File name: Pandora141s1_Calakmul_20250114_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250117T185335.4Z 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 v1.8.70 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250114_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: 20250114 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 20250114T151521.2Z 9145.635662 358 1 59.85 2 57.83 131.45 114.22 307.11 0.00 1 0.00 1 0 17 9.589e-03 6.380e-03 7.231e-03 2.816e-03 2.142235e-01 1.494186e-03 2.341953e-03 -6.000000e+00 5.795296e-03 224.50 -2.00 3.11 -2.00 316.87 0.00e+00 4.548625e-04 1.991247e-04 1.515148e-04 -6.000000e+00 2.644374e-04 290.47 -2.00 20.00 -2.00 316.04 0.00e+00 1.872 0.000 302.00 328.00 3 6.2362e+00 3.8781e-03 2.0433e-02 -6.0000e+00 1.4239e-02 6.1365e-02 4.3399e-03 9.7583e-03 -6.0000e+00 1.5356e-02 5.4205e-03 2.5557e-03 4.8097e-03 -6.0000e+00 9.2192e-03 -7.1406e-03 1.2411e-03 1.3802e-03 -6.0000e+00 4.0178e-03 1.3149e-04 -1.7670e-04 9.0929e-05 1.8708e-05 -6.0000e+00 2.9590e-04 -5.1424e-02 4.3716e-06 11 1 0 11 8 0 99.97 19.91 0.30 -0.05142 -0.05275 43 43 1 5 0 1391.680 26.11 20.00 19.91 34.54 36.3 990.41 772 238 -1089 -2703 -1276 2744 -100 435 -1206 807 -589 -1217 -1425 -1873 1972 -2056 -407 227 -27 -46 -790 414 79 2345 -870 1612 -996 -514 1491 -137 2478 2223 2235 -1428 -290 -1651 -28 -425 -273 -244 -1075 -288 -1204 -393 -804 -837 -742 -1002 -820 -614 809 114 1357 1000 1092 914 1076 -355 -139 786 845 1374 1474 1469 216 79 -818 -653 813 114 690 595 811 362 56 492 -1232 -531 -1688 -758 -1610 -1227 -2089 -1901 -990 -101 93 354 531 429 405 -241 -514 -114 71 487 521 1031 -40 -99 -631 -556 -359 -523 -833 -1042 -285 -344 866 1062 661 440 301 39 92 -201 218 58 -196 228 -143 115 36 283 223 -493 88 397 259 -67 -445 -266 -258 304 -193 328 -14 178 -84 106 72 -644 110 37 -173 -415 -177 350 -14 65 -200 137 -102 -217 -277 -410 464 -543 -110 63 -8 -14 -240 125 24 733 -293 545 -341 -168 453 -41 752 720 765 -512 -100 -570 -10 -177 -132 -134 -640 -178 -769 -251 -516 -534 -465 -615 -494 -370 498 74 919 705 788 673 800 -267 -103 580 640 1093 1245 1288 190 66 -648 -506 652 100 645 577 787 343 50 408 -957 -394 -1300 -629 -1470 -1204 -2179 -2069 -1125 -120 116 448 671 528 472 -263 -526 -114 73 535 618 1304 -53 -131 -800 -665 -418 -623 -1046 -1373 -387 -483 1253 1599 1028 688 459 56 126 -264 283 78 -276 335 -215 172 53 404 307 -657 113 510 346 -93 -647 -395 -389 470 -311 546 -23 308 -145 181 121 -1062 SS 20250114T154256.3Z 9145.654818 371 1 2.20 2 53.14 136.78 119.12 311.09 0.00 1 0.00 1 0 17 7.779e-03 6.062e-03 1.038e-03 6.820e-04 1.867524e-01 3.684232e-04 2.075352e-03 -6.000000e+00 4.701069e-03 224.50 -2.00 3.11 -2.00 315.13 0.00e+00 3.292755e-04 3.356619e-05 4.927634e-05 -6.000000e+00 2.145345e-04 290.47 -2.00 20.00 -2.00 314.44 0.00e+00 1.663 0.000 302.00 328.00 3 1.1478e+00 9.3524e-04 1.8078e-02 -6.0000e+00 1.1551e-02 9.3310e-04 1.0343e-03 8.5174e-03 -6.0000e+00 1.2457e-02 3.7046e-03 5.9644e-04 4.1969e-03 -6.0000e+00 7.4787e-03 -4.4784e-03 2.6989e-04 1.2031e-03 -6.0000e+00 3.2588e-03 2.8101e-02 -2.5784e-04 2.1599e-05 1.8201e-05 -6.0000e+00 2.4007e-04 -5.0930e-02 -1.1427e-05 12 1 1 12 1 1 93.34 19.91 0.16 -0.05093 -0.05287 86 2380 1 5 0 25.180 26.11 20.01 19.91 35.23 36.5 990.46 19 -452 -1252 -1951 -2450 -611 -660 958 495 -583 -1430 -1023 -172 462 504 -218 138 477 694 650 540 795 1074 1227 1096 622 -4 -236 541 1054 1375 1891 1040 -886 -1933 -1662 -1491 -545 -342 -790 -1052 -996 -805 -638 -670 -540 -667 -766 -487 5 415 600 839 536 526 572 613 364 291 690 1037 1622 1507 951 208 -229 -263 322 1085 1128 331 247 377 134 96 -40 -492 -412 -554 -608 -1242 -1722 -1892 -1684 -1131 -621 -257 51 -24 160 241 143 22 654 440 508 493 300 -30 -272 -646 -494 -37 0 -650 -767 -709 -309 245 619 476 278 124 57 284 519 529 588 255 -97 -138 -243 -35 290 233 133 554 635 506 289 -214 -192 -251 131 -104 -90 0 -75 -80 -193 -212 -447 6 -145 -407 -600 -740 -172 -192 303 160 -198 -490 -355 -64 178 217 -95 63 221 330 317 268 394 536 636 561 328 -2 -125 266 500 665 965 564 -466 -1051 -888 -804 -318 -223 -561 -816 -771 -638 -508 -533 -425 -513 -599 -370 4 322 468 688 459 442 489 530 314 248 588 908 1501 1428 905 197 -212 -236 279 982 1078 331 258 394 136 95 -38 -444 -352 -488 -561 -1225 -1787 -2013 -1889 -1292 -727 -316 62 -29 194 283 160 23 672 469 565 580 370 -38 -337 -789 -583 -42 0 -788 -952 -922 -403 333 851 679 398 171 75 359 642 649 751 336 -132 -192 -339 -47 389 309 168 695 795 638 387 -289 -265 -342 184 -149 -136 0 -114 -123 -293 -323 -663 SS 20250114T154819.6Z 9145.658560 374 1 30.19 2 52.27 137.92 120.05 311.94 0.00 1 0.00 1 0 17 7.629e-03 5.820e-03 2.769e-04 1.626e-04 1.828664e-01 8.713404e-05 2.022380e-03 -6.000000e+00 4.610558e-03 224.50 -2.00 3.11 -2.00 315.57 0.00e+00 2.672865e-04 8.717770e-06 6.964571e-05 -6.000000e+00 2.103841e-04 290.47 -2.00 20.00 -2.00 314.84 0.00e+00 1.630 0.000 302.00 328.00 3 7.8297e-01 2.2216e-04 1.7716e-02 -6.0000e+00 1.1328e-02 -1.9551e-03 2.4630e-04 8.3301e-03 -6.0000e+00 1.2217e-02 4.1535e-03 1.4213e-04 4.1053e-03 -6.0000e+00 7.3346e-03 -4.7409e-03 6.5430e-05 1.1727e-03 -6.0000e+00 3.1963e-03 4.2108e-02 -8.0483e-05 5.1867e-06 1.7449e-05 -6.0000e+00 2.3542e-04 -5.1311e-02 8.1539e-07 10 0 0 10 0 0 99.96 19.92 0.17 -0.05131 -0.05192 2718 2718 1 5 0 11.010 26.11 20.00 19.92 36.06 36.4 990.46 144 -504 -1326 -2123 -2120 -1236 -218 844 646 -826 -1277 -922 -264 218 232 -158 -130 385 527 579 606 750 858 1046 1050 640 94 -101 581 874 1413 1821 1040 -811 -1878 -1754 -1459 -420 -277 -831 -1073 -920 -756 -710 -512 -532 -788 -768 -392 36 390 697 853 622 499 697 591 211 330 638 1137 1484 1640 956 270 -212 -269 272 1026 977 359 253 330 159 89 -114 -501 -439 -466 -691 -1216 -1734 -1881 -1647 -1062 -647 -306 12 -6 174 237 138 129 554 473 529 516 268 -55 -337 -593 -636 66 -3 -644 -695 -678 -261 205 618 464 269 107 22 231 514 542 578 291 -128 -140 -144 -118 138 264 220 529 644 419 252 -186 -274 -130 162 -75 -89 102 -51 -84 -223 -244 -429 37 -130 -346 -572 -518 -284 -51 217 182 -246 -381 -279 -78 72 85 -63 -54 162 228 257 273 337 389 493 478 300 44 -48 259 375 617 840 509 -408 -919 -845 -753 -229 -165 -570 -804 -673 -565 -534 -383 -395 -572 -578 -286 26 291 548 658 500 412 586 503 180 277 535 979 1354 1496 915 257 -189 -236 231 911 898 360 266 347 162 85 -105 -423 -376 -383 -625 -1150 -1800 -1963 -1811 -1236 -757 -376 15 -8 212 284 151 138 569 504 576 618 330 -71 -433 -722 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