File name: Pandora141s1_Calakmul_20240922_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20240923T055853.4Z 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_20240922_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: 20240922 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 20240922T124932.2Z 9031.534401 269 1 10.22 2 75.96 94.83 44.14 286.55 0.00 1 0.00 1 0 17 1.088e-01 7.972e-03 9.816e-02 5.542e-03 4.631746e-01 3.010822e-03 4.898247e-03 -6.000000e+00 6.646700e-02 227.15 -2.00 3.11 -2.00 319.52 0.00e+00 1.780503e-03 8.914648e-04 1.013506e-03 -6.000000e+00 3.040926e-03 293.55 -2.00 20.00 -2.00 318.69 0.00e+00 4.029 0.000 302.00 328.00 3 3.7413e+00 8.6147e-03 4.4251e-02 -6.0000e+00 1.6413e-01 1.3509e-02 1.0303e-02 2.1848e-02 -6.0000e+00 1.7657e-01 1.5774e-02 8.0175e-03 1.1096e-02 -6.0000e+00 1.0600e-01 -1.1595e-02 4.2143e-03 3.4598e-03 -6.0000e+00 4.6096e-02 1.5145e-04 6.7156e-04 1.7411e-04 4.5184e-05 -6.0000e+00 3.3608e-03 -4.7448e-02 2.1278e-04 12 9 1 12 9 1 58.17 19.87 0.21 -0.04745 -0.04240 7 47 1 5 0 1276.100 26.00 20.01 19.87 31.14 26.3 979.92 916 -48662 -15425 -39918 18141 -52954 -16832 25279 -44266 -3110 -47013 -39085 -23767 -7108 -296 4512 5836 1779 5973 -13230 -6960 1025 -5018 -8554 4397 -1784 6956 11600 -7745 18294 -5442 -220 8068 1189 163 -6081 4369 -8698 -671 -3079 -2850 59 -1315 2789 -694 4682 -579 872 -1238 -1094 -1675 344 1255 1181 4257 -2578 3399 -451 1340 334 1888 1751 961 597 1041 693 -1395 2011 1596 476 1039 1529 1035 670 -587 -985 -1541 -2964 -414 -722 -2402 -729 -3126 -90 -718 -65 -1005 317 1437 -117 1494 -916 -724 33 -603 516 111 757 183 -376 -1443 140 429 822 -1258 -1442 -481 -108 541 387 802 169 101 374 -178 273 198 498 46 117 -540 513 107 55 -149 -310 395 628 561 28 -171 -798 107 -308 -152 -160 99 605 -154 -328 64 -93 11 -1097 -270 -863 215 -1204 -291 332 -1247 -64 -1538 -1302 -808 -251 -12 195 276 94 325 -906 -465 65 -348 -657 321 -145 525 823 -651 1252 -515 -23 851 140 19 -765 543 -1427 -121 -659 -674 15 -341 715 -186 1212 -159 239 -354 -326 -538 118 459 458 1682 -1117 1428 -196 568 143 825 822 495 330 585 383 -764 1086 928 307 715 1086 737 462 -386 -603 -894 -1735 -253 -493 -1846 -604 -2808 -83 -698 -66 -1066 341 1527 -123 1480 -878 -667 30 -594 550 130 949 241 -496 -1843 167 494 954 -1545 -1850 -637 -149 780 591 1277 276 163 586 -270 402 291 754 72 190 -884 824 169 85 -223 -455 567 918 867 46 -295 -1425 196 -584 -298 -322 203 1250 -320 -670 127 -181 SS 20240922T130022.8Z 9031.541930 272 1 59.93 2 73.40 95.77 46.53 286.70 0.00 1 0.00 1 0 17 2.238e-02 5.081e-03 3.229e-03 3.214e-04 4.043890e-01 1.731667e-04 4.303810e-03 -6.000000e+00 1.365301e-02 227.15 -2.00 3.11 -2.00 318.90 0.00e+00 7.648743e-04 4.144890e-05 4.038379e-04 -6.000000e+00 6.253239e-04 293.55 -2.00 20.00 -2.00 318.03 0.00e+00 3.445 0.000 302.00 328.00 3 6.4351e-01 4.7885e-04 3.7973e-02 -6.0000e+00 3.3713e-02 3.2490e-03 5.5502e-04 1.8835e-02 -6.0000e+00 3.6280e-02 4.2593e-03 3.9079e-04 9.2757e-03 -6.0000e+00 2.1778e-02 -9.1952e-03 2.0674e-04 2.6496e-03 -6.0000e+00 9.4628e-03 6.2687e-03 -3.5722e-04 1.0256e-05 3.3839e-05 -6.0000e+00 6.9141e-04 -4.7572e-02 -5.3481e-05 10 0 0 10 0 0 94.65 19.87 0.15 -0.04757 -0.05026 1648 1648 1 5 0 36.290 26.00 20.00 19.87 32.58 26.2 980.06 -5464 -5314 -6310 -7546 -7814 -9477 -9484 -5619 -5989 -6723 -7364 -4951 -3083 -1684 -1299 -1195 -424 -390 496 -398 114 349 205 420 -90 -487 -1379 -1778 -741 -392 291 1382 614 -1386 -2304 -2456 -1816 -474 -714 -1352 -1237 -1134 -804 -532 -446 -332 -721 -668 -295 149 527 801 987 688 669 714 653 130 265 603 1267 1769 1982 1233 571 268 244 767 1354 1080 512 292 303 92 -26 -217 -464 -393 -518 -672 -1152 -1637 -1840 -1481 -975 -491 -217 145 104 279 370 404 409 762 509 486 536 155 -282 -523 -708 -644 165 -26 -813 -949 -781 -259 249 548 324 111 37 56 371 716 701 567 89 -327 -343 -144 -48 64 95 95 620 731 357 99 -268 -318 -127 148 -168 -156 107 -54 -98 -143 -60 -49 -144 -157 -197 -230 -223 -269 -287 -185 -221 -267 -307 -219 -155 -100 -91 -95 -36 -36 48 -41 12 37 22 49 -11 -64 -184 -230 -92 -50 40 212 104 -229 -412 -441 -325 -99 -179 -398 -404 -394 -290 -195 -165 -123 -269 -249 -111 58 202 334 442 329 335 370 345 69 139 314 680 1021 1162 781 370 168 146 462 877 784 408 227 234 73 -19 -146 -291 -261 -342 -504 -920 -1461 -1780 -1424 -996 -532 -247 169 121 312 387 418 398 740 500 533 621 199 -365 -674 -913 -767 198 -31 -1002 -1243 -1077 -355 363 815 513 181 59 85 553 1018 997 841 140 -513 -546 -225 -77 98 140 134 894 1078 537 153 -445 -550 -216 265 -318 -295 207 -108 -193 -276 -116 -91 SS 20240922T131025.5Z 9031.548906 275 1 36.02 2 71.04 96.65 48.75 286.89 0.00 1 0.00 1 0 17 2.159e-02 5.299e-03 1.096e-02 1.641e-03 3.606978e-01 8.815148e-04 3.863593e-03 -6.000000e+00 1.317149e-02 227.15 -2.00 3.11 -2.00 318.43 0.00e+00 4.108897e-04 1.828140e-04 3.447781e-04 -6.000000e+00 6.032702e-04 293.55 -2.00 20.00 -2.00 317.54 0.00e+00 3.040 0.000 302.00 328.00 3 3.7942e+00 2.3865e-03 3.3605e-02 -6.0000e+00 3.2524e-02 1.4814e-02 2.7295e-03 1.6789e-02 -6.0000e+00 3.5001e-02 6.5493e-03 1.8096e-03 8.2003e-03 -6.0000e+00 2.1010e-02 -9.1457e-03 9.4814e-04 2.2940e-03 -6.0000e+00 9.1291e-03 4.1041e-04 -4.0116e-04 5.2437e-05 2.8986e-05 -6.0000e+00 6.6703e-04 -4.7585e-02 -5.4447e-05 12 1 1 12 1 1 99.22 19.88 0.15 -0.04759 -0.05060 47 80 1 5 0 750.240 26.00 20.00 19.88 33.92 26.1 980.29 -6987 2018 -5735 -4343 -12687 -7395 -8720 -10024 282 -2187 -2980 -4518 -601 -2608 -2455 -2636 -469 129 339 587 -1130 2540 -749 -183 486 -894 943 -2329 675 -501 2281 1785 -777 -414 -1364 -1782 -1242 390 -636 -650 -934 -369 -647 -944 -773 -630 70 -1214 21 28 537 1004 639 946 911 883 225 701 266 348 1197 1588 1817 1065 468 -179 316 503 1474 1234 534 54 35 136 -67 -158 -509 -454 -784 -940 -1089 -1779 -1714 -1683 -792 -599 -146 -62 74 296 271 210 244 656 337 788 701 241 -243 -525 -591 -513 304 -124 -874 -901 -842 -198 303 626 478 121 10 155 375 457 526 482 143 -195 -120 -104 -83 -43 172 145 747 686 317 101 -326 -224 -226 37 -169 -109 80 -58 -84 -264 47 -72 -302 89 -282 -204 -602 -326 -413 -538 15 -129 -182 -299 -44 -226 -245 -294 -55 16 44 79 -159 350 -110 -28 79 -154 160 -393 108 -82 388 337 -163 -89 -290 -382 -286 102 -197 -229 -360 -149 -271 -402 -331 -270 30 -520 9 12 247 491 332 513 512 510 132 411 155 203 714 1000 1225 757 337 -126 213 339 1044 951 441 46 30 113 -53 -116 -354 -311 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