File name: Pandora25s1_HoustonTX_20220910_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T155011.4Z 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 v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220910_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: 20220910 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 20220910T125948.4Z 8288.541533 238 1 49.65 2 78.62 90.93 101.14 266.48 0.00 1 0.00 1 0 25 2.618e-01 5.403e-03 1.089e-01 1.759e-03 5.975351e-01 9.382769e-04 6.322114e-03 -6.000000e+00 1.518714e-01 228.67 -2.00 3.24 -2.00 320.64 0.00e+00 1.098947e-03 4.007276e-04 3.655324e-04 -6.000000e+00 7.219125e-03 293.74 -2.00 20.00 -2.00 319.87 0.00e+00 4.895 0.001 302.00 328.00 3 1.8572e+00 3.0519e-03 5.6552e-02 -6.0000e+00 3.7782e-01 -4.8403e-02 4.0195e-03 2.9345e-02 -6.0000e+00 4.1018e-01 1.8620e-02 3.7269e-03 1.4498e-02 -6.0000e+00 2.4352e-01 -1.5349e-02 1.8463e-03 4.9173e-03 -6.0000e+00 1.0465e-01 3.5494e-04 -3.2140e-04 4.9766e-05 4.9219e-05 -6.0000e+00 7.3981e-03 -4.0376e-03 7.9802e-05 10 0 0 10 0 0 16.07 24.65 0.39 -0.00404 -0.00645 135 29 1 5 0 367.730 27.15 20.01 24.65 31.99 27.4 989.64 900000 172408 -90929 900000 -89196 -49306 900000 -108658 900000 -107203 -65781 4539 -33485 -25317 -6603 96017 7071 14788 7540 -4770 7049 -11229 -7369 -7570 -19998 -267 -17904 -1091 -3199 -31886 13699 13510 3365 -522 -10344 1192 1382 20169 -14 -3265 -3719 2818 1135 1524 2990 628 -2825 -2975 4035 -4009 3649 -626 11 2013 1981 963 727 -2179 -376 -105 -599 453 -82 2431 -5 1024 784 -441 1268 775 559 516 -214 -463 1199 31 -2101 -426 -1367 -225 -848 -1051 -1745 286 -979 -502 500 320 497 1445 1110 800 393 -12 72 585 238 377 107 -222 -245 -921 -610 -828 -361 -780 -780 -826 340 -87 312 564 389 273 -17 330 -63 32 -414 -243 -667 5 -68 79 270 418 283 612 351 318 334 -67 -248 67 -52 -188 -215 168 1 70 -27 -197 -42 900000 296 -766 900000 -663 -254 900000 -1335 900000 -1608 -695 28 -383 -340 -91 562 113 243 144 -110 148 -289 -197 -225 -678 -9 -637 -34 -103 -1400 493 533 169 -28 -596 63 83 1221 -1 -342 -438 333 143 196 387 85 -406 -444 588 -685 647 -130 2 484 505 242 189 -580 -96 -27 -160 133 -28 886 -2 378 287 -171 540 358 283 272 -112 -228 568 14 -874 -179 -654 -118 -520 -732 -1254 214 -797 -434 425 280 431 1262 906 612 292 -9 62 548 257 439 135 -277 -284 -1027 -632 -879 -411 -895 -945 -1072 453 -130 484 913 627 422 -24 486 -94 48 -658 -402 -1100 8 -104 122 401 599 394 885 542 549 600 -129 -478 135 -108 -413 -486 369 3 154 -57 -409 -84 SS 20220910T130549.6Z 8288.545713 241 1 49.37 2 77.32 91.69 102.39 267.22 0.00 1 0.00 1 0 25 1.200e-01 4.686e-03 4.175e-02 1.250e-03 5.441381e-01 6.516589e-04 5.795760e-03 -6.000000e+00 6.886215e-02 228.67 -2.00 3.24 -2.00 320.19 0.00e+00 9.105974e-04 2.367587e-04 3.170481e-04 -6.000000e+00 3.198838e-03 293.74 -2.00 20.00 -2.00 319.36 0.00e+00 4.428 0.001 302.00 328.00 3 1.7353e+00 1.9992e-03 5.1216e-02 -6.0000e+00 1.7078e-01 -3.7713e-02 2.5088e-03 2.6529e-02 -6.0000e+00 1.8506e-01 5.8073e-03 2.1540e-03 1.2939e-02 -6.0000e+00 1.1093e-01 -9.6774e-03 1.0997e-03 4.1049e-03 -6.0000e+00 4.7813e-02 6.5604e-04 -3.5640e-04 3.5299e-05 4.1518e-05 -6.0000e+00 3.2851e-03 -3.8527e-03 6.9556e-05 10 0 0 10 0 0 61.24 24.64 0.35 -0.00385 -0.00653 189 40 1 5 0 261.160 27.15 20.00 24.64 32.48 27.2 992.14 900000 715 -48009 -5761 -66608 -37163 25432 -42728 30018 -54423 -49323 12137 -31652 -6123 -17065 -13099 -4478 4832 -4503 802 -1107 -8837 -6544 -7433 -10353 -5971 -5643 -3773 -3770 -14973 5687 4034 4319 -1760 -5058 1343 -537 6648 -2636 -1282 -2856 2057 185 236 1672 958 -798 -1086 1168 -1816 2178 -131 759 651 454 447 839 -1358 853 -457 1031 504 687 1698 335 369 165 56 902 937 337 832 112 275 526 192 -1597 -890 -887 -849 -773 -1244 -1446 -465 -659 -667 274 241 685 1045 1057 967 573 325 122 279 -42 550 266 -219 -171 -883 -736 -691 -544 -945 -736 -568 89 2 191 208 240 110 163 212 40 23 -15 -354 -522 -111 97 88 345 426 266 725 457 391 235 21 -131 99 -19 -97 -128 79 -129 -180 -23 -184 -30 900000 5 -541 -40 -799 -340 152 -538 207 -940 -852 131 -659 -124 -472 -373 -141 152 -154 28 -40 -347 -269 -340 -529 -309 -292 -184 -182 -882 319 269 326 -146 -416 106 -49 685 -341 -194 -487 356 34 44 315 185 -159 -223 244 -418 499 -34 214 198 146 150 288 -474 285 -154 359 195 281 757 155 164 72 25 450 537 200 509 68 158 293 96 -767 -431 -481 -508 -534 -921 -1162 -393 -598 -613 263 237 668 972 966 824 469 275 114 285 -47 688 340 -278 -212 -1001 -820 -751 -637 -1175 -918 -755 122 3 302 341 389 170 247 309 59 35 -24 -583 -860 -176 149 137 512 607 384 1034 726 660 413 40 -245 194 -38 -206 -270 170 -277 -388 -46 -371 -60 SS 20220910T131125.0Z 8288.549595 244 1 49.44 2 76.10 92.39 103.54 267.90 0.00 1 0.00 1 0 25 8.047e-02 4.839e-03 1.853e-02 9.103e-04 5.023898e-01 4.677878e-04 5.403537e-03 -6.000000e+00 4.615533e-02 228.67 -2.00 3.24 -2.00 319.77 0.00e+00 9.824218e-04 1.483879e-04 1.824100e-04 -6.000000e+00 2.129595e-03 293.74 -2.00 20.00 -2.00 318.91 0.00e+00 4.067 0.001 302.00 328.00 3 1.5428e+00 1.3777e-03 4.7106e-02 -6.0000e+00 1.1447e-01 -3.4288e-02 1.6766e-03 2.4358e-02 -6.0000e+00 1.2402e-01 1.4362e-03 1.3510e-03 1.1870e-02 -6.0000e+00 7.4325e-02 -6.3250e-03 7.0319e-04 3.5871e-03 -6.0000e+00 3.1837e-02 1.1673e-03 -2.6646e-04 2.5774e-05 3.8366e-05 -6.0000e+00 2.1920e-03 -3.9743e-03 6.6747e-05 10 0 0 10 0 0 54.26 24.65 0.30 -0.00397 -0.00598 276 59 1 5 0 179.080 27.15 20.00 24.65 32.88 27.1 993.98 -30574 -17471 -27881 -15657 -48044 -30537 -7536 -23281 -2261 -31938 -27111 1130 -24329 -3521 -4873 -884 -1253 1107 1292 -2270 -2840 -5630 -4344 -4522 -3205 -4771 -2483 -3998 -1069 -9006 1769 1021 1037 -1045 -3889 -1730 -2336 2920 -1857 -1259 -1991 538 -490 130 1029 566 -1113 -435 587 -1199 886 -193 990 1074 1238 434 949 -285 528 147 433 604 1171 1986 736 763 18 334 481 595 588 711 356 317 393 -66 -846 -953 -633 -791 -769 -1162 -1615 -1063 -830 -719 39 161 573 914 939 808 606 457 246 245 205 376 71 -277 -343 -853 -713 -520 -717 -1143 -535 -762 -38 732 381 247 348 100 -5 179 126 -91 -173 -233 -440 -88 6 98 310 456 118 847 343 348 354 65 20 150 -129 -119 -155 109 -36 -250 -28 -223 -150 -417 -235 -434 -203 -799 -434 -95 -396 -35 -714 -602 22 -736 -107 -182 -33 -52 49 61 -118 -151 -312 -253 -289 -218 -347 -177 -276 -71 -692 141 95 109 -115 -421 -187 -288 380 -311 -247 -435 122 -117 31 249 140 -283 -112 154 -316 252 -61 337 394 476 175 390 -118 212 59 182 260 563 1036 395 391 9 172 275 364 393 492 244 206 234 -38 -456 -519 -382 -523 -585 -939 -1418 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