File name: Pandora179s1_CornwallCT_20241219_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20241220T050308.2Z 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 v1.8.60 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20241219_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: 20241219 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 20241219T133407.8Z 9119.565368 313 1 8.82 2 79.48 135.13 67.92 273.80 0.00 1 0.00 1 0 17 6.045e-01 1.572e-02 3.462e-01 1.007e-02 7.082980e-01 5.306671e-03 7.876256e-03 -6.000000e+00 3.416596e-01 222.57 -2.00 3.52 -2.00 320.93 0.00e+00 7.913602e-03 2.269203e-03 1.981415e-03 -6.000000e+00 1.523574e-02 273.14 -2.00 20.00 -2.00 320.48 0.00e+00 5.269 0.003 302.00 328.00 3 2.7564e+00 1.6341e-02 6.3457e-02 -6.0000e+00 8.4400e-01 2.3838e-01 2.2410e-02 4.3788e-02 -6.0000e+00 9.2364e-01 -2.3619e-01 2.4207e-02 2.0546e-02 -6.0000e+00 5.4870e-01 9.0853e-02 1.1843e-02 1.2934e-02 -6.0000e+00 2.3210e-01 1.0605e-04 -4.2011e-05 2.7212e-04 9.6868e-05 -6.0000e+00 1.6551e-02 7.3180e-03 0.0000e+00 12 9 9 12 1 1 99.86 22.67 0.58 0.00732 0.00700 4 6 1 5 0 1763.480 25.90 20.00 22.67 5.57 33.6 922.79 -103282 900000 122107 -107898 -150272 -99782 -165927 -232557 -187909 900000 -171931 -183270 -170494 14281 900000 38159 900000 44880 -27985 5062 -23806 11874 108139 -27938 245244 249693 7831 210251 -43679 -17457 -22593 -21666 22448 91060 7825 13861 16552 25398 25704 24823 10001 -5327 13454 -5476 -12246 15050 -4939 43030 19071 15398 19036 20327 -4448 5367 218 15991 3552 -2853 3237 185 1023 5640 4080 3057 140 -9407 -3204 860 -1979 4938 1828 6171 334 566 924 984 -2224 -4670 -1157 1792 -4887 490 1200 -2334 -648 1684 -517 -2511 1487 -961 1272 -2308 -574 673 354 1166 -1069 -491 -486 45 -1177 -127 1344 -249 286 -503 351 -1385 -730 -43 1237 153 -752 1074 640 -1181 -992 465 -44 -434 110 -1022 1061 23 -370 1711 831 589 947 445 24 714 -964 -55 98 219 -709 140 318 666 42 -124 -1432 -1014 900000 1199 -1059 -1721 -979 -2172 -6468 -3689 900000 -3235 -4347 -4602 140 900000 375 900000 441 -624 86 -552 191 1061 -723 2407 2451 161 2064 -1481 -498 -827 -967 761 1706 328 532 665 1088 1330 1551 821 -551 1225 -625 -1530 1477 -613 3456 2059 1855 2463 2920 -826 983 45 2891 744 -632 654 38 214 1246 1051 908 46 -3355 -1064 283 -738 1975 833 2807 159 252 372 354 -773 -1700 -460 828 -2846 286 765 -1636 -475 1282 -421 -2144 1216 -774 934 -1644 -388 468 279 1064 -1080 -568 -613 56 -1396 -133 1358 -255 290 -542 396 -1713 -990 -61 1928 255 -1194 1726 978 -1767 -1493 723 -72 -741 184 -1647 1609 33 -528 2466 1176 826 1506 756 46 1418 -1929 -115 220 486 -1614 319 717 1508 90 -247 -2998 SS 20241219T133818.0Z 9119.568264 316 1 48.44 2 78.94 135.93 68.68 274.43 0.00 1 0.00 1 0 25 3.664e-01 5.581e-03 8.287e-02 1.392e-03 6.785127e-01 7.270877e-04 7.615538e-03 -6.000000e+00 2.053695e-01 222.57 -2.00 3.52 -2.00 321.00 0.00e+00 2.881424e-03 3.127950e-04 1.029117e-03 -6.000000e+00 8.908049e-03 273.14 -2.00 20.00 -2.00 320.54 0.00e+00 5.032 0.002 302.00 328.00 3 8.3195e-01 2.2461e-03 5.8965e-02 -6.0000e+00 5.0582e-01 7.0473e-02 3.1150e-03 3.6714e-02 -6.0000e+00 5.5279e-01 -4.5899e-02 3.4420e-03 1.8937e-02 -6.0000e+00 3.2884e-01 9.0715e-03 1.6820e-03 6.8993e-03 -6.0000e+00 1.3877e-01 9.8358e-04 -9.4144e-04 3.7843e-05 7.3492e-05 -6.0000e+00 9.9801e-03 1.5908e-02 0.0000e+00 10 0 0 10 0 0 99.99 22.68 0.31 0.01591 0.00883 482 115 1 5 0 100.480 25.90 20.00 22.68 5.90 33.5 924.04 -123972 -54580 -150434 -102348 -153422 -57066 -147481 -127490 -126785 -72728 -112741 -91137 -76375 -80485 -5119 -56773 -21855 -48874 -22022 -22799 -18948 -24349 -4791 -20422 -21517 -3121 -33892 -6422 -26344 -8116 -14660 -10262 -5697 157 -4136 -8740 -5702 -8582 1 -2983 -71 -1848 993 70 795 1227 -2262 2699 -854 2342 1086 4090 997 3015 1085 2808 1969 -63 911 -180 2003 819 3821 2380 2507 519 1252 455 1063 1923 970 1408 -133 840 -557 50 -127 -1149 -92 -315 -554 -1081 -1442 -2126 -662 -822 -192 -325 529 258 522 508 -112 844 135 390 264 882 38 -51 -149 -518 -82 -163 -798 -1283 -642 -880 -451 -11 150 32 44 238 108 524 252 273 94 -289 -547 219 101 260 511 465 262 1009 434 102 230 -331 -97 -34 -342 -160 -62 283 -222 -80 73 -37 -35 -606 -163 -1307 -556 -1292 -178 -1221 -987 -1119 -415 -1026 -755 -695 -1005 -39 -894 -282 -929 -353 -393 -327 -446 -75 -413 -482 -62 -953 -135 -669 -185 -428 -350 -219 6 -169 -368 -254 -466 0 -230 -6 -175 97 7 82 130 -255 302 -105 299 157 648 164 532 209 556 406 -13 185 -36 405 185 957 687 771 161 382 145 371 766 432 654 -62 366 -225 18 -43 -397 -35 -144 -299 -673 -991 -1563 -469 -622 -151 -263 423 199 409 372 -80 617 112 343 270 1027 48 -65 -178 -555 -80 -160 -844 -1439 -756 -1116 -578 -15 239 53 75 385 166 767 372 423 154 -490 -917 350 156 384 724 688 377 1407 690 184 420 -649 -199 -74 -800 -364 -143 664 -518 -190 162 -78 -73 SS 20241219T134635.9Z 9119.574027 322 1 4.49 2 77.88 137.54 70.20 275.70 0.00 1 0.00 1 0 17 3.703e-01 1.090e-02 2.685e-01 8.019e-03 6.268186e-01 4.123227e-03 7.112872e-03 -6.000000e+00 2.087195e-01 222.57 -2.00 3.52 -2.00 320.43 0.00e+00 3.694827e-03 1.530645e-03 5.497168e-04 -6.000000e+00 9.140747e-03 273.14 -2.00 20.00 -2.00 319.94 0.00e+00 4.624 0.002 302.00 328.00 3 2.4581e+00 1.2171e-02 5.3938e-02 -6.0000e+00 5.1359e-01 9.7460e-02 1.5607e-02 3.2935e-02 -6.0000e+00 5.6139e-01 -4.6589e-02 1.5850e-02 1.7137e-02 -6.0000e+00 3.3340e-01 8.0205e-03 8.0265e-03 7.0450e-03 -6.0000e+00 1.4047e-01 2.8572e-04 -7.5108e-04 2.2026e-04 6.6241e-05 -6.0000e+00 1.0115e-02 1.2668e-02 0.0000e+00 12 9 9 12 1 1 99.50 22.68 0.12 0.01267 0.00702 4 13 1 5 0 896.490 25.90 20.00 22.68 6.26 33.0 923.89 -116548 180121 -139156 -72864 -142592 900000 -119076 -10461 -38122 150490 -31172 -130362 -96853 -86231 900000 -74323 54942 -47686 5641 11819 40542 21438 16463 -33203 -3196 8767 -32640 -9782 -34744 21026 -3579 -16165 2624 24194 2220 -11190 -9896 -17053 4574 5270 4393 -4808 13341 6227 -5598 6000 155 1682 -4928 2775 -1456 11673 -1723 5879 4238 7221 3396 -835 -607 -658 724 -1687 6537 2075 6221 -709 2867 -185 -514 3152 687 1022 -1385 1211 -2035 556 -827 -2830 216 -468 -704 -2741 -1442 -2351 -2105 34 781 -1178 633 -1621 -207 -387 -409 524 -342 859 -560 1722 -1364 306 967 -538 555 592 525 -742 -419 -637 207 -258 557 -432 995 882 -438 108 -147 656 -1108 -79 -847 141 747 74 764 65 665 1110 146 -244 -164 -1078 -300 570 464 -179 -231 404 -142 -173 -258 -14 -30 -1121 1408 -2259 -613 -2229 900000 -1504 -82 -298 1176 -244 -3057 -2038 -2126 900000 -2547 595 -1606 122 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