File name: Pandora64s1_NewHavenCT_20240904_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240905T052308.1Z 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_20240904_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: 20240904 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 20240904T111206.4Z 9013.466740 63 1 48.33 2 81.41 88.34 96.41 82.81 0.00 1 0.00 1 0 33 6.818e-01 4.333e-02 2.146e-01 9.896e-03 7.526761e-01 5.741213e-03 1.517164e-02 -6.000000e+00 4.153709e-01 230.10 -2.00 3.52 -2.00 321.59 0.00e+00 6.153377e-02 2.850873e-03 1.359507e-02 -6.000000e+00 1.862362e-02 288.46 -2.00 20.00 -2.00 321.04 0.00e+00 6.304 0.005 302.00 328.00 3 2.3602e+00 2.0338e-02 7.8234e-02 -6.0000e+00 1.0353e+00 1.3259e+00 2.3263e-02 4.1751e-02 -6.0000e+00 1.1168e+00 -1.6529e+00 1.4150e-02 2.5597e-02 -6.0000e+00 6.6632e-01 6.7988e-01 7.6674e-03 3.2182e-02 -6.0000e+00 2.8321e-01 2.9650e-05 -4.5907e-03 2.7257e-04 8.7339e-04 -6.0000e+00 2.0301e-02 3.8071e-03 -8.4415e-05 12 9 8 11 8 0 98.82 21.35 0.11 0.00381 -0.03069 28 7 1 5 0 1726.060 25.90 19.99 21.35 18.59 39.3 988.22 131774 86256 156060 151825 -101846 116296 137456 95512 320711 35041 15572 -13815 67588 37251 162364 130255 185291 179402 158280 113754 133178 202938 900000 115750 45914 7780 21390 -3459 68765 -29964 59147 83895 101131 95465 117782 54712 142746 64794 79689 78387 69860 51088 36687 5779 56341 59128 94015 80569 93774 13780 104092 13094 89132 34536 49745 24238 9386 8906 30166 13444 11048 24251 31782 50364 52726 25612 27785 34313 15849 17973 9907 7325 1290 597 -4358 -7721 16798 -7517 -5564 5985 -4423 -2135 -1216 -2980 -2692 -6785 -3830 -4658 755 2037 -5842 -4399 -14252 -10739 -8951 -5542 -5575 -1074 2269 612 -1468 -2520 -6444 -3365 -6078 -7395 -4047 1598 -877 -834 745 -1617 -624 279 407 -1940 634 -438 1967 3681 1988 4091 3948 5653 4676 1764 -1045 1766 1902 1103 1972 369 614 -1108 18 -706 -898 -76 1398 -1186 -1539 -2548 4291 4650 4517 3936 -21927 2524 1857 1474 3094 654 331 -466 1652 1730 3133 4006 3933 4385 4486 4801 4095 2741 900000 2308 1477 305 757 -156 1902 -2551 2960 3946 4512 4432 4091 3134 3581 3360 3652 3734 3665 3358 3031 659 4450 4920 5896 6170 6559 2119 7406 2296 7954 5037 5872 3439 1449 1304 3527 1968 1850 4129 5808 8632 9156 5698 6071 7107 4044 4942 3048 2289 402 170 -1241 -2077 3508 -2180 -1798 2088 -1977 -1047 -628 -1629 -1550 -4024 -2291 -2855 460 1172 -3394 -2393 -8448 -6665 -6063 -4345 -5166 -1101 2411 649 -1476 -2284 -5601 -2894 -5731 -7413 -4256 1743 -1051 -1133 1102 -2557 -975 419 588 -2845 944 -695 3229 6040 3225 6212 5815 7864 6363 2417 -1463 2647 3283 2056 4013 814 1429 -2657 46 -1847 -2374 -200 3586 -2948 -3778 -5943 SS 20240904T113045.4Z 9013.479692 74 1 8.62 2 77.91 91.42 93.06 85.88 0.00 1 0.00 1 0 25 4.075e-01 1.557e-02 1.890e-01 6.188e-03 6.078753e-01 3.456813e-03 7.441809e-03 -6.000000e+00 2.498881e-01 230.10 -2.00 3.52 -2.00 320.56 0.00e+00 5.270734e-03 1.413315e-03 3.282909e-03 -6.000000e+00 1.121384e-02 288.45 -2.00 20.00 -2.00 319.89 0.00e+00 4.628 0.002 302.00 328.00 3 2.4624e+00 1.0920e-02 5.7847e-02 -6.0000e+00 6.2254e-01 1.0547e-01 1.3777e-02 3.6041e-02 -6.0000e+00 6.7172e-01 -1.5909e-01 1.1989e-02 1.8766e-02 -6.0000e+00 3.9961e-01 6.0029e-02 5.9584e-03 5.8128e-03 -6.0000e+00 1.6925e-01 2.2703e-04 -6.9323e-04 1.8490e-04 1.0352e-04 -6.0000e+00 1.2171e-02 2.7108e-03 -8.7047e-05 12 9 9 12 1 1 92.98 21.35 0.30 0.00271 -0.00250 11 16 1 5 0 717.580 25.90 19.99 21.35 19.01 39.3 990.41 -151545 -36132 -104548 86516 -234733 900000 -130234 241691 -117686 -26010 -99739 -38710 -87681 -35942 -7341 61298 -28581 11826 -22933 22715 -34569 64944 17379 12034 -21226 10197 -16130 -1290 -5022 -17096 14678 1567 -2689 -7235 12565 -572 -1050 2176 6962 9040 10705 -178 11151 1283 7178 1705 7246 2279 3681 -3245 14476 4083 7225 3041 7022 1636 2864 1584 5624 1281 1743 2168 6250 4253 6042 -1028 4052 -286 2586 1946 1086 54 1756 -987 965 -1631 138 -5591 -652 -1061 -1258 -1060 -2458 -2764 14 -1545 103 -403 949 307 219 -969 -2326 -1438 -135 431 -810 1082 538 -141 -1183 -1106 -3581 -717 -1040 -1069 -1202 20 249 805 699 207 93 716 -732 -73 72 350 631 1091 -367 149 1188 1196 1526 837 -2029 1275 1242 147 410 -495 -499 -475 416 -390 -626 419 301 -53 -243 -984 -3324 -277 -1663 522 -11093 900000 -2643 1458 -2582 -267 -2079 -531 -2501 -769 -145 777 -893 272 -792 523 -1422 1097 458 356 -920 336 -690 -47 -196 -853 636 89 -180 -512 703 -39 -82 196 658 963 1222 -24 1413 183 989 255 1049 362 605 -620 2591 889 1653 780 1793 457 801 442 1484 359 520 664 2056 1559 2184 -389 1485 -115 1142 971 580 29 915 -496 433 -690 56 -2538 -325 -620 -782 -738 -1854 -2225 12 -1392 95 -353 866 267 178 -761 -1828 -1203 -127 430 -929 1274 659 -168 -1416 -1205 -3848 -791 -1227 -1319 -1492 26 361 1205 1127 342 151 1103 -1090 -106 107 547 1039 1816 -606 236 1817 1858 2293 1225 -3036 2011 2063 255 768 -982 -989 -1001 926 -857 -1402 941 663 -117 -514 -2004 SS 20240904T113535.2Z 9013.483047 77 1 48.26 2 77.00 92.23 92.20 86.68 0.00 1 0.00 1 0 25 2.406e-01 7.986e-03 3.231e-02 1.279e-03 5.754824e-01 7.086476e-04 6.700563e-03 -6.000000e+00 1.466086e-01 230.10 -2.00 3.52 -2.00 320.32 0.00e+00 1.180129e-03 2.693056e-04 1.220778e-03 -6.000000e+00 6.569724e-03 288.45 -2.00 20.00 -2.00 319.62 0.00e+00 4.328 0.001 302.00 328.00 3 1.5733e+00 2.1667e-03 5.3194e-02 -6.0000e+00 3.6543e-01 -6.1340e-03 2.7149e-03 3.1254e-02 -6.0000e+00 3.9416e-01 -1.8259e-02 2.3861e-03 1.5618e-02 -6.0000e+00 2.3517e-01 -1.8298e-03 1.1992e-03 4.4546e-03 -6.0000e+00 9.9940e-02 7.8599e-04 -4.8156e-04 3.8650e-05 5.9709e-05 -6.0000e+00 7.1605e-03 2.2820e-03 -6.0790e-05 11 8 0 10 0 0 34.70 21.35 0.19 0.00228 -0.00134 215 52 1 5 0 224.440 25.90 19.99 21.35 19.23 39.4 991.49 -90872 -68342 -70235 -78529 -153459 -78262 -77879 -60330 -50409 -58654 -56412 -47345 -26244 -27883 -18242 -20279 -8791 -13771 -8198 -7672 -9241 -7413 -34 -7053 -6822 -3474 -4523 -7222 -6514 -13630 -1636 -527 3269 -1465 -2745 -4653 -1889 -638 2222 55 1660 1091 1819 -2023 914 239 1658 8 102 -1164 2007 2200 2873 2066 786 1319 1604 648 686 1469 730 2436 2472 3094 1559 -332 179 -796 837 1668 553 688 -700 429 -575 -1569 -1313 -2719 -1302 -567 -1510 -374 -1791 -1805 -352 -336 451 473 1200 649 389 491 -628 -142 636 50 -329 1200 497 -364 -665 -1872 -2223 148 155 -1477 -496 -613 -120 556 917 333 149 96 -159 -259 525 -186 678 412 -277 -274 635 77 988 518 -1178 344 826 230 259 -565 -687 -381 421 -186 -395 430 372 -292 342 -617 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