7.1182e-03 2.8248e-02 -6.0000e+00 5.8528e-01 3.7692e-01 3.2447e-03 1.0794e-02 -6.0000e+00 2.5436e-01 7.4214e-05 -1.1400e-03 5.3676e-05 1.4272e-04 -6.0000e+00 1.6676e-02 8.5343e-04 0.0000e+00 12 8 8 10 0 0 -0.01 21.06 0.37 0.00085 -0.00771 583 148 1 5 0 82.060 21.06 15.00 14.62 28.89 1.3 800.16 -210278 -178185 -168985 -202057 -189028 -223808 -190317 -205680 -153595 -223910 -130797 -192742 -95671 -145536 -73586 -89030 -59385 -63976 -70607 -52547 -80062 -45794 -83721 -42639 -106649 -22749 -83190 -44897 -83120 -36711 -41436 -5767 -11119 -5228 -19344 -29781 -3873 -13439 33087 14468 29057 5389 34180 5581 28173 1493 22982 11599 20724 15610 27421 25241 22311 29236 20464 33125 16011 21169 8774 16456 3312 18093 12743 19319 11471 13834 10441 8116 11363 9791 13335 7664 9466 3862 4550 -4505 -1668 -5310 -334 -130 2414 430 55 345 271 1581 707 1606 884 1736 -1588 -1035 -3798 -2320 -3444 -1802 -1435 -788 -940 -1621 -1366 -2347 -1538 -2886 -2189 -2807 -1083 -1738 -558 -706 371 -156 164 -56 -272 -111 -328 270 196 912 968 1937 937 1394 469 877 344 873 241 666 213 149 113 -330 4 -81 512 -2 82 -373 -691 -1094 -3107 -2120 -1848 -2753 -1995 -3264 -2118 -2920 -1524 -4210 -1132 -3476 -969 -2932 -1010 -1691 -940 -1161 -1431 -898 -1741 -686 -1926 -702 -3489 -327 -2125 -749 -2088 -690 -1050 -125 -293 -131 -519 -886 -100 -460 866 531 1012 251 1234 269 1088 77 999 605 1067 942 1684 1785 1789 2376 1909 2825 1632 1975 876 1483 359 1932 1689 2744 1845 2164 1745 1369 2145 2153 3037 1868 2150 842 956 -933 -332 -1101 -80 -38 819 171 24 159 133 807 379 863 468 863 -763 -476 -1828 -1232 -2209 -1365 -1177 -744 -956 -1624 -1239 -1875 -1222 -2409 -1791 -2432 -988 -1757 -642 -950 517 -233 247 -82 -386 -169 -475 410 314 1453 1467 2963 1398 2013 663 1194 470 1336 407 1300 464 324 264 -838 11 -226 1445 -6 228 -971 -1655 -2430 SS 20240811T071358.9Z 8989.301377 49 1 47.88 2 82.32 76.96 156.85 60.26 0.00 1 0.00 1 0 25 6.121e-01 9.922e-03 2.112e-02 6.293e-04 7.669335e-01 3.390934e-04 8.052985e-03 -6.000000e+00 3.473180e-01 227.69 -2.00 3.19 -2.00 321.18 0.00e+00 3.291705e-03 1.619080e-04 2.829666e-03 -6.000000e+00 1.522293e-02 282.04 -2.00 20.00 -2.00 320.66 0.00e+00 6.976 0.003 302.00 328.00 3 7.0226e-01 1.1423e-03 6.5530e-02 -6.0000e+00 8.6376e-01 1.6068e-01 1.6101e-03 4.0471e-02 -6.0000e+00 9.3547e-01 -2.2394e-01 1.6855e-03 2.2596e-02 -6.0000e+00 5.5655e-01 8.8393e-02 8.0216e-04 7.5824e-03 -6.0000e+00 2.4190e-01 5.8855e-04 -5.4892e-04 1.5997e-05 9.9082e-05 -6.0000e+00 1.5855e-02 1.6538e-04 0.0000e+00 12 8 8 10 0 0 -8.11 21.06 0.29 0.00017 -0.00396 1982 505 1 5 0 24.130 21.06 15.00 14.63 29.36 1.3 803.61 -206492 -190760 -194926 -196852 -210222 -204127 -205434 -185174 -185528 -174372 -166965 -147805 -129259 -98244 -87743 -68982 -62766 -55931 -49483 -50381 -48435 -56342 -42091 -44339 -43735 -41004 -41258 -49033 -41833 -34772 -22564 -13558 -9131 -11350 -14138 -14321 -11651 -4405 423 4548 3688 5329 5737 5869 5216 4460 3748 5142 4391 5747 7818 8052 7927 7484 7597 6305 4807 2974 2840 2331 3522 4411 5969 5711 4373 3004 2134 2549 3121 3120 2928 2267 1975 859 -463 -1906 -3206 -2844 -1436 -846 -925 -1475 -1826 -1549 -870 -297 128 462 562 445 -156 -879 -1407 -1333 -1132 -573 -16 280 -154 -474 -952 -1159 -954 -1276 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