File name: Pandora101s1_Izana_20231118_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T133054.1Z 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_20231118_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: 20231118 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 20231118T074142.3Z 8722.320629 29 1 33.41 2 88.49 112.80 149.35 93.42 0.00 1 0.00 1 0 25 8.221e-01 1.197e-01 4.626e-01 6.726e-02 1.139320e+00 4.164209e-02 1.397189e-02 -6.000000e+00 4.986559e-01 223.86 -2.00 3.19 -2.00 321.35 0.00e+00 6.738957e-03 1.338167e-02 1.728632e-02 -6.000000e+00 2.674174e-02 275.74 -2.00 20.00 -2.00 320.92 0.00e+00 17.717 0.057 302.00 328.00 3 -1.6187e+00 1.2268e-01 1.7783e-01 -6.0000e+00 1.2274e+00 3.4002e+00 1.3969e-01 1.3469e-01 -6.0000e+00 1.3461e+00 -2.3802e+00 8.5617e-02 3.1679e-02 -6.0000e+00 8.0188e-01 7.5982e-01 4.8380e-02 2.1493e-02 -6.0000e+00 3.5586e-01 5.2796e-07 -4.9669e-03 1.6033e-03 1.2424e-04 -6.0000e+00 2.3996e-02 2.6709e-03 0.0000e+00 12 9 9 12 1 1 42.13 20.96 11.14 0.00267 -0.03465 9 4 1 5 0 3340.130 20.96 15.00 14.38 14.87 0.1 926.29 34996 900000 137182 900000 -16532 900000 88408 223089 900000 15932 900000 -25512 900000 -13518 900000 -16616 900000 13795 900000 128994 900000 192932 106532 900000 113214 900000 -26304 900000 -42983 900000 126322 900000 1215 900000 -79878 900000 900000 124169 900000 900000 900000 358845 900000 900000 900000 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6153 11047 3131 12193 5293 11567 11564 9155 9496 -12147 16073 -7749 9575 -11158 14481 3396 13045 7438 12924 -2350 8662 7119 -9544 6933 -9759 12146 -9890 6870 -16107 23641 -12646 17815 -4188 9854 1395 3292 4386 3393 9729 5776 2733 -19856 6461 -12900 20883 -13441 15168 -10542 16465 -40061 3788 -13989 8168 7071 3523 16739 -13572 6462 -15751 24818 -11602 11834 -2460 19569 -10096 10171 -3072 3115 3960 -6293 -4138 -4213 12326 -2984 11839 -14429 SS 20231118T074554.9Z 8722.323552 33 1 46.01 2 87.64 113.31 148.47 93.79 0.00 1 0.00 1 0 25 5.046e-01 3.392e-02 4.683e-01 2.983e-02 1.157992e+00 1.977121e-02 1.251180e-02 -6.000000e+00 2.944687e-01 223.86 -2.00 3.19 -2.00 322.53 0.00e+00 -1.556359e-02 1.081420e-02 5.907433e-03 -6.000000e+00 1.579994e-02 275.74 -2.00 20.00 -2.00 322.15 0.00e+00 15.358 0.037 302.00 328.00 3 -7.7473e-02 7.6660e-02 1.3274e-01 -6.0000e+00 7.3258e-01 2.1220e+00 9.9573e-02 5.9639e-02 -6.0000e+00 8.0270e-01 -1.9823e+00 9.0575e-02 3.4018e-02 -6.0000e+00 4.7480e-01 6.9793e-01 4.4033e-02 1.6640e-02 -6.0000e+00 2.1423e-01 1.3770e-06 -2.5064e-03 8.2426e-04 3.3310e-04 -6.0000e+00 1.5019e-02 2.8658e-03 0.0000e+00 12 9 9 12 1 1 9.28 20.96 4.03 0.00287 -0.01597 61 16 1 5 0 742.070 20.96 14.99 14.38 15.16 0.0 930.08 900000 900000 11103 900000 -193448 38783 -42280 900000 70775 900000 -60916 900000 900000 900000 900000 76944 58933 900000 900000 -50157 900000 900000 900000 222032 69275 68786 900000 900000 900000 900000 900000 61589 90287 900000 -83898 900000 900000 83249 900000 900000 43818 900000 166651 900000 -50067 900000 14786 70255 900000 12902 181774 48402 51812 54938 91753 77141 61408 -32578 9852 49604 -31949 28181 57141 44207 -26059 22031 7905 35993 17923 35032 12328 52712 -7517 84022 5461 33408 -15034 18483 32369 1197 10442 4692 11906 -3272 5173 -6445 10312 -14366 -5289 -16187 16549 -8729 7421 5562 783 -1430 -110 -1182 2589 1750 -412 3036 2034 2561 -11703 -6541 -9687 -1660 -2304 89 -188 332 1764 306 3722 -9901 320 -1285 4095 -1114 4672 1576 1731 3607 68 -121 3065 -59 1819 1925 -1294 1562 -2054 -107 62 697 -93 86 -850 1315 -1106 -736 900000 900000 321 900000 -9783 1121 -1222 900000 2045 900000 -1760 900000 900000 900000 900000 2223 1703 900000 900000 -1845 900000 900000 900000 6416 2002 1988 900000 900000 900000 900000 900000 1780 2609 900000 -5510 900000 900000 2406 900000 900000 1612 900000 4816 900000 -3946 900000 583 2030 900000 644 5253 2162 2450 2742 3375 3790 3549 -4519 797 2437 -3508 1873 3302 3321 -4142 2165 937 3536 2434 4556 2137 6093 -1477 5827 710 2896 -2085 2030 3741 232 2203 1220 3165 -1068 1629 -2365 3278 -5812 -1880 -5987 4113 -2724 2059 1800 321 -723 -65 -823 1878 1254 -273 1667 1011 1288 -7271 -4045 -6606 -1161 -1905 86 -211 406 2203 386 4399 -13189 396 -1697 5336 -1510 5576 1795 1891 3784 72 -125 3065 -70 2580 3232 -2547 3277 -4867 -271 169 1947 -264 242 -2352 3282 -2548 -1533 SS 20231118T080056.7Z 8722.333989 39 1 51.91 2 84.63 115.19 145.34 95.08 0.00 1 0.00 1 0 17 7.217e-01 1.305e-02 5.460e-02 1.493e-03 9.129718e-01 8.237175e-04 9.131835e-03 -6.000000e+00 4.034364e-01 223.86 -2.00 3.19 -2.00 321.96 0.00e+00 6.024909e-03 4.491061e-04 1.339901e-03 -6.000000e+00 1.747891e-02 275.74 -2.00 20.00 -2.00 321.55 0.00e+00 9.371 0.008 302.00 328.00 3 2.4865e-01 3.0503e-03 8.4525e-02 -6.0000e+00 9.9676e-01 5.2517e-01 4.6749e-03 4.9993e-02 -6.0000e+00 1.0837e+00 -7.4561e-01 5.1886e-03 2.7204e-02 -6.0000e+00 6.4425e-01 3.0653e-01 2.3827e-03 1.1391e-02 -6.0000e+00 2.8078e-01 1.4674e-04 -1.1943e-03 3.7842e-05 1.3075e-04 -6.0000e+00 1.8674e-02 9.8103e-04 0.0000e+00 12 8 8 10 0 0 -3.27 20.96 0.46 0.00098 -0.00799 1234 314 1 5 0 38.760 20.96 15.00 14.42 16.65 0.0 939.94 -225727 -230305 -198515 -213495 -228662 -229130 -219621 -196118 -213660 -210852 -214817 -178067 -170725 -138833 -121701 -84106 -93501 -69664 -80553 -63261 -77746 -65184 -70361 -68670 -59240 -67035 -68748 -85255 -70294 -62555 -47427 -30054 -12842 -22905 -21774 -29343 -11260 -11064 1887 16144 10512 16375 14024 14689 8162 9756 5150 10279 11951 18605 17517 21226 22018 19327 19334 18367 17480 11444 10247 4420 9152 9136 13969 12848 11764 9059 9269 8796 8738 9538 8366 7692 5927 3834 105 -2185 -5688 -3201 -1665 542 106 644 -356 0 293 887 973 1548 1131 525 -160 -1557 -2443 -2771 -1998 -1601 -751 -625 -604 -725 -1215 -1315 -1446 -2269 -2528 -1987 -1550 -1126 -695 -152 73 102 87 -88 -203 -143 -191 -129 182 376 824 1278 1240 905 706 461 841 435 371 568 296 292 29 -243 -87 -144 383 89 -125 -204 -407 -896 -2480 -2987 -1918 -2176 -2421 -2396 -2238 -1739 -2432 -2428 -3034 -2178 -2660 -2122 -2020 -1151 -1593 -1035 -1407 -949 -1313 -949 -1137 -1180 -975 -1220 -1251 -1775 -1310 -1293 -1091 -718 -299 -600 -526 -769 -277 -329 60 522 396 620 566 595 358 435 252 513 637 1035 1130 1490 1693 1660 1748 1741 1687 1135 977 438 917 1051 1806 1927 1870 1475 1555 1606 1846 2085 1989 1864 1391 919 23 -444 -1186 -719 -446 158 37 257 -157 0 144 459 524 839 604 267 -76 -726 -1168 -1486 -1268 -1215 -613 -590 -613 -720 -1102 -1135 -1150 -1886 -2269 -1712 -1423 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