File name: Pandora25s1_HoustonTX_20241125_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20241126T061820.2Z 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_20241125_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: 20241125 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 20241125T134512.7Z 9095.573064 216 1 49.61 2 81.07 120.37 30.79 169.49 0.00 1 0.00 1 0 25 4.815e-01 9.260e-03 1.881e-01 2.854e-03 7.079800e-01 1.560303e-03 7.504122e-03 -6.000000e+00 2.765195e-01 224.77 -2.00 3.24 -2.00 321.30 0.00e+00 1.654653e-03 8.069661e-04 1.659961e-03 -6.000000e+00 1.278574e-02 287.75 -2.00 20.00 -2.00 320.71 0.00e+00 6.097 0.003 302.00 328.00 3 1.3587e+00 5.5722e-03 7.0399e-02 -6.0000e+00 6.8147e-01 3.3057e-02 8.0312e-03 3.8417e-02 -6.0000e+00 7.4063e-01 -7.9232e-02 8.2019e-03 1.8560e-02 -6.0000e+00 4.4223e-01 2.8180e-02 3.8438e-03 7.1033e-03 -6.0000e+00 1.9201e-01 1.6540e-04 -1.6211e-03 7.9214e-05 7.0343e-05 -6.0000e+00 1.3462e-02 -4.8797e-02 4.7987e-05 11 8 0 10 0 0 99.99 24.10 0.25 -0.04880 -0.06098 125 27 1 5 0 396.820 26.62 19.99 24.10 27.14 32.7 1067.46 900000 63582 -234488 900000 -237349 -136355 900000 -161085 34801 -131659 -192736 26138 -158499 -30718 -111209 900000 -63237 -13322 10065 -53437 -22851 -57930 -7462 -61375 -21839 -38358 -24475 -37315 -33868 -29801 47911 36193 -9942 23869 -27095 40809 6776 147038 -10826 -1497 -13459 6941 -1077 6226 23082 6080 -3634 -4275 22922 37 16048 -4087 2632 5566 9299 3453 6184 -6344 2639 -1619 2863 1361 835 5806 -102 5022 -992 2671 2800 2561 1939 2774 1147 -327 3904 2204 -4434 -3612 2477 -159 301 -2001 -1113 -586 -817 -1616 -532 -255 -665 1361 537 1848 -374 -365 -999 663 -773 598 6 -242 -249 -1393 -481 -1495 647 -922 -663 -1629 376 -131 127 195 432 407 301 610 -316 374 -700 -241 -736 421 113 508 310 988 -38 779 248 200 326 -148 58 231 -224 -138 0 138 22 -253 317 -613 -105 900000 177 -3152 900000 -3044 -669 900000 -1291 97 -1012 -2770 73 -2400 -181 -1787 900000 -952 -137 91 -916 -318 -1092 -95 -1413 -375 -836 -480 -819 -712 -654 619 645 -315 594 -1043 832 214 1534 -574 -88 -979 450 -80 448 1504 459 -312 -387 1680 4 1535 -518 347 786 1363 566 1028 -1204 446 -280 485 257 182 1315 -27 1239 -258 695 801 851 727 1044 439 -126 1326 684 -1365 -1112 799 -63 134 -1060 -652 -350 -523 -1117 -384 -190 -500 976 365 1161 -231 -231 -708 539 -714 606 7 -281 -276 -1416 -455 -1394 629 -972 -707 -1880 466 -176 185 308 697 645 455 911 -473 558 -1116 -402 -1232 673 174 756 462 1413 -53 1098 378 349 611 -292 121 494 -514 -328 -1 341 53 -617 724 -1370 -222 SS 20241125T135726.7Z 9095.581559 221 1 49.48 2 78.80 122.14 30.49 175.39 0.00 1 0.00 1 0 25 2.167e-01 5.255e-03 4.791e-02 1.190e-03 5.885666e-01 6.195650e-04 6.308587e-03 -6.000000e+00 1.232752e-01 224.77 -2.00 3.24 -2.00 320.45 0.00e+00 1.141093e-03 2.471858e-04 5.796767e-04 -6.000000e+00 5.593670e-03 287.75 -2.00 20.00 -2.00 319.78 0.00e+00 4.969 0.001 302.00 328.00 3 1.0714e+00 1.9321e-03 5.6868e-02 -6.0000e+00 3.0371e-01 -3.1737e-02 2.4993e-03 2.8940e-02 -6.0000e+00 3.2948e-01 1.6205e-02 2.3430e-03 1.4424e-02 -6.0000e+00 1.9735e-01 -1.4354e-02 1.1743e-03 4.9279e-03 -6.0000e+00 8.5429e-02 7.1993e-04 -3.9807e-04 3.3031e-05 5.0155e-05 -6.0000e+00 5.8792e-03 -5.1614e-02 2.1810e-04 11 1 0 11 8 0 69.74 24.08 0.28 -0.05161 -0.05461 266 56 1 5 0 185.990 26.62 20.00 24.08 28.11 33.0 1073.70 -135783 -53271 -88539 -35210 -90792 -64847 -24216 -66267 3113 -54220 -76566 -34292 -39561 -38851 -24022 25904 -7064 -7172 -11673 -11490 -9235 -15916 -8494 -12797 -13167 -9438 -10772 -7083 -13388 -5972 1209 2099 -869 -950 -8631 -1893 -3267 4555 -945 -1789 -2784 -867 -377 1131 2445 833 -445 -9 2842 -37 1666 573 1004 1299 1393 992 1542 265 493 1007 285 505 977 2032 1323 595 696 -408 286 723 617 757 420 223 914 462 -1247 -1070 -517 -816 -773 -839 -1553 -1613 -1106 -1014 -229 274 138 938 1071 1047 543 93 165 297 22 389 506 -195 -28 -512 -683 -681 -573 -874 -860 -743 -529 985 182 263 248 332 194 256 55 78 -382 -118 -643 -308 -161 184 204 508 103 492 624 350 433 143 -1 -20 -165 -188 -210 119 -37 -78 -3 -59 -177 -1733 -354 -915 -212 -881 -479 -130 -629 17 -583 -1090 -358 -543 -676 -454 358 -154 -160 -297 -311 -255 -474 -247 -429 -488 -361 -431 -267 -526 -230 51 104 -52 -62 -590 -119 -229 351 -88 -204 -366 -121 -56 170 367 130 -72 -2 477 -7 309 121 232 327 375 281 451 79 144 287 84 162 353 763 533 237 270 -163 123 358 342 415 232 126 473 217 -547 -464 -243 -451 -469 -584 -1134 -1255 -914 -898 -212 263 126 875 935 851 421 73 141 290 24 449 642 -254 -35 -579 -743 -731 -657 -1015 -1052 -967 -706 1438 282 434 415 538 298 390 83 116 -608 -198 -1093 -509 -257 282 315 755 147 708 987 595 772 262 -2 -41 -343 -415 -458 265 -84 -170 -6 -121 -364 SS 20241125T140331.5Z 9095.585782 224 1 49.48 2 77.69 123.04 30.45 178.35 0.00 1 0.00 1 0 25 1.991e-01 9.994e-03 2.386e-02 8.662e-04 5.443794e-01 4.465280e-04 5.889000e-03 -6.000000e+00 1.132254e-01 224.77 -2.00 3.24 -2.00 320.08 0.00e+00 2.322167e-03 1.556004e-04 3.053647e-04 -6.000000e+00 5.138570e-03 287.75 -2.00 20.00 -2.00 319.36 0.00e+00 4.554 0.001 302.00 328.00 3 9.4388e-01 1.3310e-03 5.2097e-02 -6.0000e+00 2.7895e-01 -7.4541e-03 1.6466e-03 2.6163e-02 -6.0000e+00 3.0263e-01 -3.0981e-02 1.4301e-03 1.3348e-02 -6.0000e+00 1.8127e-01 1.0588e-02 7.3541e-04 4.7671e-03 -6.0000e+00 7.8452e-02 1.2584e-03 -5.2574e-04 2.4223e-05 4.9537e-05 -6.0000e+00 5.4009e-03 -5.1201e-02 1.8032e-04 12 8 8 10 0 0 89.79 24.08 0.28 -0.05120 -0.05515 361 77 1 5 0 137.050 26.62 20.01 24.08 28.55 32.9 1075.54 -205259 -27090 -39616 -15774 -42606 -44565 5423 -43840 17425 -34061 -11258 -31963 -9068 -15849 -3050 -6656 5433 5337 2325 482 -68 2417 -3002 3009 -6921 5592 -7242 1915 -6559 -1044 2453 3645 4527 3522 -1410 -981 1958 1825 2338 -1968 1871 303 2546 751 3113 2457 1667 1819 2517 2307 2176 2561 1494 3319 1343 1775 680 699 185 720 446 1164 1707 2203 2206 1060 1277 -516 863 440 707 292 319 -84 480 -71 -1363 -1049 -1328 -612 -1296 -905 -1834 -1535 -1441 -947 -705 10 37 708 583 581 320 -180 80 -110 227 96 448 -231 -68 -777 -605 -697 -888 -1062 -810 -767 -428 784 205 437 236 469 70 259 138 163 -143 -114 -428 -95 146 206 488 569 504 736 801 437 480 191 61 68 -132 -81 -400 73 -209 -215 -149 -124 -338 -9724 -277 -496 -153 -494 -513 41 -616 151 -539 -148 -569 -158 -374 -79 -194 172 171 83 19 -3 95 -129 133 -366 277 -418 98 -356 -56 147 255 362 307 -125 -85 180 183 286 -303 314 56 482 149 613 497 346 385 546 529 509 665 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