File name: Pandora155s1_BostonMA_20240621_L2Fit_fout2c2d20231025p1-8.txt File generation date: 20240902T142824.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Jeff Gedes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 155 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora155_OF_v4d20190702.txt Instrument calibration file used: Pandora155s1_CF_v2d20231025.txt Level 1 file used: Pandora155s1_BostonMA_20240621_L1_smca1c2d20231025p1-8.txt Full location name: Boston University Short location name: BostonMA Country of location: USA Location latitude [deg]: 42.3497 Location longitude [deg]: -71.1040 Location altitude [m]: 40 Local noon date: 20240621 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 1 First and last pixel inside fitting window: 232 374 Nominal wavelengths inside fitting window [nm]: 305.1059 305.2467 305.3875 305.5283 305.6692 305.8100 305.9507 306.0915 306.2323 306.3730 306.5138 306.6545 306.7952 306.9359 307.0766 307.2173 307.3580 307.4987 307.6393 307.7800 307.9206 308.0612 308.2018 308.3424 308.4830 308.6236 308.7641 308.9047 309.0452 309.1857 309.3263 309.4668 309.6073 309.7477 309.8882 310.0287 310.1691 310.3096 310.4500 310.5904 310.7308 310.8712 311.0116 311.1519 311.2923 311.4326 311.5730 311.7133 311.8536 311.9939 312.1342 312.2745 312.4148 312.5550 312.6953 312.8355 312.9757 313.1159 313.2561 313.3963 313.5365 313.6767 313.8168 313.9569 314.0971 314.2372 314.3773 314.5174 314.6575 314.7976 314.9376 315.0777 315.2177 315.3577 315.4978 315.6378 315.7778 315.9177 316.0577 316.1977 316.3376 316.4776 316.6175 316.7574 316.8973 317.0372 317.1771 317.3169 317.4568 317.5966 317.7365 317.8763 318.0161 318.1559 318.2957 318.4355 318.5752 318.7150 318.8547 318.9945 319.1342 319.2739 319.4136 319.5533 319.6930 319.8326 319.9723 320.1119 320.2515 320.3912 320.5308 320.6704 320.8099 320.9495 321.0891 321.2286 321.3682 321.5077 321.6472 321.7867 321.9262 322.0657 322.2051 322.3446 322.4840 322.6235 322.7629 322.9023 323.0417 323.1811 323.3204 323.4598 323.5992 323.7385 323.8778 324.0171 324.1565 324.2957 324.4350 324.5743 324.7136 324.8528 324.9920 --------------------------------------------------------------------------------------- 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 20240621T102048.1Z 8938.431112 192 1 51.82 2 78.90 68.31 110.93 249.93 0.00 1 0.00 1 0 17 3.392e-01 1.139e-02 3.304e-01 1.023e-02 6.416311e-01 5.643898e-03 7.665538e-03 -6.000000e+00 1.995882e-01 232.96 -2.00 3.54 -2.00 321.38 0.00e+00 9.312574e-03 2.853480e-03 3.100122e-03 -6.000000e+00 8.968261e-03 286.30 -2.00 20.00 -2.00 320.76 0.00e+00 5.010 0.002 302.00 328.00 3 3.3103e+00 2.0076e-02 6.1469e-02 -6.0000e+00 5.0093e-01 2.0305e-01 2.6938e-02 3.6162e-02 -6.0000e+00 5.4225e-01 -2.3683e-01 2.4963e-02 2.2641e-02 -6.0000e+00 3.2317e-01 8.6623e-02 1.1773e-02 1.1063e-02 -6.0000e+00 1.3581e-01 6.4263e-05 -2.5863e-04 3.0264e-04 1.5548e-04 -6.0000e+00 9.6145e-03 -8.4284e-03 0.0000e+00 12 8 8 10 0 0 88.38 19.15 0.73 -0.00843 -0.01037 19 4 1 5 0 2727.050 22.09 15.00 19.15 30.55 3.3 1015.62 -99036 900000 -182740 -151335 -70207 -34418 -98320 40518 -98369 -85830 -51417 -34331 -27959 -109362 900000 -71802 11197 -58102 -68380 -52930 -24023 12015 -27761 -49150 -81246 11815 32946 -26964 -46718 -37512 -21458 -20433 7059 -15917 -1476 -24620 -4235 12059 -854 -10156 1089 -12070 -441 -148 13261 -476 3711 2833 900000 8841 18842 9535 9542 9027 7370 6973 10216 8231 87 1914 2164 9049 6145 6237 2026 4152 4133 4498 3289 3712 2215 2854 1086 -2655 2465 664 -469 -2330 1392 -1232 -711 -2563 -600 -606 -649 134 397 1123 -322 32 -711 -1309 -1006 121 -2344 -1317 -1043 -547 -733 -136 -1022 -1470 863 -1241 536 -2616 -252 -595 -305 1018 235 -860 519 -234 379 286 -1292 479 156 994 -257 656 954 279 872 307 177 1214 -330 920 -42 546 -414 -572 104 24 229 635 151 -627 -181 -196 -813 -987 900000 -3779 -2263 -700 -343 -980 404 -981 -856 -513 -342 -279 -2726 900000 -1845 142 -1627 -2281 -1583 -544 189 -671 -1546 -3676 217 512 -724 -1577 -1309 -774 -870 260 -763 -59 -1256 -197 564 -55 -830 88 -1141 -41 -14 1129 -48 370 297 900000 990 2124 1261 1374 1403 1217 1190 1709 1386 16 338 404 1768 1407 1580 552 1079 1068 1211 1003 1283 842 1109 419 -994 797 198 -135 -710 468 -504 -337 -1395 -347 -372 -426 93 287 824 -238 22 -468 -814 -606 76 -1709 -1105 -974 -577 -824 -149 -1051 -1418 762 -1151 524 -2788 -279 -684 -386 1421 362 -1392 820 -357 543 398 -1866 717 248 1614 -417 1014 1420 403 1202 424 241 1683 -525 1613 -81 1107 -891 -1266 244 58 573 1602 380 -1515 -410 -434 -1790 SS 20240621T102648.8Z 8938.435287 195 1 50.15 2 77.87 69.24 111.93 250.77 0.00 1 0.00 1 0 17 2.868e-01 7.981e-03 2.760e-01 6.601e-03 6.138304e-01 3.588185e-03 6.897482e-03 -6.000000e+00 1.683874e-01 232.96 -2.00 3.54 -2.00 321.17 0.00e+00 -3.729203e-04 1.689286e-03 1.696702e-03 -6.000000e+00 7.568390e-03 286.30 -2.00 20.00 -2.00 320.53 0.00e+00 4.615 0.002 302.00 328.00 3 3.0660e+00 1.2300e-02 5.7511e-02 -6.0000e+00 4.2292e-01 8.0794e-02 1.6428e-02 3.5557e-02 -6.0000e+00 4.5780e-01 -1.1190e-01 1.5523e-02 1.7145e-02 -6.0000e+00 2.7231e-01 3.7997e-02 7.4225e-03 4.6657e-03 -6.0000e+00 1.1392e-01 1.2952e-04 -3.0814e-05 1.9578e-04 6.2427e-05 -6.0000e+00 8.1336e-03 -8.3861e-03 0.0000e+00 11 8 0 10 0 0 99.02 19.17 0.21 -0.00839 -0.00862 36 7 1 5 0 1392.780 22.09 15.00 19.17 30.81 3.3 1017.78 -44263 -90423 900000 198355 -56471 -62154 -2330 -74124 -110614 -15888 -61826 -109340 -79889 29152 -51866 -10759 -11072 -9340 -35098 -10671 21102 -23863 -51121 -13710 -16377 20077 -24957 -43137 6497 -27591 2921 -10943 -8335 -13 -13488 -20052 4597 -7778 -2971 3523 4957 -2423 -6902 2844 -714 7787 -2112 566 -160 1806 6669 682 -162 -1199 3380 6956 1309 -864 4974 150 5457 3935 7258 4501 4655 364 812 -1377 2277 427 99 987 -2034 2350 -2168 -132 -2590 -1817 -1251 -3348 -1081 -576 -1562 -773 1405 -148 120 95 1755 754 725 734 -866 -786 147 -1029 -103 593 -572 -3 -532 -1764 -104 -153 -2136 -955 -1222 -863 -137 712 610 841 254 377 -166 256 -186 -34 199 -222 -234 -92 359 734 727 -793 352 834 504 290 194 -683 -445 -63 -97 93 212 492 -426 -242 184 17 -382 -285 -748 900000 1277 -363 -400 -15 -647 -1576 -102 -625 -2061 -1396 214 -1049 -168 -193 -176 -920 -231 340 -614 -1733 -378 -504 452 -825 -1647 161 -983 97 -455 -383 -1 -654 -1067 217 -504 -226 296 457 -257 -797 303 -80 812 -247 67 -20 237 930 112 -29 -239 680 1412 288 -193 1020 32 1161 942 1897 1329 1404 111 245 -446 749 163 41 422 -877 911 -801 -46 -878 -631 -490 -1476 -540 -323 -959 -501 954 -109 92 75 1339 555 496 471 -549 -522 109 -888 -101 653 -675 -4 -571 -1736 -95 -144 -2208 -1030 -1398 -1055 -182 1046 977 1394 418 593 -248 369 -274 -53 325 -376 -390 -147 556 1089 1036 -1102 474 1188 810 519 376 -1328 -907 -135 -224 223 521 1221 -1055 -573 409 36 -799 SS 20240621T103215.4Z 8938.439067 198 1 50.72 2 76.93 70.08 112.84 251.52 0.00 1 0.00 1 0 17 2.746e-01 7.784e-03 1.542e-01 4.367e-03 5.698388e-01 2.331381e-03 6.391758e-03 -6.000000e+00 1.611934e-01 232.96 -2.00 3.54 -2.00 320.95 0.00e+00 2.303680e-03 1.036749e-03 1.351014e-03 -6.000000e+00 7.139928e-03 286.30 -2.00 20.00 -2.00 320.29 0.00e+00 4.306 0.001 302.00 328.00 3 2.8450e+00 7.6974e-03 5.2931e-02 -6.0000e+00 4.0486e-01 6.8420e-02 1.0021e-02 3.1199e-02 -6.0000e+00 4.3825e-01 -9.6765e-02 9.1364e-03 1.6096e-02 -6.0000e+00 2.6054e-01 2.9557e-02 4.4365e-03 5.1112e-03 -6.0000e+00 1.0864e-01 2.2623e-04 2.9943e-05 1.2927e-04 6.2601e-05 -6.0000e+00 7.7599e-03 -8.6120e-03 0.0000e+00 11 8 0 10 0 0 90.62 19.19 0.54 -0.00861 -0.00839 48 9 1 5 0 1056.570 22.09 15.00 19.19 31.10 3.3 1020.09 -109024 -99740 -29271 -100283 -63367 -115371 16540 -123021 71 -113762 -63456 -87599 -44376 -53031 -45571 -13938 -29680 -218 -30579 -667 -19630 -3775 -22789 -192 -17978 20162 -21792 -11021 -3765 -8922 637 -12170 12941 -10681 -3658 -9201 -2457 -9730 5172 -822 10897 315 6246 175 1093 2709 1912 8215 -5731 7712 1601 6015 2202 5158 -61 4075 2127 1913 -1649 498 2617 1723 3324 1215 1886 174 3712 73 4213 -12 2080 811 1242 1327 -30 388 -2157 -619 -2891 -1903 -786 110 -2952 -591 -1041 85 -283 674 414 520 594 -704 -416 -928 -356 -893 293 586 383 -878 -290 -1431 -37 -357 -1193 -1160 -793 -251 -213 626 346 -64 51 712 -285 512 51 255 236 -16 -262 -264 474 218 698 146 1070 622 609 -55 226 -334 56 -217 -82 -325 104 264 -140 -26 -154 -33 -342 -1393 -1317 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