File name: Pandora101s1_Izana_20240203_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T142511.2Z 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_20240203_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: 20240203 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 20240203T082255.4Z 8799.349253 238 1 48.48 2 84.61 112.16 51.56 201.02 0.00 1 0.00 1 0 25 3.712e-01 2.287e-02 2.232e-01 9.342e-03 9.586137e-01 5.144074e-03 9.927234e-03 -6.000000e+00 2.071890e-01 223.55 -2.00 3.19 -2.00 321.72 0.00e+00 6.240141e-03 2.355141e-03 2.279868e-03 -6.000000e+00 9.023234e-03 272.59 -2.00 20.00 -2.00 321.32 0.00e+00 9.356 0.008 302.00 328.00 3 3.4170e+00 1.6989e-02 8.4249e-02 -6.0000e+00 5.1198e-01 1.2419e+00 2.1631e-02 4.6632e-02 -6.0000e+00 5.5718e-01 -1.3627e+00 2.0427e-02 2.5780e-02 -6.0000e+00 3.3078e-01 5.3463e-01 1.0215e-02 1.0065e-02 -6.0000e+00 1.4416e-01 4.5694e-06 -1.5891e-03 2.2465e-04 1.5068e-04 -6.0000e+00 9.7751e-03 4.5786e-03 0.0000e+00 12 8 8 10 0 0 97.36 21.17 0.20 0.00458 -0.00736 29 7 1 5 0 1671.580 21.17 15.00 14.58 9.28 0.3 876.53 -69954 134678 -98231 900000 -148603 122761 -141731 -28035 -68418 -66073 -112220 -52157 -58128 -22081 102674 -39571 71850 -54830 33671 3315 4869 -47179 -18417 -14658 3037 12081 -11946 -41903 -37654 16451 -75383 67376 -14272 50772 -43618 14984 -15271 1859 17795 64436 20690 45794 39492 41769 1205 -7630 19564 9775 24715 -420 44403 11566 31739 26312 40797 28834 31533 5982 9035 8389 11363 15640 15245 24682 8315 20982 8599 18722 7923 16032 14084 12749 3648 3791 -5158 -5414 -9994 -13588 515 -1840 1456 -1091 949 -1415 2261 -2871 2101 1073 -815 -2416 -898 -4785 -5353 -5552 -4003 -2171 -1749 1089 -1717 1218 -2046 -1241 -2279 -4042 -4080 -3709 -3264 -1652 -457 -292 538 320 995 -1204 -616 -1093 -498 -538 1097 788 2623 2131 2165 1799 2259 818 497 -22 2136 1446 353 971 -1233 97 -216 -225 175 242 -633 73 -139 -2109 -1820 1227 -3482 900000 -6283 1118 -5255 -373 -1338 -1248 -3444 -1056 -1647 -566 971 -1722 1158 -3085 849 106 148 -2180 -646 -514 94 334 -398 -1696 -1530 455 -6357 1699 -881 1672 -3207 619 -896 108 1085 2799 1438 2663 2476 2516 104 -723 1508 844 2034 -47 3702 1428 3468 3239 4486 3637 3829 888 1210 1087 1487 2221 2535 4237 1744 3829 1819 3839 1995 4213 3999 3661 1075 1036 -1343 -1262 -2404 -3731 148 -639 577 -507 468 -750 1175 -1642 1181 611 -460 -1349 -459 -2437 -2789 -3243 -2652 -1692 -1550 1084 -1883 1262 -1977 -1064 -1800 -3345 -3619 -3434 -3210 -1701 -535 -386 798 507 1583 -1907 -930 -1626 -758 -865 1815 1302 4020 3071 3004 2512 3043 1077 655 -31 3600 2749 731 2147 -2984 242 -576 -600 481 666 -1702 181 -323 -4594 SS 20240203T083346.0Z 8799.356782 241 1 48.80 2 82.41 113.55 52.48 203.96 0.00 1 0.00 1 0 17 6.864e-01 1.035e-02 5.509e-02 1.500e-03 8.300206e-01 8.043995e-04 8.518347e-03 -6.000000e+00 3.830281e-01 223.55 -2.00 3.19 -2.00 321.32 0.00e+00 5.349949e-03 3.672662e-04 1.477355e-03 -6.000000e+00 1.640634e-02 272.59 -2.00 20.00 -2.00 320.92 0.00e+00 7.063 0.004 302.00 328.00 3 2.2820e+00 2.6095e-03 6.6401e-02 -6.0000e+00 9.4669e-01 2.3619e-01 3.8683e-03 4.1233e-02 -6.0000e+00 1.0302e+00 -3.0243e-01 4.4244e-03 2.5186e-02 -6.0000e+00 6.1149e-01 1.2081e-01 2.1097e-03 1.1192e-02 -6.0000e+00 2.6585e-01 1.0786e-04 -6.1478e-04 3.7338e-05 1.2123e-04 -6.0000e+00 1.7762e-02 4.2484e-03 0.0000e+00 12 8 8 10 0 0 64.30 21.17 0.26 0.00425 -0.00037 442 113 1 5 0 108.190 21.17 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-561 -277 -351 337 182 202 152 293 365 250 263 318 512 533 736 891 1122 1180 1248 996 1217 623 664 347 474 440 847 1431 1334 1346 1086 1112 807 1355 1360 1646 857 794 240 -38 -660 -355 -708 -209 -154 -340 -413 -1184 -845 -834 -228 -131 319 150 165 -144 -561 -1054 -875 -1307 -622 44 248 -6 -660 -875 -935 -259 -1409 -1596 -1676 -870 -477 117 372 537 783 452 -36 -191 299 -116 28 247 419 595 1579 1034 703 452 255 789 733 524 438 160 -128 -241 -716 -420 -189 829 199 -233 -378 -532 -1022 SS 20240203T085205.6Z 8799.369509 246 1 52.10 2 78.75 116.00 54.29 208.71 0.00 1 0.00 1 0 17 2.436e-01 6.201e-03 9.059e-03 3.802e-04 6.152032e-01 1.945535e-04 6.469358e-03 -6.000000e+00 1.359254e-01 223.56 -2.00 3.19 -2.00 320.13 0.00e+00 2.288387e-03 6.462241e-05 5.413117e-04 -6.000000e+00 5.821886e-03 272.59 -2.00 20.00 -2.00 319.68 0.00e+00 4.960 0.001 302.00 328.00 3 1.5899e+00 5.5840e-04 4.7027e-02 -6.0000e+00 3.3595e-01 6.0376e-02 6.9391e-04 2.8852e-02 -6.0000e+00 3.6557e-01 -6.1023e-02 6.8258e-04 1.5632e-02 -6.0000e+00 2.1699e-01 1.7888e-02 3.5495e-04 5.7918e-03 -6.0000e+00 9.4349e-02 1.2314e-03 -3.0244e-04 9.8812e-06 5.4829e-05 -6.0000e+00 6.3025e-03 3.5912e-03 0.0000e+00 10 0 0 10 0 0 89.38 21.17 0.25 0.00359 0.00132 2109 537 1 5 0 22.670 21.17 15.00 14.58 10.19 0.2 884.06 -88990 -81911 -78976 -85419 -95090 -90102 -84272 -74839 -69162 -69917 -62923 -54366 -41084 -30695 -22036 -16369 -16249 -12908 -11535 -9047 -12121 -10863 -11351 -8563 -9760 -9644 -11636 -12407 -13263 -9182 -5553 -1438 -1837 -3699 -5312 -6289 -3579 -1379 461 1001 1210 613 1376 1560 1782 1292 1508 1034 1068 2091 2760 3067 2658 2452 1918 1619 676 462 26 842 1130 2198 2448 2005 940 568 9 348 1204 855 986 308 306 -231 -572 -1374 -1972 -1860 -1226 -1145 -1060 -1612 -1818 -1397 -908 -169 205 599 667 698 332 30 -298 -115 -215 38 512 526 45 -237 -670 -538 -138 -669 -1075 -963 -625 -271 401 383 557 455 310 76 143 172 102 137 -61 -186 -15 399 229 331 28 -39 497 579 230 34 -232 -168 -136 -277 -155 -163 303 107 -53 -92 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