File name: Pandora25s1_HoustonTX_20240826_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240928T021509.2Z 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_20240826_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: 20240826 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 20240826T124451.6Z 9004.531153 229 1 49.39 2 80.31 83.81 8.64 242.94 0.00 1 0.00 1 0 25 3.856e-01 6.107e-03 1.728e-01 2.146e-03 7.114062e-01 1.175711e-03 7.495983e-03 -6.000000e+00 2.256598e-01 229.11 -2.00 3.24 -2.00 321.16 0.00e+00 2.952433e-03 6.005294e-04 3.355822e-04 -6.000000e+00 1.054532e-02 294.23 -2.00 20.00 -2.00 320.47 0.00e+00 5.664 0.002 302.00 328.00 3 1.2719e+00 4.2221e-03 6.6010e-02 -6.0000e+00 5.6211e-01 1.5042e-05 6.0266e-03 3.5324e-02 -6.0000e+00 6.0889e-01 -8.0063e-03 6.0019e-03 1.8915e-02 -6.0000e+00 3.6215e-01 -7.6642e-03 2.8437e-03 8.0521e-03 -6.0000e+00 1.5489e-01 2.6667e-04 -4.2436e-04 5.8773e-05 7.7835e-05 -6.0000e+00 1.0805e-02 -3.4217e-02 2.2017e-04 11 1 0 11 8 0 36.49 24.42 0.36 -0.03422 -0.03741 141 30 1 5 0 350.210 26.94 20.00 24.42 32.29 32.8 1100.00 -190956 27900 -188312 900000 -193236 -27010 900000 -137087 900000 -78689 -161760 -32397 -111748 -55562 -40213 900000 13596 2534 24932 -38337 9499 -57320 -20531 -23457 -16736 -1549 -27858 -25260 -42399 -9865 6615 24067 -5550 11261 -29894 14662 9620 58957 2706 -1879 -1502 43 -4499 -660 6820 -466 -3695 -5935 11582 -2436 6265 -789 3048 3613 4081 1389 3020 -4571 -815 -377 -1322 634 -100 3393 -288 866 906 480 1566 619 1811 1676 1316 -1455 2276 -34 -3750 -2520 341 -478 -574 -1026 -1522 -1495 -769 -808 150 282 512 1339 863 1790 95 285 -110 151 114 397 375 -306 323 -1042 -498 -1663 204 -1119 -461 -1109 192 -65 323 266 554 450 -6 562 -76 -28 -393 -346 -553 -109 57 277 172 534 -45 660 230 203 436 -139 -295 10 105 -321 -134 97 121 9 83 -336 81 -1055 58 -1350 900000 -1357 -56 900000 -772 900000 -316 -1498 -104 -968 -393 -317 900000 90 21 184 -533 92 -1019 -270 -354 -260 -22 -537 -468 -937 -175 123 460 -169 316 -1237 390 300 1356 127 -112 -102 3 -367 -54 528 -40 -341 -589 1029 -254 678 -104 431 559 675 249 553 -906 -152 -69 -253 132 -24 849 -80 237 247 137 492 227 732 713 559 -601 828 -11 -1221 -826 123 -207 -279 -577 -953 -999 -517 -581 113 218 396 995 603 1228 64 198 -82 130 109 436 433 -360 357 -1107 -478 -1597 206 -1216 -525 -1300 244 -89 494 418 881 700 -9 831 -114 -43 -620 -570 -908 -171 91 422 253 755 -65 929 366 352 802 -278 -599 22 233 -756 -312 230 287 22 187 -741 170 SS 20240826T125254.1Z 9004.536737 233 1 49.31 2 78.57 84.78 10.19 248.25 0.00 1 0.00 1 0 25 2.485e-01 6.149e-03 7.825e-02 1.989e-03 6.264925e-01 1.068140e-03 6.684451e-03 -6.000000e+00 1.453948e-01 229.11 -2.00 3.24 -2.00 320.61 0.00e+00 7.585916e-04 4.497450e-04 4.200827e-04 -6.000000e+00 6.724254e-03 294.23 -2.00 20.00 -2.00 319.84 0.00e+00 4.875 0.001 302.00 328.00 3 2.0563e+00 3.4517e-03 5.7197e-02 -6.0000e+00 3.6219e-01 5.1604e-03 4.5573e-03 3.0782e-02 -6.0000e+00 3.9263e-01 -1.2439e-02 4.2167e-03 1.5254e-02 -6.0000e+00 2.3320e-01 -2.1654e-03 2.0938e-03 4.9579e-03 -6.0000e+00 1.0012e-01 2.7591e-04 -8.5840e-04 5.5516e-05 5.0659e-05 -6.0000e+00 6.9291e-03 -3.3151e-02 1.3893e-04 10 0 0 10 0 0 99.38 24.40 0.34 -0.03315 -0.03960 89 19 1 5 0 553.870 26.94 19.99 24.40 32.70 33.0 1100.00 900000 -25497 -113571 -51741 -95741 -87567 900000 -113104 900000 -70330 -105418 -56788 -83727 -47116 -48266 900000 2804 27643 -10351 -7 4957 -14202 -8014 3662 -22283 -6283 -18599 -16228 -18044 -23407 13914 6487 3081 -7995 -14555 2559 5692 28067 -388 -7557 -4282 -174 -1901 4151 5165 1920 -4171 -2494 4969 -573 2709 286 336 2131 2104 1347 2199 -2443 1134 -1513 859 -6 622 2407 828 336 851 -606 1471 1036 1328 1013 836 -236 2411 1163 -2550 -1427 20 -240 -419 -1260 -1861 -1416 -1224 -760 98 445 349 1042 1001 1009 629 7 175 439 -61 338 308 -338 -382 -852 -687 -949 -323 -1014 -870 -728 -58 217 52 494 555 331 87 423 -110 43 -216 -167 -693 -39 -30 285 323 401 139 596 340 430 177 95 -161 286 -289 4 -133 144 -132 -244 56 -111 -113 900000 -101 -1140 -282 -742 -631 900000 -1335 900000 -697 -1544 -597 -1416 -715 -920 900000 44 384 -223 0 102 -353 -200 90 -764 -198 -674 -562 -627 -918 453 267 151 -465 -874 131 314 1495 -33 -812 -503 -21 -247 523 656 257 -604 -367 714 -92 469 56 72 490 513 346 579 -674 296 -400 229 -2 203 858 314 126 313 -232 602 482 674 538 443 -121 1126 501 -1067 -594 9 -124 -249 -844 -1353 -1079 -984 -643 86 399 314 908 829 792 478 6 147 411 -64 391 381 -423 -459 -957 -721 -996 -355 -1174 -1047 -918 -77 312 80 795 898 524 133 624 -163 65 -343 -273 -1142 -62 -47 436 480 581 196 855 525 720 317 178 -311 573 -607 9 -295 322 -296 -539 119 -228 -227 SS 20240826T125850.4Z 9004.540861 236 1 49.60 2 77.29 85.49 11.37 251.32 0.00 1 0.00 1 0 25 2.685e-01 6.331e-03 1.100e-01 2.000e-03 5.747076e-01 1.057256e-03 6.165806e-03 -6.000000e+00 1.553485e-01 229.11 -2.00 3.24 -2.00 320.33 0.00e+00 7.177331e-04 4.025995e-04 4.932254e-04 -6.000000e+00 7.168080e-03 294.23 -2.00 20.00 -2.00 319.53 0.00e+00 4.419 0.001 302.00 328.00 3 2.4984e+00 3.2874e-03 5.2058e-02 -6.0000e+00 3.8587e-01 1.1036e-02 4.1979e-03 2.8275e-02 -6.0000e+00 4.1764e-01 -5.9432e-03 3.6846e-03 1.3794e-02 -6.0000e+00 2.5035e-01 -5.5421e-03 1.8640e-03 4.3747e-03 -6.0000e+00 1.0813e-01 2.8539e-04 -8.6545e-04 5.6420e-05 4.4932e-05 -6.0000e+00 7.3476e-03 -3.3023e-02 1.3137e-04 10 0 0 10 0 0 99.16 24.38 0.18 -0.03302 -0.03953 100 21 1 5 0 495.930 26.94 20.01 24.38 32.80 32.8 1100.00 900000 -38787 -61224 -33410 -60310 -91217 195208 -85671 90389 -84786 -84098 -49811 -63277 -29112 -32630 900000 -9074 12286 -1261 7297 -9048 -4188 -6172 -4540 -15529 -6531 -19937 -5441 -7389 -9531 12188 3249 1527 -3725 -7963 2026 3862 16220 1985 -2880 -1332 -305 -2025 -739 3025 3109 -2847 -2916 3720 1019 2902 1045 640 3267 1815 1448 2631 -1400 345 -355 1294 -402 1091 1441 755 -942 777 -956 1701 622 1433 1156 902 138 1162 1035 -1830 -1034 -713 -418 -1264 -1048 -1880 -1544 -1253 -932 -268 -66 282 1143 1541 905 625 -74 -44 281 97 477 219 -251 -83 -964 -1005 -853 -393 -473 -801 -599 138 661 238 480 494 375 208 245 -412 -392 -503 -285 -417 -35 148 153 328 366 -110 586 208 333 231 -6 -69 372 -73 8 -75 293 2 -286 -123 -204 -223 900000 -328 -680 -281 -604 -1207 381 -1353 322 -1634 -1688 -819 -1428 -597 -840 900000 -245 299 -37 212 -313 -140 -222 -176 -719 -296 -1040 -242 -328 -458 554 186 101 -275 -593 137 283 1256 212 -381 -194 -47 -333 -123 494 516 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