File name: Pandora64s1_NewHavenCT_20240923_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240924T045056.6Z 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_20240923_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: 20240923 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 20240923T112147.1Z 9032.473461 246 1 48.12 2 83.14 96.57 27.05 247.32 0.00 1 0.00 1 0 25 4.918e-01 3.324e-02 1.997e-01 7.820e-03 8.415961e-01 4.596046e-03 1.264182e-02 -6.000000e+00 2.975158e-01 228.25 -2.00 3.52 -2.00 321.95 0.00e+00 4.288690e-02 2.590252e-03 7.492425e-03 -6.000000e+00 1.332721e-02 286.59 -2.00 20.00 -2.00 321.45 0.00e+00 7.644 0.008 302.00 328.00 3 6.5900e-01 1.7596e-02 8.8987e-02 -6.0000e+00 7.3876e-01 1.3088e+00 2.1008e-02 5.1797e-02 -6.0000e+00 7.9827e-01 -1.6358e+00 1.4893e-02 2.7967e-02 -6.0000e+00 4.7644e-01 6.6335e-01 7.4403e-03 3.0332e-02 -6.0000e+00 2.0289e-01 4.6274e-05 -3.5233e-03 2.1652e-04 6.8802e-04 -6.0000e+00 1.4635e-02 4.0359e-03 -1.0095e-04 12 8 8 10 0 0 95.56 21.38 0.17 0.00404 -0.02244 59 14 1 5 0 815.530 25.90 20.00 21.38 18.71 39.6 988.16 46450 67940 107005 61572 -147239 -6386 22678 -19264 258 -11118 -16659 -36163 24721 94134 109304 101593 103406 100813 179990 120777 119607 167651 900000 1032 66100 -1747 35781 -19687 85955 -55059 87772 44868 85856 76801 103302 36828 65687 40687 87563 34350 67651 43596 81027 8161 73948 55870 86549 48694 59028 19476 73814 39130 99826 37316 57909 40244 21232 6902 31763 19538 23067 29917 32346 25191 43520 22204 18474 26115 21259 18698 15625 19861 8302 6856 -754 2039 5689 -1028 -7802 8625 -1583 681 -339 -2238 -2883 -3040 -1255 -1710 -1468 589 -6723 -4197 -9295 -8019 -7969 -2621 -4471 129 552 -1106 236 -1164 -8149 -4545 -4151 -4021 -5031 -947 -2397 -529 -558 -1742 -443 -296 -1436 -1329 129 242 1853 2839 2434 2540 4012 3524 3878 2231 -927 1119 2107 1392 1784 -442 368 -248 571 -720 -713 -92 593 -852 -450 -2558 1335 1713 1820 1408 -18932 -187 399 -429 4 -176 -274 -912 493 1435 1875 2085 2304 2483 2172 2532 2279 1704 900000 38 1176 -52 773 -704 1311 -4004 2175 1868 2891 2781 2559 1577 2337 1813 2837 1853 2922 2301 3397 684 3382 3243 4234 3426 3946 2067 4978 3993 5795 4158 5094 4059 2478 882 3092 2223 2773 3860 4704 4129 6635 3845 3400 4607 4353 4347 3888 4704 2070 1579 -168 403 1087 -231 -2269 2578 -609 290 -145 -1025 -1408 -1553 -653 -905 -767 287 -3307 -1939 -4554 -4287 -5038 -1882 -3861 123 524 -1045 217 -969 -6738 -3724 -3611 -3668 -5044 -943 -2758 -684 -804 -2671 -676 -441 -2096 -1926 192 379 3008 4602 3823 3801 5743 4884 5221 2997 -1292 1706 3706 2632 3726 -1013 893 -612 1485 -1954 -1955 -254 1583 -2168 -1129 -6163 SS 20240923T113224.3Z 9032.480837 249 1 48.48 2 81.16 98.37 28.86 250.35 0.00 1 0.00 1 0 25 5.383e-01 1.596e-02 9.070e-02 2.675e-03 7.249696e-01 1.528150e-03 8.713487e-03 -6.000000e+00 3.256833e-01 228.25 -2.00 3.52 -2.00 321.32 0.00e+00 6.966990e-03 7.913146e-04 4.136382e-03 -6.000000e+00 1.458339e-02 286.59 -2.00 20.00 -2.00 320.76 0.00e+00 6.149 0.004 302.00 328.00 3 8.5603e-01 5.4218e-03 7.4359e-02 -6.0000e+00 8.0870e-01 2.0925e-01 7.3597e-03 4.3804e-02 -6.0000e+00 8.7382e-01 -3.0657e-01 6.9812e-03 2.4164e-02 -6.0000e+00 5.2154e-01 1.2647e-01 3.2825e-03 8.3906e-03 -6.0000e+00 2.2201e-01 2.4038e-04 -1.1953e-03 7.7396e-05 1.6133e-04 -6.0000e+00 1.6010e-02 3.3843e-03 -8.6106e-05 12 9 8 11 8 0 92.22 21.38 0.19 0.00338 -0.00560 146 35 1 5 0 332.040 25.90 20.00 21.38 19.50 39.4 990.76 -145746 -175799 -122908 -205311 -301613 -190553 -143454 -180142 -99939 -151575 -114379 -144961 -95428 -102884 -25638 -33421 -32237 -32220 -18519 -33709 -20991 -12754 -4846 -21463 -23116 -20382 -27895 -27409 -6137 -39572 -10457 -4024 17297 5737 7439 -7488 4906 10196 17304 6663 17696 12820 15707 6613 14166 15188 13127 15208 9638 3792 12059 14410 15307 11573 12257 7562 4393 7007 4893 4363 4336 5943 6189 5952 7211 3438 4258 5008 4598 4835 2660 3511 350 2003 -269 -1805 -142 -2917 -1598 341 -1006 -621 -1466 -2300 -1058 -1059 -281 -446 1482 526 -1147 -1430 -2909 -1914 -1134 -1026 -1074 795 436 -850 -771 -2396 -3229 -796 -341 -2198 -1078 -748 -251 342 1024 4 353 31 -271 -572 179 -203 925 942 440 147 1490 856 1761 930 -1165 456 1046 624 818 -651 -692 -500 444 -271 -322 427 431 -247 -177 -1273 -1254 -2292 -994 -3213 -11656 -2733 -1384 -2772 -756 -2056 -1163 -2495 -1319 -1985 -288 -479 -513 -571 -304 -677 -372 -210 -78 -437 -500 -447 -662 -643 -123 -1300 -316 -133 532 202 248 -309 203 435 829 411 1070 869 1091 514 1055 1159 1064 1284 919 422 1398 1807 2079 1767 1935 1190 724 1105 774 705 753 1146 1353 1450 1772 870 1109 1374 1443 1706 1019 1357 134 704 -88 -552 -42 -964 -613 152 -485 -338 -866 -1459 -712 -750 -206 -330 1064 362 -755 -910 -1888 -1345 -913 -890 -1072 879 505 -968 -815 -2330 -3017 -762 -347 -2385 -1247 -937 -327 496 1613 6 575 49 -412 -860 277 -329 1560 1603 731 235 2292 1272 2526 1309 -1678 714 1852 1158 1655 -1334 -1507 -1162 1091 -652 -788 1046 1034 -598 -406 -2803 SS 20240923T114243.8Z 9032.488007 254 1 1.61 2 79.25 100.13 30.64 253.06 0.00 1 0.00 1 0 17 5.502e-01 2.610e-02 3.516e-01 1.887e-02 6.422960e-01 1.066208e-02 7.929426e-03 -6.000000e+00 3.361225e-01 228.25 -2.00 3.52 -2.00 320.66 0.00e+00 1.086834e-02 4.400444e-03 3.348943e-03 -6.000000e+00 1.676298e-02 286.59 -2.00 20.00 -2.00 320.03 0.00e+00 5.156 0.002 302.00 328.00 3 1.8902e+00 3.3659e-02 6.2277e-02 -6.0000e+00 8.3900e-01 2.9553e-01 4.2111e-02 3.5203e-02 -6.0000e+00 9.0912e-01 -3.6989e-01 3.5619e-02 2.2016e-02 -6.0000e+00 5.3746e-01 1.5724e-01 1.7630e-02 1.0753e-02 -6.0000e+00 2.2809e-01 2.2064e-04 -2.2499e-03 5.5524e-04 1.6855e-04 -6.0000e+00 1.6844e-02 3.6529e-03 -1.1438e-04 12 9 9 12 1 1 999.00 21.40 0.32 0.00365 -0.01325 1 14 1 5 0 805.740 25.90 19.99 21.40 19.90 39.4 992.43 -130719 -131740 -71679 -128339 -184815 -181101 -113187 900000 900000 -444 900000 -136882 258297 -104032 900000 -26258 110573 -47266 183867 -38627 83740 -6723 129228 68642 54409 -48016 900000 -65574 76094 -36204 97875 -21343 199336 -14059 43812 8414 4399 40223 57030 6189 52422 7199 -3153 -2285 25851 9295 45829 13260 1555 9227 26071 17403 13095 4372 21057 8588 3141 5367 -3821 18590 160 16049 667 7051 4983 9367 -4441 1916 -1790 5953 -7392 4701 -3407 5402 -6358 2516 -3933 1344 -2217 3573 -2069 -827 -954 -531 -2850 303 -1931 139 -4510 2117 -393 4379 -2349 -1880 -857 -1143 -3752 299 -1430 1821 6 -4650 -4429 2120 402 -644 -1838 -125 -1715 1454 -178 1140 747 169 -129 -1534 120 177 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