File name: Pandora179s1_CornwallCT_20230518_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20260624T054611.9Z 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_20230518_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: 20230518 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 20230518T102330.2Z 8538.432989 76 1 48.86 2 81.77 71.09 73.69 83.40 0.00 1 0.00 1 0 25 5.551e-01 2.835e-02 3.102e-01 8.121e-03 1.021711e+00 4.868977e-03 1.118878e-02 -6.000000e+00 3.307288e-01 230.93 -2.00 3.52 -2.00 322.15 0.00e+00 1.186392e-02 2.801418e-03 1.303025e-02 -6.000000e+00 1.547548e-02 280.70 -2.00 20.00 -2.00 321.71 0.00e+00 6.560 0.005 302.00 328.00 3 2.0811e+00 1.8827e-02 1.2222e-01 -6.0000e+00 8.2942e-01 1.2371e+00 2.6341e-02 1.3843e-01 -6.0000e+00 9.0529e-01 -1.5992e+00 2.4055e-02 4.3912e-02 -6.0000e+00 5.3198e-01 6.4506e-01 1.0939e-02 1.6213e-02 -6.0000e+00 2.2178e-01 3.8292e-05 -1.9157e-03 2.1049e-04 1.3181e-04 -6.0000e+00 1.6276e-02 5.1614e-03 0.0000e+00 12 8 8 10 0 0 44.93 22.65 0.90 0.00516 -0.00923 30 7 1 5 0 1628.360 25.90 20.00 22.65 7.50 19.6 929.75 28528 900000 -119249 900000 -67902 900000 -18814 -190064 39062 -39144 -185229 -34709 -44184 -101457 900000 2795 59684 -19367 51994 140394 176067 138425 900000 75978 900000 900000 -64561 -20152 -79507 1991 900000 -56455 98313 900000 900000 247034 -33738 63624 900000 900000 59756 107633 82616 49370 15844 46952 6703 151130 54585 62373 26787 900000 28642 85934 46607 102036 31938 18199 55745 42279 36906 9227 56679 47158 45534 8119 42736 21774 14573 29839 18774 31298 22878 3430 129 10455 18071 5933 -889 3015 -8932 5632 7080 -3432 3818 7021 1296 3819 3477 -8403 3567 -1231 493 -823 -2705 -2651 -8395 -2676 -2755 -248 -952 -1610 321 -4657 -1828 3393 1883 -3528 -3800 -2590 -563 -2344 -2099 270 -326 157 -1330 551 -1580 52 1146 67 2589 3482 461 7355 -870 1379 2518 1524 1027 1295 -6 623 -1607 1684 218 660 -7 -371 -1085 -573 -3304 225 900000 -4553 900000 -1207 900000 -176 -8758 309 -422 -7682 -374 -666 -3643 900000 56 772 -598 821 1109 1391 1093 900000 764 900000 900000 -2457 -463 -3197 39 900000 -3081 1341 900000 900000 1951 -1623 1279 900000 900000 1845 2164 2195 1844 819 1787 390 2171 2195 2508 1712 900000 2201 4011 3381 4323 2729 1725 3403 2793 2571 921 4070 4335 4676 1230 4634 3065 2428 4886 3775 5731 4420 737 25 1622 2427 942 -176 708 -2854 1820 2522 -1444 1577 2955 600 1761 1596 -4170 1465 -501 195 -355 -1391 -1647 -6638 -2362 -2499 -224 -889 -1340 231 -3398 -1370 2553 1527 -3298 -3705 -2920 -721 -3370 -3132 392 -463 216 -1883 804 -2475 82 1719 96 3412 4398 581 8401 -1060 1767 3765 2708 1923 2656 -13 1491 -4222 4481 596 1805 -19 -948 -2554 -1228 -6915 SS 20230518T103944.5Z 8538.444265 81 1 48.36 2 78.89 73.64 70.72 85.88 0.00 1 0.00 1 0 17 5.856e-01 8.213e-03 2.098e-01 2.521e-03 8.117443e-01 1.367849e-03 8.859512e-03 -6.000000e+00 3.391592e-01 230.93 -2.00 3.52 -2.00 321.29 0.00e+00 3.191217e-03 6.764500e-04 8.279499e-04 -6.000000e+00 1.469660e-02 280.70 -2.00 20.00 -2.00 320.77 0.00e+00 5.008 0.002 302.00 328.00 3 1.8781e+00 4.6235e-03 6.5026e-02 -6.0000e+00 8.4958e-01 1.8337e-01 6.7233e-03 4.5556e-02 -6.0000e+00 9.2113e-01 -1.7619e-01 7.2823e-03 2.3927e-02 -6.0000e+00 5.4683e-01 5.5830e-02 3.4129e-03 9.1921e-03 -6.0000e+00 2.2873e-01 2.8268e-04 -7.0204e-04 6.4734e-05 9.2791e-05 -6.0000e+00 1.5983e-02 4.7209e-03 0.0000e+00 11 8 0 10 0 0 81.30 22.63 0.45 0.00472 -0.00055 98 23 1 5 0 493.440 25.79 20.00 22.63 9.21 19.9 940.86 -120746 -108983 -218891 -163479 -213940 -144273 -160882 -211646 -168906 61909 -237805 -165087 -177431 -126331 614 -79340 -92713 -95914 -42313 -64486 -19839 -58028 64606 -79887 -22091 -20307 -63688 -52033 -52558 -47152 -3909 -31161 -22877 60977 -10118 -9559 -32392 -6256 3081 13059 -1009 3340 10404 -475 -956 4365 -5839 2231 2539 -1809 1351 10737 532 9115 3286 8009 2409 996 579 4087 1234 1461 7074 5736 5096 487 5071 -284 1928 2105 2316 1518 1428 147 -1228 1035 -240 -1339 -823 -6 -2262 -377 -1861 -2465 -617 -32 516 39 1062 -394 829 -70 -126 -473 398 -431 -132 893 -208 -51 -363 -671 -520 -316 -1152 -842 -530 -920 -672 322 119 -52 -92 56 169 250 236 234 109 -193 -257 291 457 369 156 982 -22 712 439 -49 375 -253 -17 -88 -404 -57 126 364 -95 -257 19 -29 -419 -297 -268 -1663 -731 -1482 -484 -683 -1703 -1121 152 -3454 -1461 -2311 -1335 2 -878 -1390 -1697 -489 -999 -205 -884 302 -1748 -299 -290 -1456 -1049 -1059 -985 -65 -858 -697 899 -301 -277 -1282 -226 126 591 -61 211 652 -34 -71 316 -487 181 220 -179 147 1214 74 1293 485 1305 392 165 93 680 216 255 1347 1277 1240 125 1245 -77 569 718 879 610 568 56 -427 315 -69 -400 -278 -2 -1115 -211 -1176 -1673 -401 -22 370 29 775 -281 595 -48 -84 -330 287 -368 -132 1024 -245 -60 -404 -725 -506 -303 -1188 -914 -606 -1051 -850 459 177 -84 -150 90 256 392 373 359 176 -322 -419 449 726 566 230 1387 -30 1041 738 -89 745 -508 -37 -201 -925 -137 306 893 -232 -596 44 -62 -872 SS 20230518T104521.8Z 8538.448169 84 1 48.38 2 77.88 74.51 69.69 86.74 0.00 1 0.00 1 0 17 4.675e-01 7.148e-03 1.235e-01 1.753e-03 7.529143e-01 9.392248e-04 8.326398e-03 -6.000000e+00 2.707610e-01 230.93 -2.00 3.52 -2.00 321.00 0.00e+00 2.130643e-03 4.285797e-04 6.230197e-04 -6.000000e+00 1.173280e-02 280.70 -2.00 20.00 -2.00 320.45 0.00e+00 4.623 0.002 302.00 328.00 3 1.6986e+00 3.0600e-03 5.9823e-02 -6.0000e+00 6.7824e-01 1.1899e-01 4.2422e-03 4.1215e-02 -6.0000e+00 7.3537e-01 -1.0990e-01 4.4603e-03 2.1328e-02 -6.0000e+00 4.3655e-01 3.1866e-02 2.1363e-03 7.4959e-03 -6.0000e+00 1.8260e-01 5.1491e-04 -6.8074e-04 4.5752e-05 7.5525e-05 -6.0000e+00 1.2760e-02 4.7937e-03 0.0000e+00 11 8 0 10 0 0 66.92 22.65 0.31 0.00479 -0.00032 138 33 1 5 0 350.530 25.90 20.00 22.65 9.75 19.9 943.86 -115947 -77298 -179276 -107856 -195190 -125057 -195840 -140714 -172561 -25787 -177909 -65191 -145774 -81530 -29552 -62278 -38205 -63325 -9340 -50355 -851 -42257 48872 -49446 -13973 -9526 -36302 -24174 -53041 -13014 -25157 -12163 -16665 31389 -12201 2093 -24048 -9410 -903 -766 3242 -3785 7594 -3885 3331 469 -116 2154 -586 2696 -1356 8417 -842 6730 1609 6795 2100 2096 84 2048 2099 570 4989 2356 3460 -237 3050 -257 1900 1133 1318 977 297 879 -1410 855 -1190 -232 -823 70 -1582 -653 -1448 -2036 -655 -592 97 38 1089 -76 696 -9 -327 193 -57 94 -72 1101 -151 -79 -307 -570 -440 -219 -938 -1094 -403 -1056 -312 -112 412 -329 -92 99 173 360 262 158 127 117 -427 333 226 509 353 553 53 872 472 38 213 -251 -111 -168 -275 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