File name: Pandora25s1_HoustonTX_20221007_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T043511.3Z 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_20221007_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: 20221007 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 20221007T131507.1Z 8315.552166 190 1 49.48 2 78.66 103.27 132.23 283.33 0.00 1 0.00 1 0 25 3.340e-01 5.192e-03 1.408e-01 1.511e-03 5.684214e-01 7.850592e-04 6.025950e-03 -6.000000e+00 1.907440e-01 227.38 -2.00 3.24 -2.00 320.54 0.00e+00 1.545130e-03 3.236654e-04 3.766763e-04 -6.000000e+00 8.768044e-03 291.93 -2.00 20.00 -2.00 319.79 0.00e+00 4.912 0.001 302.00 328.00 3 1.5820e+00 2.5137e-03 5.5915e-02 -6.0000e+00 4.7196e-01 -7.1830e-02 3.2723e-03 2.7917e-02 -6.0000e+00 5.1187e-01 1.8846e-02 2.9982e-03 1.3802e-02 -6.0000e+00 3.0673e-01 -1.3288e-02 1.4936e-03 4.8881e-03 -6.0000e+00 1.3159e-01 4.8429e-04 -3.7235e-04 4.2472e-05 4.7840e-05 -6.0000e+00 9.0914e-03 -6.8490e-03 1.3578e-04 11 1 0 11 8 0 4.53 24.96 0.35 -0.00685 -0.00965 189 40 1 5 0 261.790 27.35 20.01 24.96 29.62 27.2 976.89 258146 -49813 -43967 -40017 -66672 -92336 188505 -55942 88541 -68954 -79912 -14496 -49425 29764 -25695 25583 -11411 31774 -8740 7872 -11033 -12110 -17894 -7978 -4460 -5688 -15597 -12142 -7138 -26026 11546 -650 3271 -3099 -8914 -1015 -1906 11723 -2700 -1415 -3556 3028 2173 -34 2114 2221 -3482 -1619 488 -980 3666 1876 738 2027 941 612 1440 -2746 1397 -1081 955 -288 600 948 225 553 278 183 648 1204 860 874 410 288 904 147 -1789 -387 -874 -826 -784 -974 -1636 -450 -788 -808 313 247 648 1130 1047 978 476 126 -6 277 60 672 32 -96 -118 -786 -940 -698 -660 -969 -653 -749 -65 298 345 362 420 235 25 184 168 -164 -187 -534 -615 -140 202 196 299 350 168 671 432 510 277 -28 -108 69 -116 -78 -189 75 -111 -168 202 -334 15 380 -334 -295 -247 -500 -915 278 -502 235 -868 -1188 -130 -795 275 -513 360 -260 519 -232 188 -327 -368 -618 -276 -162 -222 -623 -494 -275 -1218 479 -33 183 -193 -565 -61 -130 848 -279 -172 -455 389 296 -5 300 323 -548 -258 79 -174 693 403 175 516 256 175 421 -833 398 -314 285 -90 210 367 90 215 107 73 286 608 446 472 220 157 447 66 -770 -167 -426 -443 -488 -688 -1268 -343 -648 -710 286 233 607 1011 874 762 382 98 -5 276 64 774 40 -118 -145 -880 -981 -743 -758 -1182 -793 -974 -91 439 557 581 669 378 38 267 247 -254 -308 -874 -1007 -234 324 304 445 501 246 1014 691 865 513 -53 -212 136 -247 -174 -416 168 -248 -365 434 -683 31 SS 20221007T132107.8Z 8315.556341 193 1 49.44 2 77.40 104.08 133.42 284.35 0.00 1 0.00 1 0 25 9.599e-02 4.788e-03 2.867e-02 1.059e-03 5.208671e-01 5.471043e-04 5.568952e-03 -6.000000e+00 5.481976e-02 227.38 -2.00 3.24 -2.00 320.12 0.00e+00 1.392546e-03 1.952632e-04 2.979822e-04 -6.000000e+00 2.536369e-03 291.93 -2.00 20.00 -2.00 319.33 0.00e+00 4.454 0.001 302.00 328.00 3 1.4421e+00 1.6608e-03 5.0811e-02 -6.0000e+00 1.3563e-01 -6.3231e-02 2.0701e-03 2.5405e-02 -6.0000e+00 1.4713e-01 1.4202e-02 1.7788e-03 1.2450e-02 -6.0000e+00 8.8184e-02 -1.1294e-02 9.1094e-04 4.2073e-03 -6.0000e+00 3.8076e-02 8.9575e-04 -1.9662e-04 3.0208e-05 4.2174e-05 -6.0000e+00 2.6254e-03 -7.0531e-03 1.2644e-04 11 1 0 11 8 0 14.62 24.96 0.30 -0.00705 -0.00853 271 57 1 5 0 182.410 27.35 20.00 24.96 30.41 27.1 981.13 900000 -23526 -30697 -16460 -56705 -41200 7752 -28254 11657 -31258 -44724 -9670 -18346 -6449 -17095 15281 -4678 8305 -4707 -775 -4009 -8484 -7745 -6842 -1010 -4542 -9307 -6840 -6713 -10977 5742 1187 2635 -604 -5246 -750 -4879 4432 -1283 -1505 -1253 856 61 -225 755 1543 -654 -971 398 -668 917 532 776 1074 740 566 728 -980 403 -569 184 66 760 1875 607 926 23 -3 607 927 581 675 413 348 740 386 -1678 -455 -739 -587 -862 -1193 -1583 -1074 -714 -711 152 202 653 925 1034 750 601 571 201 315 427 626 51 -177 -324 -806 -645 -553 -741 -985 -801 -649 -76 82 423 432 451 127 -16 145 104 -176 -269 -374 -545 -154 45 214 412 375 164 794 516 491 229 -14 -33 48 -20 -209 -74 105 -61 -179 -99 -133 -88 900000 -235 -344 -154 -722 -461 61 -357 114 -489 -828 -147 -370 -143 -505 385 -156 267 -182 -31 -167 -372 -359 -342 -52 -252 -543 -377 -366 -669 346 86 211 -52 -450 -63 -476 472 -174 -238 -218 155 12 -44 148 306 -134 -204 85 -153 227 145 227 336 243 193 253 -346 138 -196 66 26 326 865 289 424 10 -1 307 523 354 424 258 208 413 198 -830 -225 -401 -361 -596 -910 -1289 -911 -638 -669 147 201 645 886 939 647 501 485 185 320 477 763 66 -227 -395 -925 -705 -616 -872 -1209 -1021 -864 -107 122 669 700 727 198 -25 212 153 -267 -426 -613 -895 -248 71 329 616 547 235 1155 805 819 404 -26 -62 94 -41 -436 -156 225 -132 -378 -202 -266 -172 SS 20221007T132643.3Z 8315.560224 196 1 49.49 2 76.22 104.85 134.53 285.33 0.00 1 0.00 1 0 25 8.491e-02 5.003e-03 1.502e-02 8.155e-04 4.831447e-01 4.165456e-04 5.207398e-03 -6.000000e+00 4.848753e-02 227.38 -2.00 3.24 -2.00 319.72 0.00e+00 1.605794e-03 1.290197e-04 1.798695e-04 -6.000000e+00 2.229014e-03 291.93 -2.00 20.00 -2.00 318.88 0.00e+00 4.100 0.001 302.00 328.00 3 1.3435e+00 1.2155e-03 4.6831e-02 -6.0000e+00 1.1997e-01 -4.9432e-02 1.4701e-03 2.3387e-02 -6.0000e+00 1.3012e-01 1.8487e-03 1.1823e-03 1.1485e-02 -6.0000e+00 7.7973e-02 -6.0818e-03 6.1679e-04 3.7904e-03 -6.0000e+00 3.3451e-02 1.4310e-03 -2.6505e-04 2.3235e-05 3.8700e-05 -6.0000e+00 2.3112e-03 -6.9503e-03 1.1867e-04 10 0 0 10 0 0 1.47 24.97 0.30 -0.00695 -0.00894 350 74 1 5 0 141.350 27.35 19.99 24.97 31.24 27.1 984.93 -70376 -11851 -29423 -10314 -36303 -19572 -1572 -19435 -3131 -22276 -23690 -12976 -11034 -5262 -6888 -3533 -2754 2064 -577 -658 -536 -2814 -3509 -2057 -3934 -1534 -5647 -1985 -3084 -4906 335 2753 1067 -731 -3785 -2390 -3890 1099 -1272 -1778 -431 2 732 -579 354 739 -80 -356 594 -197 1299 804 509 952 719 742 375 -425 516 24 423 554 1376 1749 1126 577 205 -151 435 786 664 597 333 234 515 -10 -1067 -1347 -655 -833 -1046 -1059 -1612 -1067 -887 -471 -97 91 620 865 929 713 466 489 448 190 311 387 108 -269 -376 -848 -750 -602 -742 -1027 -579 -658 -96 758 341 321 344 201 58 284 158 -77 -335 -351 -561 -125 -41 146 383 450 208 766 586 424 270 63 -24 12 -63 -140 -70 120 -64 -170 -165 -202 -132 -1628 -172 -532 -145 -612 -282 -21 -355 -55 -502 -562 -312 -320 -178 -263 -150 -127 99 -30 -36 -30 -164 -218 -137 -288 -115 -444 -144 -222 -385 29 266 118 -85 -432 -273 -509 152 -220 -364 -96 0 180 -147 90 191 -21 -95 162 -53 379 260 179 359 285 305 159 -180 212 10 182 244 675 935 616 303 105 -79 251 485 449 419 232 155 312 -6 -587 -745 -398 -555 -803 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