File name: Pandora141s1_Calakmul_20240804_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091024.0Z 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 v1.8.88 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20240804_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: 20240804 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 20240804T123230.2Z 8982.522572 63 1 59.88 2 78.07 75.85 79.67 71.61 0.00 1 0.00 1 0 25 3.415e-01 1.114e-02 2.843e-01 8.303e-03 5.510875e-01 4.691179e-03 5.906967e-03 -6.000000e+00 2.076165e-01 227.36 -2.00 3.11 -2.00 320.82 0.00e+00 6.354080e-03 2.085373e-03 1.464739e-03 -6.000000e+00 1.013067e-02 293.75 -2.00 20.00 -2.00 320.09 0.00e+00 4.688 0.000 302.00 328.00 3 4.7957e+00 1.5656e-02 5.1781e-02 -6.0000e+00 5.1270e-01 8.1230e-02 2.0294e-02 2.6018e-02 -6.0000e+00 5.5280e-01 -7.3782e-02 1.7668e-02 1.5737e-02 -6.0000e+00 3.3171e-01 1.8172e-02 8.7427e-03 7.6306e-03 -6.0000e+00 1.4384e-01 2.5693e-05 -1.1163e-03 2.6872e-04 1.0257e-04 -6.0000e+00 1.0740e-02 -1.2496e-02 -1.0383e-04 12 9 8 11 8 0 99.71 20.87 0.53 -0.01250 -0.02088 17 17 1 5 0 3521.930 26.83 20.00 20.87 30.38 20.4 982.34 -127706 -123343 47326 900000 23720 133472 186445 -5279 -39518 -102280 900000 -50619 -89574 -45286 81239 32755 -59601 -9488 97425 54051 -71915 -61355 7641 -21398 -8920 64119 39661 36258 18485 -25342 4495 11907 -7476 -12705 11548 3430 8774 17436 14869 -1757 -850 -879 -115 -4542 2828 16537 2083 -4108 10510 -7690 16568 6831 9352 3969 1143 3243 -1778 -4848 3294 2264 3320 -2850 1476 3216 1465 2251 4597 1456 1940 -1041 912 333 -46 823 1882 4383 1439 910 -559 -3376 -1876 -630 -1829 -3964 -928 -1846 -937 760 196 662 1543 -1522 -988 17 -1165 78 830 1447 -185 -485 -1202 -624 -571 -82 -304 -2067 -69 -52 857 753 1020 10 -129 808 -521 1703 388 61 -626 100 -384 -342 -343 -333 818 2 1046 665 309 132 -611 -71 -1023 378 -423 647 -431 573 -264 323 -103 -370 -1928 -2038 383 900000 192 1080 1509 -43 -365 -1833 900000 -683 -2187 -913 657 446 -2198 -238 935 828 -3758 -2941 197 -774 -303 1122 882 828 512 -1165 181 520 -437 -809 577 190 512 1109 1150 -183 -97 -107 -15 -622 369 1943 288 -620 1441 -1340 2509 1248 1810 862 267 766 -447 -1249 777 546 838 -840 466 1080 513 768 1516 515 754 -464 429 162 -22 373 779 1630 525 344 -239 -1710 -1067 -394 -1247 -2925 -707 -1501 -789 643 165 536 1166 -1119 -703 12 -953 72 852 1627 -222 -577 -1352 -646 -569 -83 -327 -2383 -82 -66 1171 1120 1610 16 -208 1247 -778 2438 570 94 -1013 166 -635 -553 -538 -507 1194 3 1466 980 498 233 -1152 -138 -2113 811 -957 1507 -1032 1377 -634 750 -230 -801 SS 20240804T123832.5Z 8982.526765 66 1 59.99 2 76.68 76.25 78.36 72.01 0.00 1 0.00 1 0 25 1.471e-01 6.706e-03 2.176e-01 5.095e-03 5.085491e-01 2.847076e-03 5.377658e-03 -6.000000e+00 9.018245e-02 227.36 -2.00 3.11 -2.00 320.50 0.00e+00 3.189768e-03 1.143745e-03 1.182762e-03 -6.000000e+00 4.184217e-03 293.75 -2.00 20.00 -2.00 319.73 0.00e+00 4.233 0.000 302.00 328.00 3 4.4997e+00 9.0381e-03 4.7070e-02 -6.0000e+00 2.2301e-01 -5.0427e-03 1.1557e-02 2.4214e-02 -6.0000e+00 2.4057e-01 2.5693e-02 1.0022e-02 1.3210e-02 -6.0000e+00 1.4357e-01 -2.2334e-02 5.0292e-03 4.8332e-03 -6.0000e+00 6.1728e-02 5.6319e-05 -5.0723e-04 1.6615e-04 6.5582e-05 -6.0000e+00 4.6333e-03 -1.3564e-02 -1.9048e-06 11 8 0 10 0 0 98.73 20.87 0.38 -0.01356 -0.01738 45 45 1 5 0 1332.730 26.83 19.99 20.87 30.56 20.3 982.47 -55241 66586 7904 30778 900000 10340 30505 900000 -76154 -17315 -52446 -16218 3825 32978 60632 31925 47164 -6319 17020 -4590 -2744 -7390 4258 -17915 -4866 -6345 -15190 6107 -14912 -1065 -3615 17631 1128 -7458 6587 -3124 7111 -5058 5514 4104 -1163 5066 -6131 -4667 -3050 -1985 -4061 5080 -1098 -1266 -36 2328 2264 -368 1211 343 2371 -844 290 -1570 648 2305 3307 2292 996 380 -1110 617 24 1227 485 -1447 2182 -805 1016 -2005 1168 -195 52 -814 -1203 -1560 -435 -59 -1333 -663 139 -1149 -401 -76 1894 -316 1600 -139 1201 1798 618 66 -1133 -607 -364 471 546 -33 -1180 -734 -1205 -659 460 864 818 -300 26 -408 825 620 439 626 -811 -69 -408 354 381 176 -52 -534 521 574 143 -320 -642 -291 -67 316 -290 -179 17 176 44 -57 -35 218 -515 331 48 153 900000 57 152 900000 -1318 -184 -831 -208 49 400 682 543 773 -186 431 -150 -91 -261 142 -789 -203 -279 -731 238 -714 -48 -191 879 73 -540 414 -221 509 -482 568 494 -163 714 -1004 -774 -508 -334 -708 832 -198 -243 -8 517 545 -97 329 97 674 -247 83 -461 197 753 1185 891 400 150 -437 248 11 600 257 -805 1159 -419 482 -900 484 -84 25 -444 -744 -1072 -318 -46 -1106 -578 125 -1071 -368 -67 1550 -249 1201 -109 1022 1708 664 78 -1415 -745 -421 503 563 -35 -1337 -872 -1510 -871 647 1307 1309 -495 41 -638 1220 896 645 954 -1309 -114 -675 570 596 268 -76 -767 736 844 228 -554 -1180 -555 -132 653 -632 -402 39 408 101 -129 -76 457 SS 20240804T125455.3Z 8982.538140 72 1 59.71 2 72.91 77.32 74.77 73.03 0.00 1 0.00 1 0 25 4.748e-02 5.014e-03 3.521e-02 2.594e-03 4.066008e-01 1.400334e-03 4.313917e-03 -6.000000e+00 2.886518e-02 227.36 -2.00 3.11 -2.00 319.57 0.00e+00 9.392582e-04 4.094159e-04 6.436869e-04 -6.000000e+00 1.325932e-03 293.75 -2.00 20.00 -2.00 318.71 0.00e+00 3.351 0.000 302.00 328.00 3 4.3724e+00 4.0332e-03 3.7317e-02 -6.0000e+00 7.1297e-02 -1.3523e-02 4.8047e-03 1.9138e-02 -6.0000e+00 7.6838e-02 1.5341e-02 3.5890e-03 9.4439e-03 -6.0000e+00 4.6122e-02 -1.3345e-02 1.8733e-03 2.6760e-03 -6.0000e+00 1.9921e-02 1.6484e-04 -3.1252e-04 8.4916e-05 3.5591e-05 -6.0000e+00 1.4692e-03 -1.2976e-02 -6.4228e-07 11 1 0 11 8 0 99.47 20.87 0.25 -0.01298 -0.01532 94 94 1 5 0 635.130 26.83 20.00 20.87 31.05 20.3 982.75 11200 -4318 -2711 -19091 -39610 -3644 -17451 -9134 -6332 -1564 -5948 -1109 -14164 -2419 -1669 -9874 2949 2981 4645 343 -3881 319 -2722 493 -591 -481 -1531 -802 1849 2794 -1903 -1336 801 -1363 -3884 -2677 47 -1203 1632 -2779 -1637 -1411 -2064 -1304 217 454 165 -622 488 -86 1125 1102 -171 865 803 1134 230 16 -196 397 1187 1911 2197 857 639 353 381 928 976 988 625 291 379 359 92 -95 -666 -54 -622 -763 -745 -1927 -1414 -1158 -886 -476 -215 113 127 480 1109 149 457 781 382 323 613 -75 -474 -735 -783 -687 424 -298 -1160 -1098 -512 -147 507 683 91 333 149 240 173 436 478 385 -136 -41 -47 -9 -195 30 -30 236 269 648 297 5 -374 -373 98 -91 -74 -21 280 -108 130 -172 -113 -140 189 -93 -59 -464 -1097 -72 -427 -233 -174 -43 -180 -35 -592 -107 -86 -613 176 190 307 25 -298 24 -220 41 -53 -45 -144 -73 161 251 -197 -154 98 -175 -500 -349 7 -203 317 -644 -411 -374 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