File name: Pandora64s1_NewHavenCT_20240624_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240625T063904.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240624_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240624 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240624T100645.1Z 8941.421355 190 1 49.35 2 83.09 64.79 77.88 221.03 0.00 1 0.00 1 0 17 5.838e-01 4.182e-02 2.668e-01 1.397e-02 9.471366e-01 8.581793e-03 1.158487e-02 -6.000000e+00 3.649099e-01 232.94 -2.00 3.52 -2.00 321.94 0.00e+00 1.562503e-02 4.299938e-03 5.690332e-03 -6.000000e+00 1.675004e-02 287.41 -2.00 20.00 -2.00 321.41 0.00e+00 7.600 0.008 302.00 328.00 3 1.4395e+00 3.1075e-02 9.3332e-02 -6.0000e+00 9.1355e-01 1.6285e+00 3.8174e-02 5.2867e-02 -6.0000e+00 9.8358e-01 -1.8623e+00 2.5535e-02 3.1164e-02 -6.0000e+00 5.8247e-01 7.0332e-01 1.2568e-02 1.5265e-02 -6.0000e+00 2.4499e-01 1.8323e-05 -2.5498e-03 3.8319e-04 3.1496e-04 -6.0000e+00 1.7464e-02 -8.8953e-03 -4.9382e-05 12 8 8 10 0 0 12.49 21.88 0.27 -0.00890 -0.02806 24 6 1 5 0 2055.480 26.32 20.01 21.88 30.29 40.0 1058.68 -28815 157919 5832 115605 900000 900000 -42712 -86051 -4079 -52531 -63905 71411 -38896 -62353 102666 65169 53960 39914 58453 88978 83204 302675 900000 73042 900000 22241 13848 21329 98728 -85861 2795 -7517 51603 2291 208588 -15065 64313 24834 138954 24819 166523 18075 114106 -26463 76547 5221 144627 6705 60818 -51657 143956 79679 141259 3978 51177 22238 38947 18010 91811 5880 51273 12982 55646 34301 71483 13057 36164 31509 31953 4879 33851 17523 13928 4878 12811 1212 39977 1639 -4922 16470 -145 -19969 -3357 4522 912 5310 1009 5538 3662 15442 -9668 7563 -15933 -3078 -8205 5727 -7698 1047 -2287 -686 -6126 1450 -12417 2839 -9795 -6202 -6076 8736 -6415 2269 -952 2860 -1355 2241 -3222 -1073 -1368 -194 -85 5044 1150 3180 1225 2893 4535 1864 -1609 2048 2034 604 215 -1672 -232 -171 2749 -210 82 -766 1991 -1666 -1152 -2310 -2143 2149 323 1936 900000 900000 -2117 -6189 -132 -2451 -3292 1196 -2344 -5999 2471 2592 2360 2095 2692 2887 2613 4118 900000 2064 900000 931 594 804 1757 -10347 184 -584 2647 176 2838 -1201 2625 1663 3345 2052 3776 1581 4180 -3626 4006 523 3936 704 4201 -10945 5123 5838 5914 642 5571 2983 4315 2328 5766 794 4937 1893 6465 5134 8230 2475 5624 5390 6056 1352 7336 4462 3452 1199 2577 247 5900 357 -1359 4418 -54 -9546 -1468 1920 425 2466 504 2658 1757 6693 -4709 3220 -8123 -1527 -5046 3642 -6557 940 -2270 -657 -5752 1123 -10171 2037 -8494 -5423 -5743 7837 -7157 2672 -1302 4008 -2015 3171 -4683 -1510 -1998 -293 -134 7609 1732 4451 1691 3793 5700 2365 -2118 2903 3379 1162 438 -3747 -551 -437 7280 -592 233 -2207 5443 -4423 -2832 -5368 SS 20240624T101718.3Z 8941.428684 193 1 9.45 2 81.29 66.42 79.14 223.03 0.00 1 0.00 1 0 33 6.591e-01 3.605e-02 3.531e-01 1.260e-02 8.191569e-01 7.361872e-03 1.198120e-02 -6.000000e+00 4.063710e-01 232.94 -2.00 3.52 -2.00 321.60 0.00e+00 3.245249e-02 3.857344e-03 9.862522e-03 -6.000000e+00 1.792802e-02 287.41 -2.00 20.00 -2.00 321.07 0.00e+00 6.227 0.004 302.00 328.00 3 1.5991e+00 2.6538e-02 8.1747e-02 -6.0000e+00 1.0205e+00 9.9447e-01 3.2645e-02 4.7520e-02 -6.0000e+00 1.0980e+00 -1.3163e+00 2.4827e-02 3.0585e-02 -6.0000e+00 6.5306e-01 5.5166e-01 1.2105e-02 1.9673e-02 -6.0000e+00 2.7617e-01 7.3721e-05 -3.2164e-03 3.4173e-04 5.2194e-04 -6.0000e+00 1.9628e-02 -8.8564e-03 -5.0450e-05 12 9 9 12 1 1 35.96 21.90 0.25 -0.00886 -0.03303 8 11 1 5 0 1049.100 26.32 19.96 21.90 30.77 39.7 1060.57 -12291 36069 49130 125564 -187080 125713 -16881 -47891 -73087 -79879 -44403 -29864 -48467 46684 51457 37597 384738 63493 36641 137011 39975 135686 102813 47105 -17 46780 55402 35070 -4080 -25352 21822 126945 215023 106008 73982 102642 277765 141551 66128 90969 61364 38437 103089 63529 97539 102557 52605 58684 54386 29926 58606 77736 69847 42549 49528 25304 21329 5183 27877 18614 22611 17614 31950 25972 42643 21721 16521 30425 15741 13719 8659 4694 3207 9828 -2463 -5037 10042 6652 3501 2643 -1099 -6519 1890 -2580 -1010 -2400 -1168 -3605 424 655 -4132 -2644 -8150 -6430 -6570 -2807 -5182 -1969 275 352 1359 -3356 -7007 -5346 -4135 -6794 -3078 -1151 -1913 -238 271 -416 -312 293 -1281 -1372 1443 -87 1529 2585 1763 3596 3421 2649 4036 2154 -202 2095 1811 2278 1494 -32 127 -967 -97 587 -1267 -486 879 -461 -922 -3014 -325 702 855 1543 -21841 1545 -311 -1079 -1946 -2127 -819 -581 -1588 813 1107 1117 4728 1756 1351 1824 1310 1667 1474 1061 -1 910 965 754 -142 -1324 916 2210 2642 2606 2273 2313 3414 2688 2709 3168 3016 2480 3695 3513 3996 4201 3717 4147 4233 2942 4765 6130 6295 4867 5244 3349 2863 784 3268 2446 3078 2864 5165 5033 7296 4517 3701 6155 4077 3769 2630 1492 982 2787 -710 -1357 2297 1698 1095 935 -469 -3336 959 -1438 -589 -1490 -744 -2389 267 394 -2445 -1478 -4800 -4053 -4521 -2210 -4900 -2078 304 383 1365 -3165 -6332 -4853 -3964 -7003 -3303 -1327 -2349 -327 413 -671 -505 461 -1980 -2092 2216 -142 2442 4143 2935 5607 5172 3886 5661 3014 -287 3200 3016 4265 3119 -68 290 -2375 -239 1482 -3289 -1265 2210 -1167 -2198 -6890 SS 20240624T103044.5Z 8941.438015 198 1 48.27 2 78.96 68.47 80.81 225.52 0.00 1 0.00 1 0 25 4.961e-01 1.156e-02 5.117e-02 1.522e-03 7.052997e-01 8.723214e-04 8.229951e-03 -6.000000e+00 3.059312e-01 232.94 -2.00 3.52 -2.00 320.95 0.00e+00 4.444735e-03 4.019693e-04 2.661896e-03 -6.000000e+00 1.349626e-02 287.41 -2.00 20.00 -2.00 320.34 0.00e+00 5.031 0.002 302.00 328.00 3 9.7350e-01 2.9039e-03 6.4087e-02 -6.0000e+00 7.6828e-01 9.8810e-02 3.8659e-03 4.0382e-02 -6.0000e+00 8.2656e-01 -1.3317e-01 3.6520e-03 2.1894e-02 -6.0000e+00 4.9161e-01 4.8170e-02 1.7531e-03 7.4236e-03 -6.0000e+00 2.0794e-01 6.0969e-04 -7.7697e-04 4.3710e-05 1.1284e-04 -6.0000e+00 1.4772e-02 -9.5415e-03 -2.6649e-05 12 8 8 10 0 0 49.33 21.90 0.15 -0.00954 -0.01538 228 55 1 5 0 211.670 26.32 19.98 21.90 31.45 40.0 1064.61 -176509 -141650 -160716 -147747 -275561 -153325 -170504 -114552 -121315 -130598 -143739 -85124 -101255 -76690 -64491 -33994 -43883 -9205 -34564 -22554 -26287 -23300 -17115 -29371 -24331 -18079 -20688 -29767 -19535 -30369 -6547 -8568 3522 -3346 -2343 -10667 1101 -1198 6832 2222 7065 4018 7674 1142 5472 4326 8501 4886 6035 1912 7399 5133 7715 4465 5508 2232 3015 175 3348 1473 2837 2566 4836 5190 3984 723 2080 1440 2528 2626 1530 1315 341 503 -618 -1630 -492 -1999 -959 -172 -1815 -1573 -2028 -2111 -938 -391 273 250 847 831 -238 380 -1579 -496 8 -30 -719 781 411 -436 -663 -1671 -2771 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