File name: Pandora101s1_Izana_20231122_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T133853.4Z 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_20231122_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: 20231122 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 20231122T080304.0Z 8726.335463 102 1 49.73 2 84.88 116.11 154.60 334.93 0.00 1 0.00 1 0 17 6.160e-01 1.435e-02 1.856e-01 3.387e-03 9.473105e-01 1.903790e-03 9.444990e-03 -6.000000e+00 3.442143e-01 223.75 -2.00 3.19 -2.00 322.05 0.00e+00 4.297355e-03 1.030943e-03 1.658446e-03 -6.000000e+00 1.490311e-02 275.47 -2.00 20.00 -2.00 321.65 0.00e+00 9.725 0.009 302.00 328.00 3 1.4266e+00 6.9682e-03 8.7804e-02 -6.0000e+00 8.5032e-01 6.6764e-01 1.0818e-02 5.2087e-02 -6.0000e+00 9.2456e-01 -9.2198e-01 1.2056e-02 2.8736e-02 -6.0000e+00 5.4961e-01 3.7346e-01 5.5409e-03 1.0757e-02 -6.0000e+00 2.3955e-01 3.3354e-05 -1.3515e-03 8.4689e-05 1.2238e-04 -6.0000e+00 1.5939e-02 8.3551e-04 0.0000e+00 12 8 8 10 0 0 28.43 20.96 0.53 0.00084 -0.00932 336 86 1 5 0 142.490 20.96 15.00 14.40 14.10 0.0 917.62 -114549 -223754 -125402 -200596 -195950 -238905 -75404 -238425 -85354 -226052 -108129 -200402 -114264 -136001 -103837 -61017 -86413 -37610 -86512 -29593 -90680 -30381 -102956 -4623 -96438 47781 -86754 -40972 -62930 -25469 -47084 -19196 -10701 -23836 -8174 -18561 9281 -26242 37160 -3282 31961 6191 31475 4055 21760 -6901 17608 20683 9926 24712 13821 30661 16435 35179 10296 31234 10056 25000 6699 14781 1103 9157 14471 16991 12872 10667 13451 8592 11909 8127 13617 5540 10339 2989 3974 -5809 -2677 -6075 -329 965 110 1715 -1689 1126 -849 2192 -163 2443 -277 1671 -2298 -907 -2823 -2609 -2004 -1487 -550 -529 -99 -1418 -648 -2578 -653 -3497 -1440 -2838 -1057 -1947 -500 -864 260 204 64 -226 -351 329 -736 -5 39 845 879 1977 725 1350 611 742 826 148 746 461 513 35 97 -461 79 -264 622 -108 74 -392 -269 -964 -550 -3561 -753 -2289 -1883 -3443 -249 -4009 -333 -3733 -643 -3370 -1208 -2164 -1528 -766 -1570 -460 -1800 -352 -1917 -341 -2516 -46 -2516 300 -2034 -582 -1143 -379 -1120 -425 -251 -646 -175 -441 187 -910 835 -129 971 258 1050 178 805 -349 727 888 515 1232 881 1863 1270 2452 969 2476 993 2048 622 1230 111 971 1716 2256 1871 1582 2008 1461 2266 1841 3135 1398 2360 665 772 -1120 -496 -1288 -80 285 35 627 -697 478 -391 1032 -82 1208 -138 770 -1032 -387 -1254 -1297 -1185 -1052 -457 -510 -103 -1455 -599 -2115 -482 -2744 -1192 -2508 -982 -2016 -539 -1097 370 310 99 -343 -513 470 -1098 -9 64 1381 1364 2854 1024 1845 819 959 1065 216 1297 932 1067 79 234 -1211 223 -713 1680 -295 212 -1054 -662 -2205 SS 20231122T081413.9Z 8726.343216 105 1 51.16 2 82.69 117.56 155.44 340.90 0.00 1 0.00 1 0 17 6.126e-01 9.484e-03 4.033e-02 1.126e-03 7.696495e-01 6.016488e-04 7.952749e-03 -6.000000e+00 3.423328e-01 223.75 -2.00 3.19 -2.00 321.28 0.00e+00 4.841795e-03 2.805304e-04 1.609159e-03 -6.000000e+00 1.482126e-02 275.47 -2.00 20.00 -2.00 320.84 0.00e+00 7.291 0.004 302.00 328.00 3 1.6402e+00 1.9771e-03 6.6210e-02 -6.0000e+00 8.4567e-01 1.7098e-01 2.8549e-03 3.8186e-02 -6.0000e+00 9.1947e-01 -2.4068e-01 3.1654e-03 2.2887e-02 -6.0000e+00 5.4659e-01 9.5433e-02 1.5123e-03 9.6060e-03 -6.0000e+00 2.3826e-01 1.8926e-04 -7.0651e-04 2.9050e-05 1.0787e-04 -6.0000e+00 1.5849e-02 5.8243e-05 0.0000e+00 12 8 8 10 0 0 85.54 20.96 0.28 0.00006 -0.00525 788 201 1 5 0 60.680 20.96 15.00 14.40 14.53 0.0 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222 410 455 211 84 201 476 473 782 779 961 1056 1201 986 1016 779 571 450 230 439 898 1420 1456 1275 863 798 759 1049 1260 1445 1063 686 276 -208 -534 -762 -693 -683 -272 -330 -600 -1077 -795 -842 -355 -60 244 220 252 -55 -357 -960 -876 -989 -631 159 268 -132 -513 -832 -947 -559 -1166 -1641 -1328 -1085 -606 47 716 817 941 564 158 -111 336 -92 110 -7 52 489 1124 947 747 374 228 704 879 461 534 182 -177 -233 -526 -499 -493 420 365 -80 -294 -356 -839 SS 20231122T082515.7Z 8726.350876 108 1 50.61 2 80.55 119.03 156.03 347.11 0.00 1 0.00 1 0 25 3.288e-01 6.832e-03 1.980e-02 6.986e-04 6.410707e-01 3.618830e-04 6.748853e-03 -6.000000e+00 1.837276e-01 223.75 -2.00 3.19 -2.00 320.49 0.00e+00 2.642748e-03 1.361968e-04 7.870360e-04 -6.000000e+00 7.954345e-03 275.47 -2.00 20.00 -2.00 320.01 0.00e+00 5.818 0.002 302.00 328.00 3 2.0696e+00 1.0804e-03 5.3150e-02 -6.0000e+00 4.5387e-01 6.1043e-02 1.4008e-03 3.0515e-02 -6.0000e+00 4.9347e-01 -7.5511e-02 1.4330e-03 1.6850e-02 -6.0000e+00 2.9334e-01 2.4886e-02 7.2488e-04 6.3033e-03 -6.0000e+00 1.2788e-01 4.0410e-04 -4.6418e-04 1.8190e-05 6.3216e-05 -6.0000e+00 8.5053e-03 -3.0559e-04 0.0000e+00 11 8 0 10 0 0 92.55 20.96 0.24 -0.00031 -0.00379 920 234 1 5 0 51.950 20.96 15.00 14.40 14.99 0.0 924.37 -110832 -104615 -107842 -113982 -125796 -116692 -118647 -100512 -97522 -90353 -89705 -70366 -64890 -48260 -39546 -24688 -24845 -19386 -16721 -19071 -19278 -19144 -16841 -16810 -15053 -16495 -16919 -17693 -16525 -15293 -8207 -4907 -3620 -5558 -9495 -8800 -5160 -2278 1467 1326 1131 1743 1224 1981 1922 1841 2205 1500 1547 2703 3575 3128 3605 3321 2510 2640 1727 1189 359 915 1904 2847 3331 2688 1753 1052 533 602 1389 953 1120 454 295 -294 -791 -1717 -2112 -2191 -1555 -1335 -943 -1522 -1788 -1487 -982 -324 216 515 649 686 427 -78 -478 -480 -258 13 530 593 73 -164 -646 -771 -300 -896 -1189 -1056 -632 -256 306 415 669 477 398 83 120 162 9 63 -57 -192 -61 448 364 342 113 15 454 481 235 147 -179 -67 -149 -315 -195 -197 293 103 -24 -119 -113 -137 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