File name: Pandora141s1_Calakmul_20241228_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20241229T060918.8Z 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 v1.8.60 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20241228_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: 20241228 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 --------------------------------------------------------------------------------------- SS 20241228T133309.9Z 9128.564698 131 1 21.15 2 77.27 120.18 57.36 141.62 0.00 1 0.00 1 0 17 4.760e-01 1.188e-02 2.251e-01 1.016e-02 4.600164e-01 5.634324e-03 4.950459e-03 -6.000000e+00 2.890439e-01 224.76 -2.00 3.11 -2.00 320.02 0.00e+00 -8.341593e-04 1.924737e-03 1.144102e-03 -6.000000e+00 1.366326e-02 290.83 -2.00 20.00 -2.00 319.28 0.00e+00 4.415 0.000 302.00 328.00 3 4.8841e+00 1.6745e-02 4.7710e-02 -6.0000e+00 7.0994e-01 1.8118e-02 2.0475e-02 2.3078e-02 -6.0000e+00 7.6524e-01 -7.3605e-04 1.6915e-02 1.0693e-02 -6.0000e+00 4.5951e-01 -4.2701e-03 8.7689e-03 3.7546e-03 -6.0000e+00 2.0366e-01 3.4424e-05 -7.5375e-04 3.3386e-04 4.0490e-05 -6.0000e+00 1.4976e-02 -6.6489e-02 1.4848e-04 12 9 9 12 9 1 99.99 19.93 0.19 -0.06649 -0.07215 5 17 1 5 0 3523.660 26.00 20.00 19.93 31.14 34.9 982.36 900000 900000 11160 -65851 900000 -99077 -91586 87812 140284 -50755 450845 167179 -45697 900000 32412 25519 10382 -34200 22592 10790 2423 -45118 -5653 14229 12335 13113 175 35812 45357 -8430 13660 18128 5700 -2153 4142 -13054 9832 2221 -2173 -4234 7043 -1331 -1943 2794 9024 -741 -2163 -4114 1396 -416 1238 3148 -2476 178 1703 -1645 3419 -4656 -1957 2837 1477 4725 3851 978 2442 4162 34 -2021 2477 -445 -529 204 1243 -418 -929 -905 -2052 -1241 -320 -191 1543 -2045 -1329 -1376 -1944 -3149 249 484 2720 -316 -1246 560 334 -1935 1859 5 970 1508 -862 343 -2070 665 -256 228 -679 -1518 -1160 230 659 261 754 391 984 555 143 231 342 393 -174 564 -287 584 -954 -362 485 -793 -94 201 566 460 -298 -634 370 -926 -547 -756 12 746 97 136 558 -235 900000 900000 121 -1444 900000 -2730 -2495 869 1388 -1321 4461 1654 -1492 900000 724 699 362 -1951 807 454 114 -3401 -305 687 657 736 11 1620 1833 -572 820 1182 466 -201 363 -1347 878 249 -304 -711 1195 -263 -405 571 1758 -160 -476 -929 306 -97 303 827 -744 56 555 -577 1177 -1738 -705 972 526 1745 1574 443 1133 1868 16 -934 1177 -241 -313 126 766 -253 -532 -478 -1018 -600 -162 -108 976 -1483 -1037 -1138 -1711 -2962 239 477 2638 -308 -1163 486 276 -1628 1605 5 1033 1756 -1087 432 -2560 753 -278 248 -779 -1848 -1472 303 917 390 1189 638 1594 874 216 337 495 584 -271 908 -473 944 -1527 -562 726 -1160 -134 290 862 753 -521 -1156 691 -1815 -1117 -1606 25 1630 213 294 1169 -479 SS 20241228T135553.3Z 9128.580477 140 1 5.71 2 72.68 122.75 54.31 146.34 0.00 1 0.00 1 0 17 1.768e-02 5.894e-03 1.653e-02 2.862e-03 3.537402e-01 1.528143e-03 3.817694e-03 -6.000000e+00 1.071821e-02 224.76 -2.00 3.11 -2.00 318.11 0.00e+00 4.843251e-04 2.884410e-04 3.391991e-04 -6.000000e+00 4.883115e-04 290.83 -2.00 20.00 -2.00 317.28 0.00e+00 3.310 0.000 302.00 328.00 3 2.9521e+00 4.0742e-03 3.5634e-02 -6.0000e+00 2.6349e-02 2.0585e-02 4.6215e-03 1.6323e-02 -6.0000e+00 2.8388e-02 8.2364e-03 3.0031e-03 8.0104e-03 -6.0000e+00 1.7045e-02 -1.0739e-02 1.5719e-03 2.2777e-03 -6.0000e+00 7.4466e-03 7.4781e-04 -8.9796e-04 9.0766e-05 2.8978e-05 -6.0000e+00 5.4543e-04 -6.6074e-02 7.6269e-05 12 1 1 12 9 1 99.63 19.94 0.15 -0.06607 -0.07282 14 158 1 5 0 380.190 26.11 20.00 19.94 31.83 34.5 982.71 5606 -7356 -1698 885 -2536 -4257 -4554 6127 379 -3845 -2014 5988 -6674 -4781 1237 -4006 -231 145 -251 -1474 -1376 -450 1445 2443 -1419 279 1173 -420 -2729 -1105 145 2802 1136 -1672 -2584 -2607 -2141 -708 32 -932 -599 -1011 -1753 636 -339 -222 -763 125 372 498 -393 1031 104 57 1871 1175 1011 121 229 27 1530 1956 1824 1032 934 777 -472 241 826 1189 353 490 195 -222 643 -873 -711 -1114 -1586 -819 -1279 -1186 -1776 -1375 -1140 -894 -435 551 379 84 875 86 380 537 684 156 109 446 -130 -100 -838 -575 -349 -38 -260 -683 -1374 -317 182 662 300 252 298 92 153 50 308 976 231 135 14 -4 230 1 86 -157 130 650 297 438 -269 -405 -318 -55 -197 8 391 202 -221 -161 -132 -329 257 -426 -98 49 -136 -222 -249 338 25 -276 -147 428 -601 -492 139 -528 -32 21 -38 -238 -228 -75 242 428 -273 55 232 -82 -526 -210 29 597 266 -417 -642 -644 -558 -207 11 -360 -252 -450 -811 294 -159 -104 -359 58 174 236 -196 541 58 33 1114 721 632 76 143 17 966 1292 1284 767 707 574 -340 171 610 944 299 431 173 -193 532 -686 -526 -806 -1188 -660 -1123 -1118 -1771 -1424 -1228 -1003 -504 648 447 98 974 92 387 541 711 174 130 566 -172 -133 -1088 -711 -418 -45 -325 -888 -1851 -438 260 986 463 396 464 139 222 71 432 1394 342 207 22 -7 350 2 126 -224 180 907 430 663 -426 -657 -525 -93 -344 14 714 375 -412 -296 -239 -582 SS 20241228T140140.4Z 9128.584496 144 1 25.48 2 71.53 123.45 53.59 147.62 0.00 1 0.00 1 0 17 5.099e-02 8.686e-03 3.374e-02 5.542e-03 3.334153e-01 2.952941e-03 3.643206e-03 -6.000000e+00 3.090538e-02 224.76 -2.00 3.11 -2.00 318.40 0.00e+00 1.337354e-03 6.016047e-04 6.609649e-04 -6.000000e+00 1.408050e-03 290.83 -2.00 20.00 -2.00 317.57 0.00e+00 3.116 0.000 302.00 328.00 3 5.4363e+00 7.9350e-03 3.3605e-02 -6.0000e+00 7.5977e-02 8.6591e-02 9.0583e-03 1.5532e-02 -6.0000e+00 8.1855e-02 2.2752e-03 5.9753e-03 7.6774e-03 -6.0000e+00 4.9150e-02 -1.0759e-02 3.1303e-03 2.2221e-03 -6.0000e+00 2.1471e-02 7.4020e-05 -7.2640e-04 1.7846e-04 2.8302e-05 -6.0000e+00 1.5728e-03 -6.5457e-02 8.9842e-05 12 9 1 12 9 1 99.96 19.95 0.32 -0.06546 -0.07092 6 16 1 5 0 3638.410 26.11 19.97 19.95 32.00 34.9 982.80 15148 -35295 -20455 -3975 -8104 -6971 -1447 -17173 14550 -6589 -21454 -6767 -7116 1811 -4474 788 -2967 -1644 4049 -3165 -1400 7233 6327 4934 -817 -7 -1574 3526 1363 -877 1343 4862 1674 -1740 1841 933 -4172 -4436 2368 703 281 113 -452 -124 411 14 -2424 -2696 459 -39 -44 1846 971 1175 1227 -189 1619 -522 -477 368 1802 1834 1900 1643 923 2294 -2261 -393 196 1468 -114 689 591 -320 727 -679 -1681 -2044 -787 -965 -1866 -998 -2589 -486 -1113 283 588 1016 1389 635 -735 -512 -403 -1890 -450 -341 161 32 624 387 -133 -1785 -686 -1451 -723 -103 -1211 -465 36 1367 1220 762 624 143 190 -388 -25 -397 -32 552 31 734 505 22 496 -25 232 0 650 -226 -430 -673 -294 -65 -255 384 277 427 -50 -142 -31 -830 596 -2509 -1325 -215 -424 -345 -70 -1074 749 -440 -1697 -489 -579 158 -479 90 -379 -219 537 -467 -209 1007 905 752 -139 -1 -282 585 223 -146 232 892 344 -384 386 195 -974 -1192 702 243 107 46 -191 -53 177 6 -1068 -1182 196 -17 -20 885 499 632 684 -109 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