File name: Pandora141s1_Calakmul_20240907_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20240908T060023.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 141 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240907_L1_smca1c3d20231011p1-8.txt Full location name: Calakmul Atmospheric Observatory Short location name: Calakmul Country of location: Mexico Location latitude [deg]: 18.5956 Location longitude [deg]: -89.4137 Location altitude [m]: 275 Local noon date: 20240907 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB session based on session 2 First and last pixel inside fitting window: 238 379 Nominal wavelengths inside fitting window [nm]: 305.1074 305.2483 305.3892 305.5302 305.6711 305.8120 305.9528 306.0937 306.2346 306.3754 306.5163 306.6571 306.7979 306.9387 307.0795 307.2203 307.3611 307.5018 307.6426 307.7833 307.9240 308.0647 308.2054 308.3461 308.4868 308.6275 308.7681 308.9088 309.0494 309.1900 309.3306 309.4712 309.6118 309.7524 309.8930 310.0335 310.1741 310.3146 310.4551 310.5956 310.7361 310.8766 311.0171 311.1575 311.2980 311.4384 311.5788 311.7192 311.8596 312.0000 312.1404 312.2808 312.4211 312.5615 312.7018 312.8421 312.9824 313.1227 313.2630 313.4033 313.5435 313.6838 313.8240 313.9643 314.1045 314.2447 314.3849 314.5251 314.6652 314.8054 314.9455 315.0857 315.2258 315.3659 315.5060 315.6461 315.7862 315.9262 316.0663 316.2063 316.3463 316.4864 316.6264 316.7664 316.9063 317.0463 317.1863 317.3262 317.4662 317.6061 317.7460 317.8859 318.0258 318.1657 318.3055 318.4454 318.5852 318.7250 318.8649 319.0047 319.1445 319.2842 319.4240 319.5638 319.7035 319.8433 319.9830 320.1227 320.2624 320.4021 320.5418 320.6814 320.8211 320.9607 321.1003 321.2400 321.3796 321.5192 321.6588 321.7983 321.9379 322.0774 322.2170 322.3565 322.4960 322.6355 322.7750 322.9145 323.0539 323.1934 323.3328 323.4723 323.6117 323.7511 323.8905 324.0299 324.1692 324.3086 324.4479 324.5873 324.7266 324.8659 --------------------------------------------------------------------------------------- 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 --------------------------------------------------------------------------------------- SU 20240907T130717.0Z 9016.546724 80 1 29.98 2 71.19 90.17 119.95 97.24 0.00 1 0.00 1 0 17 5.194e-02 5.904e-03 3.062e-02 2.570e-03 3.675938e-01 1.392886e-03 3.913246e-03 -6.000000e+00 3.171477e-02 227.21 -2.00 3.11 -2.00 319.42 0.00e+00 1.303229e-03 3.829387e-04 1.375215e-04 -6.000000e+00 1.452368e-03 293.73 -2.00 20.00 -2.00 318.55 0.00e+00 3.063 0.000 302.00 328.00 3 3.5141e+00 3.9540e-03 3.3974e-02 -6.0000e+00 7.8319e-02 -2.2515e-02 4.6665e-03 1.7183e-02 -6.0000e+00 8.4254e-02 4.8688e-02 3.3889e-03 8.5429e-03 -6.0000e+00 5.0582e-02 -2.8177e-02 1.7760e-03 2.8449e-03 -6.0000e+00 2.1998e-02 5.2794e-04 1.6682e-05 8.5053e-05 3.4456e-05 -6.0000e+00 1.6040e-03 -5.0881e-02 3.6104e-05 11 1 0 11 8 0 100.00 19.86 0.15 -0.05088 -0.05076 463 463 1 5 0 64.740 26.00 20.02 19.86 31.92 24.1 976.64 35296 -19572 16497 -11302 2617 2783 -1650 19060 -16895 7743 -11476 14148 -8123 9216 -2840 -3859 1980 -2188 4207 -2673 8226 -2619 3486 -4894 -1596 1766 -2366 4021 -5712 6676 -696 3877 795 1217 -1574 -3785 1358 -3168 2013 -3528 -996 -2118 -1182 -648 -2023 359 -2304 -340 -822 976 -414 1802 533 -28 1061 107 682 -1356 856 483 1763 1367 1224 1647 184 791 -347 779 1107 1402 226 -279 1132 -615 996 -295 295 35 -12 89 -1111 -1035 -1987 -1222 -1548 -379 -696 367 -332 147 878 486 1125 969 1276 783 644 172 -225 -353 -846 -329 -151 457 -1095 -866 -683 -114 66 304 391 -329 139 -130 662 609 513 520 -358 -244 -665 27 -547 147 -162 442 835 794 602 -206 176 -418 175 -93 -37 -139 216 88 -344 42 -237 54 624 -624 400 -341 66 68 -45 477 -643 251 -458 480 -383 435 -173 -266 140 -171 328 -232 665 -237 308 -495 -167 186 -260 407 -616 653 -79 466 107 170 -222 -546 202 -572 410 -871 -265 -605 -348 -194 -620 108 -713 -103 -253 305 -139 640 205 -11 448 47 304 -616 378 214 801 668 653 930 107 441 -187 416 632 883 156 -201 808 -431 644 -178 164 19 -7 58 -813 -833 -1729 -1117 -1503 -386 -745 400 -364 156 873 453 985 847 1178 799 727 213 -294 -461 -1056 -383 -169 517 -1324 -1102 -909 -158 96 473 639 -551 227 -204 976 864 729 765 -557 -395 -1098 44 -872 226 -241 630 1157 1119 900 -332 297 -735 316 -176 -73 -285 453 189 -737 88 -484 106 SU 20240907T131200.9Z 9016.550010 83 1 20.33 2 70.07 90.55 118.88 97.55 0.00 1 0.00 1 0 17 2.411e-02 6.208e-03 1.985e-02 3.124e-03 3.491075e-01 1.677450e-03 3.748940e-03 -6.000000e+00 1.471786e-02 227.21 -2.00 3.11 -2.00 318.40 0.00e+00 3.327880e-04 3.434569e-04 3.847849e-04 -6.000000e+00 6.742009e-04 293.73 -2.00 20.00 -2.00 317.50 0.00e+00 2.901 0.000 302.00 328.00 3 4.4995e+00 4.5328e-03 3.2195e-02 -6.0000e+00 3.6345e-02 2.8423e-02 5.1815e-03 1.6280e-02 -6.0000e+00 3.9103e-02 9.7378e-03 3.4109e-03 7.9394e-03 -6.0000e+00 2.3475e-02 -1.1272e-02 1.7834e-03 2.2187e-03 -6.0000e+00 1.0206e-02 2.3213e-04 -2.9732e-04 1.0013e-04 2.7991e-05 -6.0000e+00 7.4473e-04 -5.0465e-02 -2.8198e-05 12 1 1 12 9 1 99.98 19.86 0.14 -0.05047 -0.05270 14 22 1 5 0 1354.510 26.00 20.00 19.86 32.18 24.2 976.64 -2104 -6822 -10566 -7215 -10072 -6918 -5938 -2339 -3206 -3456 -11643 -82 140 -4846 -4956 -4976 -1070 -793 -1031 -347 2593 4101 2455 1043 -3137 3616 -3031 -364 1076 -1475 -574 -54 2960 -862 -1252 -1375 229 -952 -257 -2641 -749 -1088 -682 -156 -973 1298 -1552 -36 -229 649 523 977 1040 301 2041 789 196 305 -81 1775 968 2382 1183 1926 -227 1402 -455 153 931 486 238 -336 997 86 -63 -17 -181 -445 -307 -657 -1782 -1298 -1895 -1392 -988 -785 -38 32 594 138 155 -49 241 209 646 765 131 -1 -748 -407 -896 -652 50 -95 -789 -811 -552 -109 222 499 592 63 -91 203 467 1060 821 875 189 -125 -568 32 -437 -62 14 258 809 708 636 292 -589 -193 -23 92 -231 43 293 -153 -385 -199 -118 -131 -92 -346 -576 -369 -493 -320 -288 -123 -188 -216 -811 -5 11 -444 -523 -586 -131 -102 -139 -49 363 574 358 164 -544 612 -546 -62 175 -247 -102 -10 606 -188 -269 -296 53 -255 -80 -959 -292 -450 -290 -67 -423 555 -677 -15 -98 284 241 480 541 165 1143 458 116 181 -47 1030 581 1498 806 1370 -166 976 -309 103 661 377 197 -289 851 72 -50 -12 -125 -303 -218 -512 -1536 -1204 -1867 -1427 -1059 -880 -44 38 698 159 171 -51 239 206 662 845 158 -2 -1004 -543 -1156 -796 58 -113 -991 -1063 -747 -153 323 759 934 101 -144 308 678 1485 1152 1259 284 -195 -899 51 -672 -93 21 364 1115 986 926 448 -946 -316 -39 158 -413 80 548 -290 -733 -374 -217 -234 SU 20240907T131622.9Z 9016.553043 86 1 18.99 2 69.03 90.90 117.90 97.83 0.00 1 0.00 1 0 25 1.980e-02 5.791e-03 1.298e-02 2.347e-03 3.352399e-01 1.258900e-03 3.620784e-03 -6.000000e+00 1.209017e-02 227.21 -2.00 3.11 -2.00 318.17 0.00e+00 7.570289e-04 2.408822e-04 4.323004e-04 -6.000000e+00 5.538447e-04 293.73 -2.00 20.00 -2.00 317.27 0.00e+00 2.767 0.000 302.00 328.00 3 4.1270e+00 3.3773e-03 3.0760e-02 -6.0000e+00 2.9856e-02 5.0751e-03 3.8379e-03 1.5604e-02 -6.0000e+00 3.2122e-02 6.4490e-03 2.4675e-03 7.6314e-03 -6.0000e+00 1.9284e-02 -8.4354e-03 1.2830e-03 2.1403e-03 -6.0000e+00 8.3837e-03 3.9395e-04 -4.0205e-04 7.5064e-05 2.7154e-05 -6.0000e+00 6.1179e-04 -4.9610e-02 -7.4614e-06 12 1 1 12 9 1 99.82 19.86 0.16 -0.04961 -0.05263 21 35 1 5 0 862.730 26.00 20.00 19.86 32.42 24.1 976.66 6096 -7450 1062 -6601 -5804 -7095 -4066 -10461 756 2251 -4847 66 -4455 -1855 -3281 3037 -2120 -713 -1039 -506 1650 1333 792 1488 1350 -2024 -274 -405 505 694 -119 -129 -412 -242 -4301 -2185 -2838 -846 -1014 -1393 -1549 -961 216 -603 433 -492 -760 191 -38 937 491 1121 489 1283 735 903 1158 -45 314 405 2071 1968 2370 1014 -296 211 -520 1077 1163 1327 539 589 206 26 -163 -333 -87 -1351 -917 -967 -1205 -1430 -2037 -1231 -851 -246 -137 164 -22 371 -335 -313 -116 305 -72 424 323 115 -179 -826 -580 -409 -45 66 -571 -800 -736 -262 437 707 561 237 416 120 424 640 881 424 -137 -345 -215 117 -122 76 314 242 354 747 213 194 -150 -463 -99 101 -100 -343 186 -100 -79 -88 -177 -156 297 -456 62 -401 -326 -391 -230 -701 51 157 -371 5 -405 -191 -394 382 -300 -105 -161 -81 266 218 133 263 253 -405 -54 -77 93 128 -23 -28 -96 -58 -1050 -524 -735 -248 -347 -542 -656 -426 98 -279 200 -229 -353 88 -17 437 241 583 270 735 437 550 713 -28 193 249 1293 1299 1667 754 -224 154 -367 748 851 1052 457 516 181 22 -133 -254 -63 -957 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