File name: Pandora25s1_HoustonTX_20241113_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20241114T061756.6Z 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_20241113_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: 20241113 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 20241113T133418.1Z 9083.565488 197 1 49.64 2 81.01 117.01 129.22 312.33 0.00 1 0.00 1 0 25 3.603e-01 6.241e-03 1.271e-01 2.131e-03 6.387036e-01 1.145589e-03 6.767636e-03 -6.000000e+00 2.077494e-01 225.12 -2.00 3.24 -2.00 321.01 0.00e+00 3.416433e-03 5.477450e-04 5.592713e-04 -6.000000e+00 9.497638e-03 288.68 -2.00 20.00 -2.00 320.38 0.00e+00 6.061 0.003 302.00 328.00 3 9.8634e-01 3.8974e-03 6.7513e-02 -6.0000e+00 5.1342e-01 2.5830e-03 5.3861e-03 3.1590e-02 -6.0000e+00 5.5781e-01 -1.8698e-02 5.3501e-03 1.7346e-02 -6.0000e+00 3.3106e-01 -1.1618e-03 2.5700e-03 7.3571e-03 -6.0000e+00 1.4329e-01 2.6806e-04 -3.5435e-04 6.0005e-05 7.5936e-05 -6.0000e+00 1.0030e-02 -5.2002e-02 2.1603e-04 11 1 0 11 8 0 15.19 24.08 0.30 -0.05200 -0.05466 158 34 1 5 0 314.140 26.62 20.00 24.08 23.74 32.4 1050.00 900000 -114097 -113973 -80834 -73759 -153263 900000 -161062 900000 -120576 -133949 -3408 -118204 -30705 -70954 140745 -18503 26324 -28197 -28718 -10883 -14100 -45022 -30427 -29556 -23599 -20888 -25194 -35438 -22491 20122 -2925 5239 -5505 -10980 1305 5158 42866 4033 -5554 -4208 141 581 2269 5884 4102 -6172 -2813 5388 2468 4202 1711 -313 4834 2210 1131 3183 -2370 1438 -1372 643 -917 1549 2532 739 896 1745 -539 925 1083 1805 1811 10 617 1367 2525 -3068 -569 -747 576 -799 -615 -1507 -740 -1299 -958 235 285 262 1007 962 702 376 -466 -161 15 39 519 98 -488 58 -1079 -910 -606 -288 -906 -995 -827 -242 20 234 452 148 375 101 321 342 2 -188 -287 -524 394 33 78 298 594 110 636 528 77 134 63 -260 214 -264 69 -290 294 -46 -79 19 -328 -38 900000 -675 -742 -382 -303 -1342 900000 -1887 900000 -1207 -1615 -13 -1755 -257 -1106 346 -244 254 -499 -546 -182 -246 -1097 -708 -742 -599 -534 -663 -1018 -617 439 -95 183 -231 -476 50 209 1441 235 -423 -359 13 54 217 556 405 -691 -317 591 297 550 256 -53 842 420 227 649 -513 295 -285 135 -213 397 723 229 275 524 -169 312 415 760 802 4 266 546 909 -1085 -197 -283 251 -408 -355 -958 -495 -924 -722 184 230 212 796 722 499 259 -326 -123 13 38 560 115 -586 67 -1163 -910 -596 -298 -992 -1139 -997 -310 28 354 720 239 594 154 474 502 3 -297 -474 -871 638 52 120 447 867 157 915 820 132 246 122 -525 448 -580 157 -678 695 -109 -186 42 -716 -80 SS 20241113T134605.7Z 9083.573677 202 1 49.52 2 78.75 118.68 130.94 315.19 0.00 1 0.00 1 0 25 1.181e-01 4.732e-03 3.003e-02 9.760e-04 5.389758e-01 5.043633e-04 5.787928e-03 -6.000000e+00 6.730182e-02 225.12 -2.00 3.24 -2.00 320.17 0.00e+00 1.335539e-03 1.828736e-04 3.246808e-04 -6.000000e+00 3.061759e-03 288.68 -2.00 20.00 -2.00 319.46 0.00e+00 4.947 0.001 302.00 328.00 3 7.7698e-01 1.5216e-03 5.5436e-02 -6.0000e+00 1.6589e-01 -8.1368e-03 1.9010e-03 2.6238e-02 -6.0000e+00 1.7988e-01 1.0003e-03 1.6953e-03 1.3095e-02 -6.0000e+00 1.0778e-01 -9.4985e-03 8.6864e-04 4.4756e-03 -6.0000e+00 4.6668e-02 1.0386e-03 -2.2475e-04 2.7604e-05 4.5792e-05 -6.0000e+00 3.2057e-03 -5.2082e-02 2.1112e-04 10 0 0 10 0 0 41.09 24.09 0.29 -0.05208 -0.05377 340 72 1 5 0 145.640 26.62 20.00 24.09 24.66 32.7 1055.40 -9528 -54544 -35934 -36719 -35022 -65328 -10915 -46516 6130 -25570 -44639 -9707 -32530 -17233 -21839 1208 -9822 5485 -11499 2633 -10502 -2777 -7436 -4890 -7084 -6109 -5033 -8559 -4755 -10068 3173 -691 2665 -2050 -3780 -4029 -2689 872 -1932 -1075 -2539 -168 -470 222 39 617 -1419 -119 486 151 1065 916 773 1353 1419 985 1449 -248 1319 -181 485 232 1522 1278 1439 548 328 -532 576 705 615 1001 450 217 439 524 -1158 -810 -957 -749 -1000 -870 -1775 -1411 -987 -637 -70 128 604 850 953 768 436 160 225 247 220 393 237 -41 -77 -499 -694 -376 -729 -911 -964 -723 -366 724 289 306 329 190 0 106 127 24 -238 -206 -526 -211 -8 97 210 495 120 631 533 466 198 85 -40 84 -109 -8 -266 143 -41 -113 -53 -88 -211 -63 -609 -361 -365 -347 -780 -90 -576 57 -323 -715 -121 -625 -358 -590 31 -314 166 -447 94 -445 -110 -322 -226 -335 -306 -256 -439 -228 -533 169 -45 194 -169 -308 -324 -233 87 -243 -149 -406 -28 -84 41 7 116 -277 -23 98 32 248 238 220 387 432 314 476 -83 427 -59 160 84 611 575 683 256 148 -246 285 373 363 623 283 131 245 263 -582 -399 -476 -433 -677 -629 -1426 -1200 -841 -580 -67 127 601 821 862 687 369 135 194 243 236 477 300 -53 -95 -592 -755 -404 -842 -1126 -1188 -945 -514 1055 443 497 538 300 -1 156 186 36 -367 -335 -873 -341 -12 154 319 723 177 934 820 764 341 155 -77 163 -225 -17 -576 316 -91 -247 -110 -181 -419 SS 20241113T135204.5Z 9083.577829 205 1 49.53 2 77.62 119.56 131.78 316.70 0.00 1 0.00 1 0 25 6.790e-02 4.658e-03 1.530e-02 7.389e-04 4.985155e-01 3.789786e-04 5.401420e-03 -6.000000e+00 3.867855e-02 225.12 -2.00 3.24 -2.00 319.78 0.00e+00 9.427748e-04 1.202651e-04 2.975903e-04 -6.000000e+00 1.759559e-03 288.68 -2.00 20.00 -2.00 319.03 0.00e+00 4.528 0.001 302.00 328.00 3 7.1352e-01 1.1010e-03 5.0841e-02 -6.0000e+00 9.5335e-02 -8.1090e-03 1.3372e-03 2.4160e-02 -6.0000e+00 1.0338e-01 -2.9882e-03 1.1185e-03 1.1938e-02 -6.0000e+00 6.1940e-02 -5.9390e-03 5.8280e-04 3.8185e-03 -6.0000e+00 2.6821e-02 1.7168e-03 -1.6491e-04 2.0961e-05 4.0062e-05 -6.0000e+00 1.8423e-03 -5.2367e-02 2.0891e-04 10 0 0 10 0 0 18.80 24.11 0.24 -0.05237 -0.05361 454 96 1 5 0 109.080 26.62 19.99 24.11 25.05 32.6 1057.80 -10792 -16299 -33770 -16222 -33629 -24301 -15442 -26166 -7145 -19119 -20102 -18434 -12862 -12330 -7473 -7324 431 -1285 518 -1650 -900 -5408 -1891 -4069 -4494 -3889 -5160 -2087 -4998 -1804 -2685 2429 -1493 -212 -4513 -3067 -3644 207 -1563 -1626 -1327 -386 -126 -475 624 -154 -357 -386 547 -268 1142 723 886 1018 761 848 800 348 309 547 295 923 1010 1900 1139 657 -5 -401 207 519 686 586 494 365 909 130 -456 -1054 -532 -856 -885 -1084 -1605 -1492 -1027 -640 -231 212 356 908 810 889 484 471 191 219 181 366 379 -85 -116 -661 -626 -555 -465 -1006 -820 -630 -267 515 165 205 171 226 10 208 59 87 -158 -132 -549 -239 -106 167 254 511 220 687 720 393 315 14 22 94 106 -3 -253 95 -65 -153 -129 -107 -314 -117 -218 -577 -227 -513 -330 -207 -449 -116 -382 -421 -414 -330 -391 -254 -292 18 -58 25 -86 -48 -304 -107 -257 -310 -284 -390 -148 -352 -127 -217 217 -146 -22 -473 -311 -406 26 -247 -310 -285 -82 -28 -109 143 -36 -85 -93 134 -69 318 224 299 371 275 319 311 137 119 207 115 388 475 984 624 351 -2 -209 115 310 456 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