File name: Pandora177s1_WestportCT_20230212_L2Fit_fout2c3d20221101p1-8.txt File generation date: 20240313T194730.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 177 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora177_OF_v3d20201002.txt Instrument calibration file used: Pandora177s1_CF_v3d20221101.txt Level 1 file used: Pandora177s1_WestportCT_20230212_L1_smca1c3d20221101p1-8.txt Full location name: Westport - Sherwood Island State Park CTDEEP (USEPA AQS ID 09-001-9003) Short location name: WestportCT Country of location: USA Location latitude [deg]: 41.1183 Location longitude [deg]: -73.3367 Location altitude [m]: 4 Local noon date: 20230212 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: None First and last pixel inside fitting window: 218 360 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1790 305.3198 305.4607 305.6015 305.7423 305.8831 306.0238 306.1646 306.3054 306.4461 306.5868 306.7276 306.8683 307.0090 307.1497 307.2904 307.4310 307.5717 307.7124 307.8530 307.9936 308.1343 308.2749 308.4155 308.5561 308.6967 308.8372 308.9778 309.1184 309.2589 309.3994 309.5400 309.6805 309.8210 309.9615 310.1019 310.2424 310.3829 310.5233 310.6638 310.8042 310.9446 311.0850 311.2254 311.3658 311.5062 311.6466 311.7869 311.9273 312.0676 312.2079 312.3482 312.4885 312.6288 312.7691 312.9094 313.0497 313.1899 313.3302 313.4704 313.6106 313.7508 313.8910 314.0312 314.1714 314.3116 314.4517 314.5919 314.7320 314.8721 315.0123 315.1524 315.2925 315.4325 315.5726 315.7127 315.8527 315.9928 316.1328 316.2728 316.4129 316.5529 316.6928 316.8328 316.9728 317.1128 317.2527 317.3926 317.5326 317.6725 317.8124 317.9523 318.0922 318.2320 318.3719 318.5118 318.6516 318.7914 318.9313 319.0711 319.2109 319.3507 319.4904 319.6302 319.7700 319.9097 320.0494 320.1892 320.3289 320.4686 320.6083 320.7480 320.8876 321.0273 321.1669 321.3066 321.4462 321.5858 321.7254 321.8650 322.0046 322.1442 322.2837 322.4233 322.5628 322.7024 322.8419 322.9814 323.1209 323.2604 323.3998 323.5393 323.6788 323.8182 323.9576 324.0971 324.2365 324.3759 324.5153 324.6546 324.7940 324.9334 --------------------------------------------------------------------------------------- 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 20230212T133008.0Z 8443.562592 293 1 23.50 2 74.26 124.87 76.05 233.86 0.00 1 0.00 1 0 17 3.675e-01 1.211e-02 1.985e-01 7.235e-03 4.740563e-01 3.854451e-03 5.702578e-03 -6.000000e+00 2.191649e-01 224.77 -2.00 3.51 -2.00 320.35 0.00e+00 7.582737e-03 1.360414e-03 1.933122e-03 -6.000000e+00 9.585086e-03 275.07 -2.00 20.00 -2.00 319.83 0.00e+00 3.623 0.001 302.00 328.00 3 3.8899e+00 1.1331e-02 4.3512e-02 -6.0000e+00 5.4161e-01 5.9437e-02 1.3947e-02 2.4551e-02 -6.0000e+00 5.8945e-01 -5.1857e-02 1.2738e-02 1.7341e-02 -6.0000e+00 3.4958e-01 1.5611e-02 6.4851e-03 1.0078e-02 -6.0000e+00 1.4608e-01 1.6455e-04 -1.2239e-04 2.3480e-04 1.1842e-04 -6.0000e+00 1.1249e-02 8.4993e-03 -5.8484e-05 12 9 9 12 1 1 71.49 23.33 0.40 0.00850 0.00758 8 4 1 5 0 2591.420 26.73 19.97 23.33 5.01 18.2 883.46 167294 -61578 900000 -81818 -20938 -66521 900000 325744 4837 -55907 -92481 75819 -52615 62244 -11147 39392 -14533 3746 3105 20307 20639 -9487 -3329 -4714 16898 -24245 15627 -20431 -12374 -24615 -14977 13614 -12872 8777 -2785 13394 -12474 19818 5649 -9072 -844 -8266 -1434 -6182 1786 6059 13823 -2201 1736 275 4117 11236 -1028 3818 -913 8965 2030 -3353 1557 -2572 3386 3049 4800 873 3700 -3580 -318 -637 2597 2571 -1256 1850 -2342 1912 -2610 1416 1016 -1823 -230 -2211 647 -2593 -2231 -2075 1188 287 85 1159 256 1549 -166 2215 -3381 1207 812 -358 -326 -371 1101 -1831 -39 -2067 259 76 -214 -2139 -2074 -491 -1044 1385 413 769 -404 518 149 498 -38 481 820 131 900 -535 1264 727 273 705 -1048 313 24 898 -1439 -845 -901 526 488 -125 119 -110 341 -232 74 -803 354 1180 -1175 900000 -2003 -261 -1242 900000 2297 54 -1206 -2993 535 -1528 723 -333 833 -591 138 124 716 745 -464 -155 -231 701 -1569 681 -1263 -708 -1675 -1044 830 -1153 666 -235 950 -1227 1644 645 -1389 -132 -1502 -256 -1195 327 1086 2334 -444 345 58 899 2499 -280 1053 -275 2522 622 -1080 471 -811 1112 1031 1773 366 1564 -1594 -131 -266 1136 1260 -699 1041 -1370 1026 -1358 684 457 -834 -112 -1257 387 -1792 -1669 -1650 972 252 79 1098 244 1411 -144 1750 -2667 913 667 -336 -346 -441 1384 -2391 -47 -2334 269 79 -238 -2573 -2628 -648 -1494 2109 646 1240 -654 792 228 726 -55 726 1304 207 1427 -844 2000 1116 406 997 -1464 442 37 1504 -2508 -1534 -1706 1034 1014 -275 269 -252 775 -518 158 -1641 702 SS 20230212T134140.3Z 8443.570605 300 1 48.43 2 72.50 127.15 77.81 235.97 0.00 1 0.00 1 0 17 2.296e-01 9.593e-03 1.861e-01 6.026e-03 4.377640e-01 3.193217e-03 5.138314e-03 -6.000000e+00 1.358445e-01 224.77 -2.00 3.51 -2.00 320.16 0.00e+00 1.937223e-03 1.041952e-03 1.390862e-03 -6.000000e+00 5.884092e-03 275.07 -2.00 20.00 -2.00 319.60 0.00e+00 3.279 0.001 302.00 328.00 3 4.3321e+00 9.2767e-03 3.9860e-02 -6.0000e+00 3.3570e-01 2.0059e-02 1.1199e-02 2.3332e-02 -6.0000e+00 3.6526e-01 1.8916e-02 9.8307e-03 1.2555e-02 -6.0000e+00 2.1727e-01 -2.1563e-02 5.0582e-03 4.2006e-03 -6.0000e+00 9.0762e-02 1.5601e-04 -4.9273e-04 1.9901e-04 5.7903e-05 -6.0000e+00 6.9569e-03 9.7897e-03 -1.1365e-04 12 8 8 10 0 0 91.45 23.32 0.44 0.00979 0.00609 16 4 1 5 0 3026.540 26.73 19.97 23.32 5.79 18.3 889.23 43822 -48733 218808 -60525 -3599 -35035 62065 20058 -36113 8031 39874 39451 -17994 -21254 -1749 -11891 -5319 23648 5542 -14272 18712 -1153 48871 -2498 -9910 9801 -16661 -3689 -6041 9169 -5981 12365 -976 594 -4322 -12046 1591 -7960 7703 -2365 -1371 -5476 3433 -5813 -1149 -2012 -1159 3360 -1346 3205 -79 1153 1790 2629 807 -446 1032 -3732 -273 -1815 2927 1800 3076 3633 368 513 -670 3587 944 2666 -904 1882 1616 872 -1594 505 820 -1410 298 -1497 -1538 -2061 -1859 -3190 136 -205 391 972 852 1532 469 414 -329 432 1164 -1191 554 436 299 -51 -663 -2706 -346 422 -143 -1902 -1518 -1746 -677 1330 291 363 -355 -475 794 -546 1137 426 934 866 -414 581 179 1018 194 370 -306 923 888 -575 -704 -774 -768 -25 105 -192 144 692 377 -80 4 -895 32 288 -927 1286 -1339 -42 -545 386 215 -761 117 441 477 -454 -676 -55 -477 -221 793 238 -784 811 -62 1633 -149 -684 583 -1297 -247 -406 542 -453 890 -90 56 -425 -1274 158 -1026 1024 -406 -261 -1167 699 -1328 -254 -454 -261 728 -311 736 -20 317 530 822 269 -156 364 -1380 -96 -646 1026 689 1282 1631 176 238 -301 1546 452 1405 -540 1144 984 513 -894 252 376 -649 144 -838 -984 -1480 -1446 -2677 118 -189 378 964 842 1456 424 347 -261 340 974 -1143 589 514 378 -65 -804 -3069 -362 443 -160 -2299 -1924 -2341 -963 2012 475 613 -597 -760 1177 -782 1591 623 1437 1395 -685 935 280 1521 282 511 -412 1251 1298 -934 -1227 -1411 -1455 -49 218 -421 325 1575 861 -180 9 -1851 64 SS 20230212T135635.4Z 8443.580966 308 1 48.90 2 70.31 130.19 80.15 238.63 0.00 1 0.00 1 0 17 3.436e-02 7.627e-03 1.424e-02 1.246e-03 3.889376e-01 6.447351e-04 4.527094e-03 -6.000000e+00 2.033426e-02 224.77 -2.00 3.51 -2.00 319.37 0.00e+00 2.451844e-03 1.666153e-04 6.805728e-04 -6.000000e+00 8.805001e-04 275.07 -2.00 20.00 -2.00 318.80 0.00e+00 2.935 0.000 302.00 328.00 3 2.3863e+00 1.7875e-03 3.5246e-02 -6.0000e+00 5.0251e-02 2.5636e-02 2.0770e-03 1.9788e-02 -6.0000e+00 5.4670e-02 -1.7339e-03 1.6070e-03 1.0437e-02 -6.0000e+00 3.2521e-02 -8.4878e-03 8.4181e-04 3.8514e-03 -6.0000e+00 1.3589e-02 1.6179e-03 -4.4252e-04 4.0193e-05 4.4745e-05 -6.0000e+00 1.0411e-03 8.7179e-03 -8.8020e-05 11 8 0 10 0 0 97.26 23.31 0.33 0.00872 0.00539 117 27 1 5 0 417.890 26.73 19.97 23.31 7.08 18.4 897.85 -1741 -12820 2518 -16781 -1599 -5539 -9934 -10771 -7230 -13880 -15406 -7105 -10885 -2371 -2791 -1189 -1044 -2200 1817 438 -467 -1204 1260 -1107 -212 -1726 -3986 -4270 -3665 -500 -329 2609 1005 -578 -5204 -3095 -4406 -593 -90 -2421 -1958 -1877 -987 -960 406 138 253 128 -925 197 1403 1660 1301 1371 379 1311 519 -563 -210 -214 1391 2326 3057 2192 544 -968 -717 -171 1751 2454 334 1165 393 808 287 -822 -822 -1336 -342 -815 -1318 -1919 -2315 -2106 -739 -432 325 526 698 1229 705 660 -578 359 323 25 385 724 444 -489 -965 -1418 -145 485 -742 -2036 -1455 -1219 -98 802 307 135 -131 -60 -62 202 736 575 808 56 -48 195 767 550 844 269 -344 1117 516 -87 -727 -1096 -462 110 202 -204 103 477 361 -159 -40 -750 -195 -39 -368 65 -510 -39 -134 -262 -321 -231 -503 -586 -267 -491 -118 -166 -79 -76 -173 145 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