File name: Pandora179s1_CornwallCT_20221230_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20260624T053616.9Z 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 v1.8.88 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20221230_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: 20221230 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 20221230T130359.8Z 8399.544442 75 1 4.18 2 84.16 128.44 128.99 35.35 0.00 1 0.00 1 0 25 7.329e-01 7.230e-02 4.943e-01 5.638e-02 8.715400e-01 3.233204e-02 9.581315e-03 -6.000000e+00 4.297399e-01 222.91 -2.00 3.52 -2.00 321.82 0.00e+00 -2.511340e-02 1.208033e-02 2.737292e-03 -6.000000e+00 2.054997e-02 272.53 -2.00 20.00 -2.00 321.31 0.00e+00 8.754 0.012 302.00 328.00 3 9.9658e-01 1.0162e-01 9.8829e-02 -6.0000e+00 1.0687e+00 1.4131e+00 1.2407e-01 6.9523e-02 -6.0000e+00 1.1786e+00 -1.6741e+00 9.1216e-02 2.2874e-02 -6.0000e+00 6.8930e-01 6.0033e-01 4.7895e-02 1.9000e-02 -6.0000e+00 2.9105e-01 2.2667e-05 2.0487e-03 1.6103e-03 2.3631e-04 -6.0000e+00 2.2012e-02 2.7230e-03 0.0000e+00 12 9 9 12 1 1 999.00 22.67 0.62 0.00272 0.01812 1 6 1 5 0 2005.670 25.90 20.00 22.67 15.72 17.4 994.59 900000 900000 262376 900000 6090 -12749 32206 900000 -83807 900000 -103157 110692 -7394 900000 900000 131305 900000 -54041 900000 2520 280040 164523 210046 6016 240003 900000 61642 900000 206336 900000 -20022 1107 -40206 900000 -62856 900000 56403 900000 85257 900000 51148 18745 900000 11388 55365 -32413 -26573 324357 86562 137471 19995 75011 -10670 43247 -6531 900000 945 22422 11236 134674 10470 59953 126112 16157 56050 -33525 147016 -22339 50302 -5433 81928 91602 10941 36167 -3129 41783 17868 28058 -28164 -3928 -13008 39691 41696 -19583 25611 15472 22081 -5860 7433 -3229 12913 -21248 3607 20766 -5156 16912 -18187 2315 -11682 -5806 -534 -3093 -5164 -3579 -10557 5782 5109 -4931 15604 -5488 1173 -4879 -1260 -1267 1604 -890 1217 6224 -566 2731 -4354 -2989 -440 11493 -1120 11406 -3440 1814 5764 1077 2366 -4254 4816 -2861 -268 -2624 434 3254 2059 3117 -123 -4197 -4735 900000 900000 14372 900000 334 -698 1764 900000 -10165 900000 -16952 6063 -530 900000 900000 7193 900000 -7287 900000 181 15340 9012 11506 456 13147 900000 3377 900000 11302 900000 -1603 79 -4744 900000 -8740 900000 3090 900000 4670 900000 4526 2370 900000 1392 4296 -5190 -3807 17767 4742 7530 2282 5478 -1843 5133 -1266 900000 187 3787 1949 7377 1577 5747 6908 2950 7164 -9465 8053 -5930 7807 -1557 11593 12126 3146 7429 -843 6294 3181 4611 -9128 -1183 -5047 10509 11991 -10232 9820 6921 9575 -3136 3414 -1564 5364 -10923 1564 8152 -2781 9264 -15173 1804 -11371 -5309 -432 -2294 -3569 -2458 -8363 4117 3896 -4529 13150 -6590 1498 -7154 -1826 -1809 2142 -1184 1610 8208 -842 4016 -6678 -4308 -597 13462 -1444 12591 -4348 2361 8404 1898 4267 -8888 9854 -6828 -673 -6592 1156 8505 5358 7572 -286 -9476 -10523 SS 20221230T140324.1Z 8399.585696 105 1 10.82 2 76.21 139.70 121.54 50.25 0.00 1 0.00 1 0 17 2.099e-01 1.378e-02 1.237e-01 8.098e-03 4.720347e-01 4.053870e-03 5.545271e-03 -6.000000e+00 1.179889e-01 222.91 -2.00 3.52 -2.00 319.56 0.00e+00 1.403165e-03 1.116083e-03 4.530187e-04 -6.000000e+00 5.132185e-03 272.52 -2.00 20.00 -2.00 319.04 0.00e+00 4.101 0.001 302.00 328.00 3 3.9190e+00 1.1308e-02 4.5195e-02 -6.0000e+00 2.9090e-01 1.1357e-01 1.3346e-02 2.4418e-02 -6.0000e+00 3.1766e-01 -1.1161e-01 1.1057e-02 1.2202e-02 -6.0000e+00 1.8898e-01 4.4407e-02 5.8313e-03 3.8741e-03 -6.0000e+00 8.0319e-02 1.3018e-04 -5.9819e-04 2.3213e-04 4.1548e-05 -6.0000e+00 5.7226e-03 1.6951e-03 0.0000e+00 12 9 9 12 1 1 76.47 22.75 0.56 0.00170 -0.00280 3 4 1 5 0 2661.240 25.90 20.00 22.75 16.83 17.4 1000.34 -61205 900000 -38465 -13355 -56140 -98995 112913 -81165 -5259 3008 -45759 -52876 -35817 -26777 10877 31415 23498 29333 -5522 77731 16270 44278 32097 -168 19852 18005 -8737 65 -4313 -17643 21883 4426 14810 10775 -8583 3708 -12782 -1596 6597 13298 -11446 4444 -6156 3998 -2777 1541 -1575 8746 7553 -816 4644 -4231 3835 -1795 4002 2272 -1084 55 -108 2504 -567 267 -908 2206 529 -1550 641 251 -1393 1790 3862 229 3254 -1504 -1788 -1965 3653 -2603 1818 -693 -2165 -2344 -1932 -1919 260 483 -1164 1000 1627 -1807 2330 -1233 -299 1420 1037 -373 820 -460 -115 -723 864 -1712 -368 -983 -720 -393 392 -454 -168 -137 -540 288 31 1016 161 -735 634 -826 438 -972 449 -1326 760 868 27 1875 447 1708 311 480 -574 93 152 189 -247 608 69 -141 136 -52 -18 -1330 -289 -1893 900000 -1189 -316 -1847 -4690 892 -3738 -128 73 -1867 -2435 -1626 -1357 458 1261 1129 1428 -407 2608 1038 2127 1774 -14 1424 1386 -897 6 -389 -1834 1699 469 1598 1304 -1220 449 -1951 -253 1168 2634 -3024 1072 -1724 1034 -772 415 -439 2210 1959 -238 1382 -1514 1370 -728 1614 963 -488 25 -47 1042 -248 125 -481 1159 295 -847 352 138 -776 1100 2576 167 2294 -1063 -1171 -1158 2003 -1481 1062 -445 -1627 -1992 -1663 -1744 247 489 -1264 1028 1778 -1974 2274 -1152 -260 1294 959 -396 919 -589 -150 -942 1107 -2045 -401 -1090 -859 -495 515 -601 -238 -213 -862 475 50 1556 246 -1073 912 -1259 701 -1567 718 -2103 1211 1330 39 2603 642 2338 474 762 -990 168 267 350 -489 1190 139 -290 278 -103 -36 -2538 -531 SS 20221230T140710.2Z 8399.588312 108 1 3.35 2 75.76 140.46 121.00 51.11 0.00 1 0.00 1 0 25 1.564e-01 1.512e-02 2.030e-01 1.182e-02 4.587636e-01 5.885487e-03 5.396095e-03 -6.000000e+00 8.794531e-02 222.91 -2.00 3.52 -2.00 319.36 0.00e+00 3.157749e-03 1.558783e-03 2.200607e-04 -6.000000e+00 3.796970e-03 272.52 -2.00 20.00 -2.00 318.85 0.00e+00 3.979 0.001 302.00 328.00 3 3.2979e+00 1.6221e-02 4.3866e-02 -6.0000e+00 2.1683e-01 7.5596e-02 1.8952e-02 2.3731e-02 -6.0000e+00 2.3676e-01 -2.4875e-02 1.5631e-02 1.2054e-02 -6.0000e+00 1.4076e-01 -1.0123e-03 8.3484e-03 4.7325e-03 -6.0000e+00 5.9467e-02 2.7182e-04 -6.7948e-04 3.3647e-04 4.6024e-05 -6.0000e+00 4.2605e-03 1.0557e-03 0.0000e+00 12 9 9 12 1 1 999.00 22.75 -0.03 0.00106 -0.00405 1 7 1 5 0 1590.300 26.00 20.00 22.75 16.82 17.4 999.66 50475 -42584 -2424 5775 -23816 16372 26209 -32416 -76423 63581 -65090 38516 -48127 -12228 18414 -2508 55035 -21810 19090 12190 35077 -10028 14820 -16577 14977 -4757 -8896 18817 10479 22004 -499 -31 -2513 2353 -11270 -1799 -2629 -4703 5280 7915 3629 6873 4903 -7477 429 -4344 -3933 3917 2885 1241 -546 -701 799 -762 -4105 2863 -2862 3843 2738 -3629 2626 681 6018 -271 391 -2933 4227 -2676 2579 682 2505 2165 -711 -392 -2432 1836 -2949 -2070 688 2046 -369 1743 -1668 -5757 2147 -1312 -416 -823 1551 -659 3001 -1415 1323 2132 239 654 -327 2394 -680 -512 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