File name: Pandora64s1_NewHavenCT_20240304_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240305T050900.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240304_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240304 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240304T152158.6Z 8829.640262 301 1 3.03 2 52.74 147.73 86.76 225.75 0.00 1 0.00 1 0 17 1.749e-02 9.589e-03 8.975e-03 4.351e-03 2.559613e-01 2.322160e-03 3.102588e-03 -6.000000e+00 1.048728e-02 225.69 -2.00 3.52 -2.00 316.17 0.00e+00 4.200884e-04 2.521532e-04 5.138030e-05 -6.000000e+00 4.538416e-04 276.16 -2.00 20.00 -2.00 315.61 0.00e+00 1.648 0.000 302.00 328.00 3 4.1602e+00 5.9879e-03 2.1013e-02 -6.0000e+00 2.5980e-02 3.9120e-02 6.6730e-03 1.2967e-02 -6.0000e+00 2.8163e-02 -7.6734e-03 3.8713e-03 6.4310e-03 -6.0000e+00 1.6737e-02 9.5970e-04 1.7948e-03 1.8500e-03 -6.0000e+00 7.1021e-03 1.1474e-03 -7.3386e-05 1.3401e-04 2.3767e-05 -6.0000e+00 5.1963e-04 -1.8881e-03 3.0597e-05 12 9 9 12 1 1 999.00 21.42 0.22 -0.00189 -0.00244 2 12 1 5 0 1010.460 25.90 20.00 21.42 21.19 38.1 1015.50 5653 -499 1608 -5188 -9998 -1925 5360 -2568 3084 930 -2901 -2156 -407 -578 1014 -1280 -927 1652 1077 2683 3255 -2582 2304 962 91 -80 1768 -3021 293 -1507 1646 -389 3244 223 -4041 -3232 -2873 -476 1137 733 -905 -1335 -495 56 -952 428 -965 -23 -482 -906 528 994 92 1044 -4 297 1538 -527 124 -48 1051 1634 915 2966 81 -1297 -963 -1685 -398 2701 840 1600 -497 1172 -17 -181 -785 -186 -666 -41 -1173 -856 -2583 -1922 -656 -135 150 475 1126 569 -457 116 -1467 83 590 583 117 1517 451 -629 -443 -1158 -1377 176 574 -1724 -550 -532 -501 229 960 74 208 244 -91 -145 143 -592 816 268 -94 178 493 -108 1460 785 -1013 312 1278 339 501 -424 -746 -730 412 -163 12 408 987 -727 -56 -1303 1013 -99 314 -980 -1821 -326 910 -524 646 204 -655 -521 -103 -167 306 -424 -315 574 387 982 1187 -994 881 372 37 -33 700 -1231 111 -589 668 -162 1403 98 -1738 -1446 -1366 -258 686 479 -612 -940 -354 40 -682 300 -668 -16 -322 -623 382 727 71 840 -3 240 1240 -428 99 -39 880 1409 848 2700 76 -1130 -836 -1474 -365 2567 830 1606 -498 1141 -16 -159 -648 -156 -588 -38 -1194 -916 -2854 -2157 -758 -164 184 588 1366 675 -521 125 -1555 88 647 679 146 1965 583 -814 -554 -1357 -1640 213 718 -2226 -740 -725 -700 336 1406 108 295 330 -118 -188 188 -797 1127 376 -133 253 680 -146 1920 993 -1297 399 1723 472 705 -615 -1084 -1080 639 -255 19 644 1575 -1140 -87 -1986 SS 20240304T152714.0Z 8829.643912 305 1 6.97 2 52.22 149.24 87.44 226.62 0.00 1 0.00 1 0 17 2.888e-02 1.111e-02 1.381e-02 6.361e-03 2.511655e-01 3.388511e-03 3.053244e-03 -6.000000e+00 1.731933e-02 225.69 -2.00 3.52 -2.00 316.33 0.00e+00 2.949313e-04 3.819273e-04 9.038501e-05 -6.000000e+00 7.495038e-04 276.16 -2.00 20.00 -2.00 315.77 0.00e+00 1.629 0.000 302.00 328.00 3 5.3930e+00 8.7666e-03 2.0727e-02 -6.0000e+00 4.2904e-02 4.9213e-02 9.7723e-03 1.2755e-02 -6.0000e+00 4.6510e-02 -2.5122e-04 5.6887e-03 6.3277e-03 -6.0000e+00 2.7641e-02 -4.8297e-03 2.6574e-03 1.8037e-03 -6.0000e+00 1.1729e-02 3.4176e-04 -1.9176e-04 1.9612e-04 2.3396e-05 -6.0000e+00 8.5817e-04 -2.4476e-03 3.2158e-06 12 9 9 12 33 1 999.00 21.43 0.13 -0.00245 -0.00389 1 3 1 5 0 3483.730 25.90 20.00 21.43 21.33 38.4 1016.46 -777 3248 -2739 -988 -24884 -4034 -1782 -6363 10387 -1256 -6972 -5573 1591 -739 2476 -406 659 1839 621 3482 4304 1205 3076 -418 1375 2024 612 -2408 2718 1968 -224 -3577 4492 172 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-2522 -1161 1510 -414 -1591 886 -1341 -144 505 2034 588 183 60 12 -832 543 51 1453 188 -234 -6 775 444 1950 257 -39 -289 897 560 946 -1543 -1924 -1054 477 -29 -905 700 1511 -327 -696 -1056 SS 20240304T154347.7Z 8829.655413 317 1 48.31 2 50.74 154.15 89.67 229.33 0.00 1 0.00 1 0 17 1.268e-02 8.597e-03 3.360e-03 1.553e-03 2.499272e-01 8.255062e-04 3.036248e-03 -6.000000e+00 7.603062e-03 225.69 -2.00 3.52 -2.00 316.31 0.00e+00 4.681673e-04 9.267952e-05 9.217880e-05 -6.000000e+00 3.289956e-04 276.16 -2.00 20.00 -2.00 315.75 0.00e+00 1.577 0.000 302.00 328.00 3 5.2309e+00 2.1338e-03 2.0286e-02 -6.0000e+00 1.8835e-02 6.0856e-02 2.3801e-03 1.2676e-02 -6.0000e+00 2.0416e-02 -9.4421e-03 1.3851e-03 6.2952e-03 -6.0000e+00 1.2133e-02 -1.1010e-03 6.4685e-04 1.8132e-03 -6.0000e+00 5.1496e-03 4.2202e-04 1.9882e-05 4.8024e-05 2.3255e-05 -6.0000e+00 3.7664e-04 -2.6741e-03 5.0936e-05 11 9 0 11 8 0 99.97 21.46 -0.01 -0.00267 -0.00252 24 6 1 5 0 2012.910 25.90 20.00 21.46 21.51 38.6 1017.48 -1286 -615 -71 -4393 -3372 -2111 -757 -430 1729 -394 -4876 -1837 -210 -980 1602 775 -1075 1000 174 2408 1741 459 2494 1470 823 1140 -122 -1180 -780 -2502 927 678 2311 32 -4264 -2425 -1310 -1266 463 165 -805 -671 -172 -1465 -696 -233 -786 -494 -506 -1319 1371 1218 1281 968 250 500 1351 173 158 644 638 1415 1110 2596 942 -1229 -780 -951 680 1591 739 503 -207 649 365 -903 -671 -2475 -1584 -253 -1193 -1355 -1967 -1669 -490 -439 331 293 1170 616 -59 443 -1319 -267 691 452 52 1209 572 -274 -642 -1598 -1994 238 312 -1403 -433 -345 -25 387 1219 415 204 54 -343 -518 262 -263 477 590 -21 65 814 248 898 586 -1074 316 1035 216 522 -698 -732 -192 515 -135 -168 375 370 -481 -175 -956 -225 -111 -13 -788 -549 -342 -130 -82 349 -83 -1008 -396 -50 -268 479 237 -345 329 59 830 605 161 891 557 325 459 -48 -440 -277 -917 351 272 980 14 -1783 -1042 -593 -670 271 105 -546 -452 -118 -1015 -478 -165 -543 -335 -338 -907 978 881 972 771 195 398 1076 138 124 508 527 1247 1006 2408 851 -1087 -660 -806 599 1541 735 513 -208 639 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