File name: Pandora179s1_CornwallCT_20240904_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20240905T050510.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c40p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 179 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20240904_L1_smca1c40d20221201p1-8.txt Full location name: Cornwall - Mohawk Mt CTDEEP (USEPA AQS Site ID 09-005-0005) Short location name: CornwallCT Country of location: United States Location latitude [deg]: 41.8213 Location longitude [deg]: -73.2973 Location altitude [m]: 505 Local noon date: 20240904 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: None First and last pixel inside fitting window: 205 347 Nominal wavelengths inside fitting window [nm]: 305.0173 305.1585 305.2997 305.4409 305.5821 305.7232 305.8644 306.0055 306.1467 306.2878 306.4289 306.5700 306.7111 306.8521 306.9932 307.1343 307.2753 307.4163 307.5573 307.6983 307.8393 307.9803 308.1213 308.2623 308.4032 308.5442 308.6851 308.8260 308.9669 309.1078 309.2487 309.3896 309.5304 309.6713 309.8121 309.9529 310.0938 310.2346 310.3754 310.5161 310.6569 310.7977 310.9384 311.0792 311.2199 311.3606 311.5013 311.6420 311.7827 311.9234 312.0640 312.2047 312.3453 312.4859 312.6265 312.7672 312.9077 313.0483 313.1889 313.3295 313.4700 313.6105 313.7511 313.8916 314.0321 314.1726 314.3131 314.4535 314.5940 314.7344 314.8749 315.0153 315.1557 315.2961 315.4365 315.5769 315.7173 315.8576 315.9980 316.1383 316.2786 316.4189 316.5592 316.6995 316.8398 316.9801 317.1203 317.2606 317.4008 317.5410 317.6812 317.8214 317.9616 318.1018 318.2420 318.3821 318.5223 318.6624 318.8025 318.9426 319.0827 319.2228 319.3629 319.5029 319.6430 319.7830 319.9231 320.0631 320.2031 320.3431 320.4831 320.6230 320.7630 320.9029 321.0429 321.1828 321.3227 321.4626 321.6025 321.7424 321.8823 322.0221 322.1620 322.3018 322.4416 322.5814 322.7212 322.8610 323.0008 323.1406 323.2803 323.4201 323.5598 323.6995 323.8392 323.9789 324.1186 324.2583 324.3980 324.5376 324.6773 324.8169 324.9565 --------------------------------------------------------------------------------------- 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 20240904T111334.3Z 9013.467758 63 1 48.41 2 81.41 88.40 96.37 82.74 0.00 1 0.00 1 0 17 7.005e-01 1.089e-02 2.624e-01 3.530e-03 8.086834e-01 1.930904e-03 8.946665e-03 -6.000000e+00 4.037312e-01 229.78 -2.00 3.52 -2.00 321.68 0.00e+00 5.718880e-03 1.106244e-03 8.453642e-04 -6.000000e+00 1.792227e-02 285.41 -2.00 20.00 -2.00 321.14 0.00e+00 6.314 0.005 302.00 328.00 3 1.2070e+00 7.3887e-03 7.4273e-02 -6.0000e+00 1.0068e+00 2.5611e-01 1.0967e-02 4.6203e-02 -6.0000e+00 1.0921e+00 -3.2445e-01 1.1338e-02 2.4404e-02 -6.0000e+00 6.5076e-01 1.2204e-01 5.1445e-03 1.0890e-02 -6.0000e+00 2.7375e-01 1.8198e-04 -8.4157e-04 9.3430e-05 1.2631e-04 -6.0000e+00 1.9121e-02 1.2644e-02 0.0000e+00 12 8 8 10 0 0 93.29 22.82 0.40 0.01264 0.00632 111 27 1 5 0 436.100 26.00 20.01 22.82 19.43 33.6 937.77 -193640 28895 -237203 -229939 -206942 -275712 -104652 -264270 -122731 -44548 -252248 -203884 -162065 -159533 -43461 -111021 -89799 -95263 -96926 88479 -14610 1714 204261 -58292 -9994 -27988 -69129 -49756 -86000 -60289 7945 -63794 28881 148954 30686 11318 -32723 -12998 -2581 35835 -8035 4590 14957 20834 -3444 5602 -9061 12009 7527 -1143 7332 13909 2852 12775 7883 16811 9954 1569 9454 5590 4 1203 5971 9213 6903 3342 5553 2876 3296 4379 5194 1236 3539 -656 437 -229 -237 -400 5 -586 -1031 -1008 -878 -2865 -47 1394 249 260 1407 -359 768 -776 -755 188 -1425 -810 -580 56 -108 -78 -88 -1435 -636 -1039 -1790 -1354 -429 -1106 -1149 -160 466 -119 -23 -24 172 136 -11 245 -32 -54 1 7 729 740 424 1698 111 1319 121 279 413 -212 61 364 -572 107 26 252 -248 -190 -25 -412 -282 -909 99 -2375 -2159 -1425 -3624 -360 -3639 -461 -153 -4026 -2297 -1572 -2047 -254 -1459 -1237 -1574 -1802 305 -131 13 703 -903 -103 -366 -1404 -822 -2043 -1225 101 -2086 447 769 507 222 -1081 -416 -92 1049 -418 229 716 975 -210 322 -627 711 500 -91 603 1221 311 1390 966 1973 1292 221 1191 716 1 183 1005 1732 1307 658 1076 601 764 1164 1520 394 1088 -197 118 -55 -59 -104 1 -193 -407 -461 -445 -1580 -27 837 159 170 909 -227 449 -435 -414 108 -951 -635 -534 55 -116 -84 -88 -1431 -569 -931 -1729 -1378 -420 -1183 -1371 -216 703 -193 -34 -39 266 203 -16 388 -54 -86 2 11 1117 1096 607 2323 151 1895 203 494 811 -452 138 816 -1387 270 68 655 -642 -467 -56 -952 -632 SS 20240904T113810.1Z 9013.484839 77 1 48.65 2 76.84 92.52 92.00 86.83 0.00 1 0.00 1 0 17 4.086e-01 1.398e-02 2.274e-01 5.046e-03 5.908876e-01 2.671726e-03 6.715330e-03 -6.000000e+00 2.366413e-01 229.78 -2.00 3.52 -2.00 320.63 0.00e+00 7.546703e-03 1.092901e-03 9.977805e-04 -6.000000e+00 1.082922e-02 285.41 -2.00 20.00 -2.00 319.97 0.00e+00 4.280 0.001 302.00 328.00 3 4.0790e+00 8.4162e-03 5.2259e-02 -6.0000e+00 5.9121e-01 1.2814e-01 1.0858e-02 3.5289e-02 -6.0000e+00 6.4187e-01 -1.0729e-01 1.0141e-02 1.7091e-02 -6.0000e+00 3.8090e-01 3.2459e-02 5.0180e-03 1.1217e-02 -6.0000e+00 1.6087e-01 7.6598e-05 -8.7143e-04 1.4267e-04 8.4206e-05 -6.0000e+00 1.1397e-02 1.2514e-02 0.0000e+00 12 8 8 10 0 0 99.51 22.84 0.41 0.01251 0.00597 24 6 1 5 0 2026.820 26.00 20.00 22.84 19.86 33.2 937.49 7207 900000 -62894 106013 900000 -133982 -32430 -184027 900000 -25531 -154696 7485 -52529 -18373 231350 6927 24876 -622 -55424 171905 11197 52834 103483 -16651 19488 48087 -3112 780 -17877 -40507 54041 -36679 25857 110618 23505 3132 -22567 4061 3057 31910 -9431 527 4769 10514 -12718 3937 -3770 11117 13126 -2778 8948 17228 1238 4040 -2807 14236 -523 -3398 6029 1694 328 -708 3600 5823 1753 -1490 462 -1964 181 -108 2972 2946 1179 -2959 -1133 -1934 68 -627 2478 -2444 -4341 124 -766 -3699 -978 1053 -1215 108 1725 -1560 1950 -925 1104 2103 -539 -20 -1493 167 576 -208 293 -1504 458 369 -958 690 547 -855 -1291 -218 701 -358 -295 7 565 770 -887 769 308 -331 63 -1465 243 597 -640 2670 -278 1563 100 636 278 53 515 -92 -1122 235 80 339 -238 221 -445 -337 -249 35 900000 -642 521 900000 -2433 -221 -5818 900000 -212 -4857 51 -815 -264 1138 121 414 -15 -2495 845 284 879 1057 -598 516 1001 -111 26 -717 -2176 1329 -2678 1174 2343 1156 184 -1844 296 273 2547 -1284 70 642 1388 -2165 584 -619 1619 1947 -511 1608 3174 292 1003 -731 3474 -141 -937 1590 461 94 -209 1152 2046 676 -579 171 -758 74 -51 1506 1563 631 -1565 -539 -833 27 -247 1046 -1277 -2696 84 -570 -2800 -769 865 -1074 97 1525 -1373 1543 -750 834 1600 -435 -18 -1618 190 708 -257 360 -1697 465 378 -1070 801 671 -1064 -1758 -326 1072 -579 -475 11 860 1119 -1319 1178 503 -534 100 -2436 382 903 -937 3633 -377 2169 157 1047 500 101 1017 -184 -2404 520 182 779 -547 485 -928 -702 -506 SS 20240904T114828.1Z 9013.491992 80 1 3.95 2 74.92 94.27 90.16 88.53 0.00 1 0.00 1 0 25 2.312e-01 1.351e-02 1.917e-01 9.599e-03 5.118668e-01 4.926789e-03 6.081545e-03 -6.000000e+00 1.333012e-01 229.78 -2.00 3.52 -2.00 319.80 0.00e+00 4.618976e-04 1.538726e-03 1.924047e-03 -6.000000e+00 5.916905e-03 285.41 -2.00 20.00 -2.00 319.07 0.00e+00 3.770 0.001 302.00 328.00 3 3.4077e+00 1.4333e-02 4.5320e-02 -6.0000e+00 3.3243e-01 3.7295e-02 1.7273e-02 2.9058e-02 -6.0000e+00 3.6057e-01 -6.5042e-02 1.4065e-02 1.3724e-02 -6.0000e+00 2.1485e-01 2.1400e-02 7.2477e-03 3.6313e-03 -6.0000e+00 9.0398e-02 2.7687e-04 2.7422e-04 2.7032e-04 4.5528e-05 -6.0000e+00 6.3121e-03 1.1386e-02 0.0000e+00 12 9 9 12 1 1 999.00 22.86 0.40 0.01139 0.01345 2 9 1 5 0 1315.570 26.11 20.00 22.86 20.02 33.3 938.73 16843 83517 -29436 -49367 -96290 -120830 -71363 -122158 -25364 -43059 -45735 51703 -26855 -34005 52940 -53090 -140 -1338 11464 14892 -1906 13026 8218 1515 27879 -12167 -5787 -21760 11118 -10922 -919 6425 -4582 25364 1263 1580 -5838 640 -3833 -1236 1051 1926 2161 6445 -1092 2536 -1329 9912 -158 -798 4433 3679 -1456 4847 403 7902 1662 -185 4315 -363 1100 2487 2220 1312 4158 -920 1295 -387 1685 929 2699 2426 -643 -1954 -791 -5507 -2982 -3979 -2107 -556 -1628 -828 -1732 -1988 -58 1456 1284 400 364 -1467 772 -1779 -3136 -172 -1358 29 27 164 -403 -414 -11 -1556 -758 -343 -1177 -990 1312 -1384 1150 1349 1627 786 808 1150 555 -183 -831 -698 10 -236 -278 -339 902 859 1166 664 -481 843 382 -163 -320 -479 -344 -691 -548 172 175 169 178 513 645 -633 -999 158 782 -501 -1008 -2868 -4421 -1700 -5510 -496 -1099 -1245 572 -777 -1302 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