File name: Pandora25s1_HoustonTX_20230526_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T021120.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 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_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20230526_L1_smca1c9d20230101p1-8.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: 20230526 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 20230526T121508.6Z 8546.510516 64 1 48.85 2 80.38 71.08 132.07 6.98 0.00 1 0.00 1 0 25 6.589e-01 3.196e-02 1.979e-01 7.881e-03 7.437693e-01 4.540539e-03 7.908516e-03 -6.000000e+00 3.941099e-01 230.99 -2.00 3.24 -2.00 321.36 0.00e+00 1.427292e-03 2.213053e-03 1.029890e-03 -6.000000e+00 2.047859e-02 291.00 -2.00 20.00 -2.00 320.72 0.00e+00 5.702 0.002 302.00 328.00 3 3.1153e+00 1.6092e-02 6.7532e-02 -6.0000e+00 9.9042e-01 5.6992e-01 2.1462e-02 3.6909e-02 -6.0000e+00 1.0762e+00 -7.6204e-01 1.7961e-02 1.8715e-02 -6.0000e+00 6.3582e-01 3.1746e-01 8.4762e-03 5.5702e-03 -6.0000e+00 2.7596e-01 3.3990e-05 -2.9426e-03 2.2650e-04 7.8016e-05 -6.0000e+00 2.0064e-02 1.1062e-02 0.0000e+00 12 9 8 11 8 0 61.12 24.81 0.56 0.01106 -0.01105 17 4 1 5 0 2872.810 27.26 19.99 24.81 29.77 28.9 1100.00 900000 900000 -144164 900000 -126297 -95052 900000 -155866 900000 -134672 900000 900000 -139006 302069 10739 900000 -47536 900000 110623 12727 900000 -49912 25136 36515 -28192 65627 -33000 -11120 26710 -77673 900000 412633 114337 49411 -17972 166583 900000 900000 43431 26056 -16158 73139 19409 70163 165732 56894 920 -14190 151224 29349 92696 -11228 41366 19954 53766 25811 48701 -17533 25671 -5144 18387 8563 7060 13793 -11791 6437 5129 18691 18569 14552 10746 8836 11687 -1747 15982 10739 -13858 851 -425 4007 3483 -7421 -3601 5929 -1203 -6359 1274 -184 -1894 1916 206 2329 -3504 -393 -8098 2774 -5000 -611 -1602 -3030 2071 -4639 -354 -5929 -2688 -180 -3006 -4358 4279 -1577 -471 -313 3920 -1135 -876 826 452 -180 -1965 0 -1300 2337 3020 2568 1494 4185 -900 2459 -209 1029 1323 -303 72 2880 -955 -1064 784 712 16 -1261 741 -3032 -705 900000 900000 -5856 900000 -3577 -1909 900000 -6357 900000 -5066 900000 900000 -7546 2316 211 900000 -2050 900000 1187 355 900000 -2427 617 856 -1283 1265 -1596 -416 677 -5595 900000 3163 2081 1744 -1139 1786 900000 900000 2245 1849 -1883 3904 1767 3993 3819 3669 101 -1847 4342 2817 5403 -1919 4696 2980 6167 3984 6186 -4101 3860 -1001 2914 1609 1512 3098 -3558 1621 1296 4298 4679 4315 3622 3157 4022 -644 4569 2903 -4401 238 -134 1416 1444 -3871 -1991 3191 -732 -4294 839 -126 -1319 1252 129 1350 -2078 -233 -5697 2030 -4501 -600 -1729 -3372 2111 -4604 -311 -5381 -2495 -173 -3108 -4849 4799 -2062 -673 -476 5872 -1746 -1298 1167 639 -264 -3069 0 -2090 3547 4405 3657 2081 5536 -1211 3291 -314 1704 2386 -590 146 6004 -2161 -2517 1865 1717 39 -3012 1662 -6642 -1460 SS 20230526T122339.9Z 8546.516434 68 1 49.65 2 78.62 72.03 131.84 9.57 0.00 1 0.00 1 0 25 4.116e-01 1.505e-02 6.993e-02 3.301e-03 6.456912e-01 1.818502e-03 6.980638e-03 -6.000000e+00 2.446151e-01 230.99 -2.00 3.24 -2.00 320.83 0.00e+00 4.965531e-03 7.939787e-04 1.616999e-03 -6.000000e+00 1.173992e-02 291.00 -2.00 20.00 -2.00 320.13 0.00e+00 4.896 0.001 302.00 328.00 3 2.7033e+00 5.9753e-03 5.8307e-02 -6.0000e+00 6.1299e-01 1.5051e-01 7.8337e-03 3.2197e-02 -6.0000e+00 6.6392e-01 -2.2866e-01 6.9884e-03 1.7729e-02 -6.0000e+00 3.9320e-01 9.3638e-02 3.4076e-03 6.8728e-03 -6.0000e+00 1.6779e-01 1.3250e-04 -1.4604e-03 9.4474e-05 8.6988e-05 -6.0000e+00 1.1898e-02 1.0493e-02 0.0000e+00 12 8 8 10 0 0 15.57 24.80 0.30 0.01049 -0.00048 45 10 1 5 0 1103.150 27.26 20.00 24.80 30.25 29.1 1100.00 -213707 900000 -149369 900000 -181431 -103824 900000 -169046 900000 -141454 -145162 900000 -100722 19562 -8680 900000 -29928 52406 8368 -18209 59958 -13450 -2172 -5542 -39776 733 -40529 -13751 -2319 -45278 40843 25718 6766 6101 -11745 26443 30079 91183 10125 930 -7044 9802 7328 7941 22626 7111 -1872 -6110 21314 4800 20028 3296 6827 7433 5626 10269 11977 -4845 3456 1274 3805 2207 -234 2642 -2224 987 1836 1540 6685 2689 3990 3221 2196 -1256 2011 532 -5324 -1745 1682 1480 -724 -1887 -2898 -18 -2051 -1919 99 -43 -427 249 -38 246 -1107 -1050 -1405 -119 -1165 166 -920 -762 192 -1811 -272 -2072 415 -1482 -1619 -1324 615 647 -302 438 934 122 -320 1346 183 577 -594 -569 -351 601 691 1173 822 1164 637 1389 524 145 110 -252 -2 1001 -323 -322 -171 168 -241 -340 -116 -605 -332 -6757 900000 -3147 900000 -4580 -1258 900000 -4478 900000 -3387 -3774 900000 -2484 199 -143 900000 -787 704 182 -530 860 -381 -58 -163 -1696 22 -1833 -475 -72 -2280 1097 936 334 319 -702 1110 1338 2712 761 89 -806 1026 823 910 2307 856 -251 -880 2489 697 2781 592 1293 1508 1223 2218 2604 -1226 793 295 892 574 -70 854 -788 334 609 527 2388 1125 1802 1524 1041 -585 843 206 -2045 -656 676 690 -396 -1170 -1964 -13 -1541 -1522 81 -36 -360 203 -30 180 -790 -764 -1119 -106 -1176 184 -1107 -924 222 -1968 -273 -2100 433 -1651 -1887 -1623 795 910 -461 697 1493 192 -486 1957 267 870 -943 -934 -575 959 1073 1770 1208 1659 891 1969 807 245 199 -480 -3 2035 -693 -718 -389 385 -554 -768 -252 -1268 -676 SS 20230526T122943.4Z 8546.520641 71 1 49.44 2 77.37 72.69 131.63 11.39 0.00 1 0.00 1 0 25 3.399e-01 8.023e-03 1.613e-01 2.129e-03 5.949427e-01 1.144254e-03 6.325790e-03 -6.000000e+00 1.992518e-01 230.99 -2.00 3.24 -2.00 320.44 0.00e+00 2.573821e-03 4.471804e-04 6.474789e-04 -6.000000e+00 9.203655e-03 291.00 -2.00 20.00 -2.00 319.70 0.00e+00 4.446 0.001 302.00 328.00 3 2.4512e+00 3.5797e-03 5.3296e-02 -6.0000e+00 4.9721e-01 2.2857e-02 4.5771e-03 3.0220e-02 -6.0000e+00 5.3730e-01 -4.4532e-02 4.1123e-03 1.4673e-02 -6.0000e+00 3.2095e-01 1.1955e-02 2.0592e-03 6.0148e-03 -6.0000e+00 1.3793e-01 2.8218e-04 -9.1671e-04 6.0881e-05 5.4437e-05 -6.0000e+00 9.7081e-03 1.0250e-02 0.0000e+00 11 8 0 10 0 0 0.35 24.80 0.32 0.01025 0.00336 74 16 1 5 0 667.440 27.26 20.00 24.80 30.58 28.9 1100.00 900000 77492 -118603 900000 -143698 -63429 198843 -43582 75043 -55001 -116069 180764 -72022 -12256 -30874 -9799 -21216 6799 26372 -29807 23899 -21176 3860 -12991 -10789 -17147 -12310 -10757 -7031 -17972 21755 20408 1690 -250 -15363 10054 3732 37931 746 -2872 -6363 3477 -2898 1837 4815 1112 -318 -6021 10445 -1176 7018 -2542 2186 291 2089 1888 2993 -2187 819 546 549 1120 156 2306 -1325 1557 -101 1142 1640 1952 1838 602 -171 -631 1295 -145 -1462 -1618 342 -607 -505 -1637 -1339 -490 -710 -1411 -212 -17 -225 1267 683 1809 145 527 -441 618 -261 401 -58 -415 60 -905 252 -839 -69 -994 -858 -910 559 -411 97 -160 508 224 34 592 687 49 -689 -234 -885 105 -37 365 42 830 238 1474 322 156 535 -317 116 376 66 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