File name: Pandora141s1_Calakmul_20240819_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20260427T091234.3Z 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_20240819_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: 20240819 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 20240819T131440.0Z 8997.551851 274 1 33.72 2 68.86 83.42 114.77 259.29 0.00 1 0.00 1 0 25 2.292e-02 5.980e-03 1.969e-02 3.094e-03 3.407742e-01 1.661675e-03 3.646181e-03 -6.000000e+00 1.398051e-02 227.26 -2.00 3.11 -2.00 318.41 0.00e+00 4.932086e-04 3.396695e-04 2.097470e-04 -6.000000e+00 6.407718e-04 293.76 -2.00 20.00 -2.00 317.51 0.00e+00 2.747 0.000 302.00 328.00 3 5.0854e+00 4.4961e-03 3.0717e-02 -6.0000e+00 3.4528e-02 2.0330e-02 5.1372e-03 1.5804e-02 -6.0000e+00 3.7158e-02 5.9293e-03 3.3707e-03 7.7477e-03 -6.0000e+00 2.2306e-02 -1.0177e-02 1.7604e-03 2.1920e-03 -6.0000e+00 9.6881e-03 1.5158e-04 -3.4979e-04 9.9651e-05 2.7719e-05 -6.0000e+00 7.0816e-04 -4.6055e-02 -9.8454e-05 12 1 1 12 9 1 99.85 19.63 0.28 -0.04605 -0.04868 15 28 1 5 0 2107.000 25.79 19.99 19.63 32.78 22.7 984.03 -4422 8592 -2229 5233 -8843 -7005 2046 -13946 4372 -3716 2214 1115 1030 1413 -4488 -3126 738 1363 -4265 4853 -2248 2763 1970 321 884 -298 1119 -3434 3659 -479 1133 -627 1537 -1984 -4316 -1375 -2731 1089 -883 -628 -2141 -1544 -1500 74 -934 -737 -156 -611 431 980 313 1000 64 1495 1193 878 -20 425 780 -79 2004 1063 2189 328 638 -829 752 513 457 1337 784 709 -28 825 -530 -16 -627 -647 -855 -1100 -838 -1563 -1501 -1786 -915 -708 -220 161 -25 450 -159 960 231 1015 738 352 481 202 -185 -408 -490 -969 549 -125 -948 -479 -779 -210 408 438 93 457 -385 436 415 245 790 -106 127 -73 128 -428 -257 155 -92 62 403 1124 399 359 -599 -259 177 -23 -188 -62 255 -188 25 -326 168 -290 -208 394 -117 246 -443 -336 96 -849 248 -240 139 75 79 126 -486 -371 91 176 -607 660 -335 398 294 52 150 -53 196 -605 585 -80 200 -124 321 -439 -955 -297 -647 289 -280 -226 -851 -643 -644 32 -407 -321 -67 -263 185 428 145 491 34 811 672 509 -12 251 454 -46 1192 676 1482 236 461 -584 502 343 325 1028 647 605 -24 681 -418 -12 -431 -437 -606 -857 -716 -1450 -1472 -1834 -980 -794 -255 190 -29 516 -175 986 227 988 754 389 575 259 -248 -543 -626 -1179 643 -149 -1193 -626 -1059 -294 596 669 147 731 -609 660 600 344 1105 -154 190 -114 202 -671 -396 232 -134 87 555 1560 583 551 -962 -426 297 -40 -337 -115 479 -357 48 -614 308 -522 SS 20240819T132040.5Z 8997.556024 277 1 60.11 2 67.45 83.84 116.10 259.66 0.00 1 0.00 1 0 17 1.129e-02 5.246e-03 4.146e-03 7.811e-04 3.201881e-01 4.186940e-04 3.450956e-03 -6.000000e+00 6.888722e-03 227.26 -2.00 3.11 -2.00 318.16 0.00e+00 2.243525e-04 7.917382e-05 2.595433e-04 -6.000000e+00 3.157123e-04 293.76 -2.00 20.00 -2.00 317.25 0.00e+00 2.586 0.000 302.00 328.00 3 3.2041e+00 1.1228e-03 2.8912e-02 -6.0000e+00 1.7013e-02 4.2452e-03 1.2748e-03 1.4880e-02 -6.0000e+00 1.8308e-02 7.8681e-03 8.1444e-04 7.2642e-03 -6.0000e+00 1.0991e-02 -9.5544e-03 4.2148e-04 2.0288e-03 -6.0000e+00 4.7741e-03 1.2014e-03 -3.0727e-04 2.5158e-05 2.6338e-05 -6.0000e+00 3.4887e-04 -4.6610e-02 -8.7746e-05 11 1 0 11 8 0 99.94 19.62 0.13 -0.04661 -0.04892 332 332 1 5 0 180.960 25.79 20.01 19.62 33.11 22.7 984.07 -1015 -1143 -2233 -4707 -4196 -3792 -3985 -733 -2216 -2204 -3084 -2335 -566 506 1352 -681 -78 -427 665 19 315 -404 188 1011 572 863 -603 -494 86 1354 1416 1746 748 -1230 -2103 -2041 -964 -700 -209 -877 -1164 -1001 -917 -739 -761 -750 -571 -600 -636 -63 623 492 978 494 692 799 621 192 282 659 1341 1730 1686 1222 202 86 53 756 1303 909 380 347 476 109 84 -227 -350 -363 -582 -603 -1134 -1626 -1807 -1488 -981 -634 -265 -29 -84 120 419 351 411 862 622 490 488 139 -203 -364 -642 -592 191 27 -766 -789 -682 -345 348 595 452 99 25 39 309 664 684 565 138 -277 -354 -198 -135 9 195 82 663 689 411 175 -211 -400 -72 167 -235 -79 83 -89 -111 -149 -62 -85 -57 -70 -143 -295 -241 -210 -235 -47 -160 -168 -243 -193 -52 54 163 -93 -11 -66 106 3 53 -70 33 187 113 176 -124 -98 16 252 281 379 177 -305 -512 -496 -253 -214 -70 -343 -503 -456 -431 -352 -363 -358 -269 -280 -296 -30 310 264 557 276 401 476 377 117 169 394 824 1137 1202 926 155 63 37 517 950 741 316 300 411 91 70 -171 -243 -245 -416 -483 -959 -1525 -1825 -1589 -1042 -716 -314 -35 -102 140 454 374 408 843 647 528 586 184 -267 -475 -842 -720 222 32 -977 -1068 -912 -484 514 883 706 158 38 60 443 901 927 799 207 -440 -541 -317 -209 13 276 119 920 970 580 266 -340 -631 -117 284 -422 -140 152 -165 -207 -271 -115 -152 SS 20240819T132749.1Z 8997.560985 280 1 60.07 2 65.77 84.33 117.69 260.10 0.00 1 0.00 1 0 25 9.231e-03 5.656e-03 6.311e-04 1.851e-04 2.967246e-01 9.942418e-05 3.198530e-03 -6.000000e+00 5.632337e-03 227.26 -2.00 3.11 -2.00 317.34 0.00e+00 3.854568e-04 1.503423e-05 1.155540e-04 -6.000000e+00 2.581305e-04 293.76 -2.00 20.00 -2.00 316.44 0.00e+00 2.419 0.000 302.00 328.00 3 7.5610e-01 2.6177e-04 2.6938e-02 -6.0000e+00 1.3910e-02 2.8247e-03 2.9397e-04 1.3672e-02 -6.0000e+00 1.4969e-02 1.9515e-03 1.7715e-04 6.6889e-03 -6.0000e+00 8.9862e-03 -5.3717e-03 8.8518e-05 1.8880e-03 -6.0000e+00 3.9035e-03 1.6863e-02 -3.3065e-04 5.9209e-06 2.4602e-05 -6.0000e+00 2.8524e-04 -4.6877e-02 -9.5558e-05 10 0 0 10 0 0 92.72 19.63 0.16 -0.04688 -0.04936 2263 2263 1 5 0 26.480 25.79 19.98 19.63 33.50 22.7 984.14 -1223 -1343 -2191 -3024 -3394 -2655 -1660 -776 -608 -2459 -2361 -1786 -762 -314 -157 -592 -335 138 171 345 268 642 682 686 770 248 -416 -552 300 683 1434 1961 1052 -785 -1859 -1481 -1366 -159 -87 -736 -1007 -811 -652 -515 -289 -357 -642 -611 -222 158 522 688 845 581 423 706 539 217 396 707 1229 1518 1613 903 273 -58 95 622 1242 880 197 121 98 14 -25 -84 -275 -35 -113 -450 -1072 -1666 -1942 -1639 -1117 -770 -441 -96 -139 214 385 539 597 1027 729 634 496 98 -305 -503 -656 -571 222 118 -683 -828 -779 -329 132 428 180 11 -33 21 419 775 789 625 178 -348 -318 -277 -134 71 264 290 777 912 514 282 -113 -192 -22 210 -86 -149 48 -159 -197 -290 -203 -247 -116 -140 -235 -311 -323 -242 -158 -82 -71 -307 -300 -237 -112 -49 -28 -117 -70 30 39 81 64 155 169 179 213 71 -119 -152 78 176 389 578 337 -261 -608 -481 -482 -60 -39 -355 -535 -454 -376 -300 -168 -208 -370 -347 -124 90 312 411 537 390 294 503 390 157 283 503 901 1116 1281 762 232 -47 72 466 989 736 180 115 93 13 -21 -69 -208 -27 -87 -389 -983 -1692 -2005 -1788 -1225 -898 -540 -115 -165 257 430 583 602 1075 765 733 605 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