File name: Pandora25s1_HoustonTX_20240414_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240928T004549.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20240414_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20240414 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20240414T125450.4Z 8870.538084 65 1 49.45 2 78.02 85.57 119.80 19.93 0.00 1 0.00 1 0 25 4.837e-01 9.770e-03 1.709e-01 3.431e-03 6.030778e-01 1.836484e-03 6.370518e-03 -6.000000e+00 2.793754e-01 229.43 -2.00 3.24 -2.00 320.91 0.00e+00 2.878638e-03 8.152604e-04 5.238376e-04 -6.000000e+00 1.250022e-02 287.95 -2.00 20.00 -2.00 320.26 0.00e+00 4.671 0.001 302.00 328.00 3 2.7300e+00 6.0777e-03 5.5143e-02 -6.0000e+00 6.9569e-01 -1.2450e-02 8.0290e-03 2.9879e-02 -6.0000e+00 7.5283e-01 -1.2649e-03 7.5039e-03 1.5612e-02 -6.0000e+00 4.4928e-01 -1.9055e-03 3.6508e-03 5.8395e-03 -6.0000e+00 1.9202e-01 1.7194e-04 -6.6465e-04 9.8555e-05 6.4963e-05 -6.0000e+00 1.3151e-02 -3.2657e-02 2.3690e-04 12 8 8 10 0 0 100.00 23.77 0.03 -0.03266 -0.03765 232 49 1 5 0 213.100 26.41 20.00 23.77 26.65 31.3 1100.00 -186774 -70393 -165739 -9336 -150282 -112744 8388 -112642 223668 -94302 -75397 47436 -71811 -54567 -60950 339440 1055 18610 3604 14993 -10490 -31171 -4978 372 -20821 13030 -9070 512 -14883 -641 46016 24375 6830 2516 -4003 12810 12779 49416 4051 -4326 -4413 2937 3052 1674 10520 3651 -605 44 15456 4436 9268 1627 1881 1340 4254 1917 4277 -1851 -985 90 314 -108 -92 899 -143 1394 -671 -547 2477 903 2167 853 1191 -1829 2614 1134 -3685 -1351 1445 352 -376 -1502 -1888 -1163 -1936 -1357 -1004 53 -594 1266 866 1550 674 -22 78 -234 81 236 5 -365 580 -1092 -799 -1137 -145 -842 -1017 -1411 -476 3636 -81 127 216 173 -297 593 182 129 -686 -255 -577 397 109 359 318 521 31 578 4 11 131 -552 -137 451 -103 17 -95 81 59 83 81 -5 -577 -3649 -626 -3353 -54 -2496 -1386 42 -1668 748 -1443 -1038 273 -1287 -1044 -1482 1136 20 336 79 315 -278 -987 -133 10 -733 367 -312 16 -524 -21 1211 885 325 132 -216 600 653 2164 310 -418 -476 318 347 198 1175 443 -78 6 1856 623 1369 285 358 277 907 434 977 -449 -232 21 75 -28 -27 290 -49 461 -222 -185 890 374 977 407 565 -854 1089 435 -1383 -498 569 162 -201 -915 -1256 -813 -1446 -1073 -829 45 -505 1032 668 1117 470 -16 60 -206 80 263 6 -445 671 -1179 -798 -1136 -153 -940 -1191 -1752 -629 5079 -127 209 356 277 -457 869 267 196 -1102 -426 -969 647 173 553 473 751 44 820 6 19 242 -1075 -277 946 -228 39 -225 195 142 196 184 -11 -1220 SS 20240414T125944.6Z 8870.541488 68 1 49.52 2 76.96 86.16 119.44 21.04 0.00 1 0.00 1 0 25 3.163e-01 7.807e-03 1.140e-01 2.533e-03 5.616765e-01 1.350939e-03 5.958021e-03 -6.000000e+00 1.839936e-01 229.43 -2.00 3.24 -2.00 320.63 0.00e+00 1.836552e-03 5.452670e-04 3.071375e-04 -6.000000e+00 8.244354e-03 287.95 -2.00 20.00 -2.00 319.94 0.00e+00 4.317 0.001 302.00 328.00 3 2.5970e+00 4.2894e-03 5.1087e-02 -6.0000e+00 4.5825e-01 -7.2688e-04 5.4964e-03 2.7835e-02 -6.0000e+00 4.9639e-01 -5.8541e-03 4.9628e-03 1.3923e-02 -6.0000e+00 2.9499e-01 -2.7502e-03 2.4662e-03 4.8302e-03 -6.0000e+00 1.2633e-01 2.8611e-04 -6.7432e-04 7.3701e-05 5.1105e-05 -6.0000e+00 8.7653e-03 -3.1822e-02 1.5540e-04 11 9 0 11 8 0 100.00 23.77 0.19 -0.03182 -0.03689 337 71 1 5 0 146.930 26.41 20.00 23.77 26.97 31.3 1100.00 900000 -38258 -88777 11048 -71209 -115630 900000 -115462 219883 -101701 -4303 -64200 -16403 -36628 -10443 150523 -14033 2723 -19205 33096 -20843 -8560 -29561 11196 -24787 15664 -18378 -5668 -14492 -9053 11955 5131 8105 -7863 -2626 -5118 14489 8694 10467 -3146 2495 -985 1672 1848 3986 3729 -3768 -1327 2460 3363 150 3560 -2060 4608 1720 3956 2235 -696 786 -385 503 -1233 2781 43 1041 -530 2381 -1899 2876 453 1537 458 260 -267 958 2204 -3218 1216 -683 617 -1508 -402 -2569 -471 -1375 -912 -682 -104 39 821 1210 325 1376 -646 522 -533 410 -45 354 -308 254 -629 -812 -528 -632 -761 -1164 -701 -709 2473 -213 224 14 310 -48 225 138 -302 -3 -395 -326 -192 342 51 469 373 503 446 482 87 192 -35 -400 514 -199 -59 -250 365 -143 109 -21 -209 -356 900000 -347 -1335 67 -837 -1988 900000 -2433 543 -2296 -44 -1215 -249 -810 -223 910 -394 72 -657 764 -783 -292 -1264 366 -1183 558 -891 -241 -653 -412 520 273 474 -559 -173 -344 899 663 944 -375 315 -137 238 269 577 552 -607 -214 396 567 28 725 -478 1085 438 1028 606 -194 212 -104 139 -377 917 16 401 -201 861 -727 1148 210 772 243 138 -136 449 929 -1330 482 -300 308 -880 -261 -1838 -349 -1090 -765 -598 -93 35 713 988 251 1008 -486 422 -488 420 -52 436 -382 300 -690 -831 -541 -688 -873 -1401 -885 -956 3533 -336 368 24 494 -73 327 200 -456 -4 -652 -541 -312 540 78 695 536 699 630 736 146 345 -66 -783 1040 -426 -133 -570 841 -332 249 -45 -439 -730 SS 20240414T131450.7Z 8870.551975 74 1 49.72 2 73.69 87.98 118.24 24.40 0.00 1 0.00 1 0 25 2.263e-01 1.292e-02 1.159e-01 5.402e-03 4.621041e-01 2.837910e-03 4.945350e-03 -6.000000e+00 1.326284e-01 229.43 -2.00 3.24 -2.00 320.01 0.00e+00 -5.156607e-04 9.186806e-04 7.461638e-04 -6.000000e+00 5.926683e-03 287.95 -2.00 20.00 -2.00 319.26 0.00e+00 3.501 0.000 302.00 328.00 3 4.1695e+00 8.4071e-03 4.1626e-02 -6.0000e+00 3.3130e-01 -6.1359e-03 1.0243e-02 2.2994e-02 -6.0000e+00 3.5902e-01 8.3402e-03 8.3542e-03 1.1129e-02 -6.0000e+00 2.1263e-01 -8.6710e-04 4.2772e-03 3.1997e-03 -6.0000e+00 9.0184e-02 1.4395e-04 7.9332e-04 1.6146e-04 3.5459e-05 -6.0000e+00 6.2471e-03 -3.5437e-02 4.4153e-04 12 8 8 10 0 0 100.00 23.76 0.23 -0.03544 -0.02948 77 16 2 5 0 645.560 26.41 20.00 23.76 27.53 31.2 1100.00 -13370 -36088 -50320 11580 -24868 -52330 900000 -59654 900000 -48085 -31536 184022 -56515 12792 -44846 900000 -7355 34920 312 44970 4984 -5356 3686 -7035 -2496 -2832 -13235 -12419 -11551 -19589 63843 22546 6671 2270 -12478 14616 21310 64556 912 3646 -6399 5388 -2840 5970 7374 3833 -6015 -5555 5871 1284 3757 -1871 853 -966 4059 984 6396 -6881 1811 -1674 2640 -3639 298 -207 -1988 -774 -47 -1950 1854 2307 1562 2632 -395 -457 3938 5172 -6145 692 664 2676 251 -2153 -1821 -824 -402 -3104 293 -676 94 1330 1267 1306 884 -413 -1308 1560 -213 1469 -305 -112 -73 -1202 -1353 -619 1243 112 -1037 -1632 630 -950 229 -81 622 -702 900 179 217 -287 -1303 -255 -857 284 407 1362 -226 1100 -26 1405 15 353 708 -40 -393 1328 -56 -414 67 4 173 -246 178 -1292 13 -213 -781 -1290 170 -460 -1207 900000 -1792 900000 -1574 -921 969 -2550 378 -2543 900000 -370 1306 17 1712 275 -325 216 -488 -179 -215 -1113 -1000 -888 -1658 2898 1645 623 232 -1398 1277 1916 4631 138 631 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