File name: Pandora64s1_NewHavenCT_20240312_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240313T050636.7Z 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_20240312_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: 20240312 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 20240312T114834.9Z 8837.492070 59 1 48.13 2 83.16 100.13 96.31 72.85 0.00 1 0.00 1 0 25 5.642e-01 3.997e-02 1.778e-01 1.157e-02 1.092116e+00 6.961369e-03 1.300814e-02 -6.000000e+00 3.385025e-01 226.04 -2.00 3.52 -2.00 322.12 0.00e+00 5.108967e-02 3.025844e-03 1.446962e-02 -6.000000e+00 1.467124e-02 276.67 -2.00 20.00 -2.00 321.71 0.00e+00 7.679 0.008 302.00 328.00 3 7.4383e-01 2.3620e-02 1.5993e-01 -6.0000e+00 8.3907e-01 2.2359e+00 2.6439e-02 1.9079e-01 -6.0000e+00 9.0959e-01 -2.6767e+00 1.5433e-02 2.7977e-02 -6.0000e+00 5.4058e-01 1.0607e+00 8.7984e-03 5.2624e-02 -6.0000e+00 2.2919e-01 2.4675e-05 -4.8749e-03 2.8160e-04 4.9143e-04 -6.0000e+00 1.6772e-02 1.0055e-03 -1.3384e-04 12 8 8 10 0 0 2.15 21.49 0.23 0.00101 -0.03563 38 9 1 5 0 1266.420 26.00 19.99 21.49 9.75 37.4 962.65 205661 184322 175145 135069 -70702 71697 79319 -4837 114176 -6488 -15696 -19521 70955 31772 146093 87797 116428 139821 101911 111694 131492 208957 900000 44363 61608 -17456 -9617 -26562 12058 -60871 41325 44683 84639 82893 95939 52021 94142 45528 60361 21506 52207 36503 73368 -10569 21879 56038 62099 36368 50600 5077 53388 63669 103447 44690 37217 32532 15089 12504 29795 32965 -6375 24782 23235 52073 69369 39910 16293 50812 28418 35979 15141 29539 9674 3165 -10000 -3991 11211 -17115 -6825 11519 319 -16237 3990 -3466 -2923 -2715 -323 -2147 2001 7041 -6667 -6403 -13732 -15527 -4818 -2565 -3730 2310 1762 -377 1758 -1121 -6513 -1607 -2547 -6516 -4245 683 -5141 -2927 -667 -2915 -2203 -207 -1469 -3316 -63 -820 978 3177 3123 4050 3801 4082 5963 3087 -675 1345 2046 566 836 517 701 -381 98 562 -732 105 642 -321 -1647 -2992 6605 7679 7601 7034 -18456 3796 2754 -286 1718 -248 -613 -1000 2402 2151 4533 5411 5861 6311 5927 5777 4698 2751 900000 1877 1738 -936 -443 -1474 522 -6552 2370 2983 4218 4053 3518 2690 3098 2440 2838 1517 2700 2231 3242 -1027 1728 3320 3679 3009 3854 599 4568 5209 5836 4580 3885 3304 1688 1317 2493 2697 -769 2726 3037 5876 6980 5404 2673 6641 4687 6027 3193 5256 1923 593 -1866 -634 1676 -3536 -1576 2740 100 -6821 1469 -1423 -1246 -1190 -142 -964 846 2689 -2732 -2540 -6019 -7283 -2466 -1578 -2796 1916 1595 -343 1445 -827 -4530 -1061 -1792 -4978 -3452 591 -5487 -3354 -855 -4131 -3188 -293 -2063 -4730 -91 -1247 1524 4808 4473 5381 4866 5042 7574 3999 -858 1913 3475 1137 1782 1209 1767 -1040 282 1659 -2187 310 1834 -859 -4085 -6920 SS 20240312T115903.0Z 8837.499340 62 1 48.32 2 81.23 101.91 94.46 74.52 0.00 1 0.00 1 0 25 4.510e-01 2.546e-02 1.011e-01 3.614e-03 9.464177e-01 2.088067e-03 1.065106e-02 -6.000000e+00 2.706616e-01 226.04 -2.00 3.52 -2.00 321.83 0.00e+00 2.261439e-02 1.101010e-03 2.370146e-03 -6.000000e+00 1.172525e-02 276.67 -2.00 20.00 -2.00 321.41 0.00e+00 6.198 0.004 302.00 328.00 3 9.0490e-01 7.3807e-03 8.6021e-02 -6.0000e+00 6.7091e-01 9.0449e-01 9.7601e-03 7.1590e-02 -6.0000e+00 7.2723e-01 -1.2183e+00 9.2655e-03 2.8039e-02 -6.0000e+00 4.3220e-01 5.0842e-01 4.3729e-03 2.3673e-02 -6.0000e+00 1.8321e-01 1.4375e-04 -2.6432e-03 9.4956e-05 3.0932e-04 -6.0000e+00 1.3402e-02 -1.2199e-04 -8.4361e-05 12 8 8 10 0 0 19.86 21.49 0.17 -0.00012 -0.01998 114 27 1 5 0 423.830 26.00 19.98 21.49 10.60 37.2 965.85 -132635 -63797 -54262 -93777 -256572 -99139 -139827 -147887 -133991 -84228 -155305 -108016 -91330 -70254 -9184 -7621 18866 34446 -17263 18267 8566 46579 10109 25297 11154 -21469 -24557 -47812 -10757 -42473 12091 27355 34920 48374 47330 23136 29135 32088 16654 22836 38578 36612 36746 20942 36462 39855 52380 38427 34528 22300 46348 28524 56639 32273 35564 24861 21105 18021 27341 17451 22778 20526 25065 24584 29616 17484 17456 17475 15078 13278 11802 11107 7790 4165 1867 -1560 5874 -1155 -1256 2587 196 -3442 604 -2378 -592 -1545 -337 -196 1607 679 -1207 -1528 -5661 -4954 -4685 -3239 -3296 -102 479 -214 -759 -2074 -4434 -1954 -2863 -3680 -2772 -2033 -2021 -925 -666 -440 -829 -364 -960 -888 208 307 1257 2299 1097 1852 2435 2459 3059 2481 -755 1258 1444 1204 1254 90 -15 -67 299 -106 -730 287 365 -674 -637 -2385 -3145 -922 -727 -1502 -16502 -1432 -2554 -2795 -2361 -891 -3184 -1941 -1963 -1684 -155 -153 326 558 -481 354 172 591 178 366 177 -462 -537 -1331 -227 -1527 328 762 1034 1262 1151 718 914 1097 757 1086 1672 1703 1800 1120 1902 2107 2584 2142 2157 1729 3178 2568 4137 3195 3441 2676 2319 1957 2610 1856 2467 2598 3517 3954 4754 3187 3339 3544 3233 3244 3071 2913 1988 1004 411 -326 1255 -269 -354 852 77 -1611 293 -1252 -300 -825 -184 -107 854 375 -638 -790 -3124 -2804 -3142 -2561 -3069 -98 490 -215 -764 -1872 -3775 -1661 -2607 -3532 -2861 -2135 -2430 -1268 -1023 -667 -1279 -550 -1517 -1389 310 479 2024 3653 1684 2860 3617 3519 4248 3404 -1079 1985 2490 2374 2582 203 -36 -163 769 -281 -1963 767 944 -1746 -1531 -5445 SS 20240312T121132.4Z 8837.508014 67 1 48.28 2 78.94 104.06 92.23 76.49 0.00 1 0.00 1 0 25 6.562e-01 1.266e-02 5.344e-02 1.510e-03 8.028547e-01 8.532073e-04 9.047859e-03 -6.000000e+00 3.939030e-01 226.04 -2.00 3.52 -2.00 321.20 0.00e+00 5.655404e-03 3.987690e-04 1.567476e-03 -6.000000e+00 1.706231e-02 276.67 -2.00 20.00 -2.00 320.75 0.00e+00 5.028 0.002 302.00 328.00 3 8.8283e-01 2.7630e-03 6.5994e-02 -6.0000e+00 9.7641e-01 1.5970e-01 3.8871e-03 4.3685e-02 -6.0000e+00 1.0583e+00 -2.1653e-01 4.1634e-03 2.5490e-02 -6.0000e+00 6.2896e-01 8.5033e-02 1.9802e-03 1.0894e-02 -6.0000e+00 2.6667e-01 6.0434e-04 -9.4769e-04 4.1518e-05 1.3751e-04 -6.0000e+00 1.9502e-02 -1.1299e-03 -7.1889e-05 12 8 8 10 0 0 14.81 21.49 0.15 -0.00113 -0.00825 259 62 1 5 0 186.370 26.00 20.01 21.49 11.62 37.5 971.15 -228030 -210399 -209331 -214643 -309765 -206569 -197436 -195824 -158213 -182305 -166370 -143455 -127246 -112219 -80922 -76260 -72104 -47016 -55393 -52293 -50346 -37455 -36763 -43148 -45851 -41563 -35999 -34392 -37175 -37549 -16823 -7395 -3331 2056 -7995 -9339 -776 -1507 4362 8898 6309 9911 7861 6137 5751 9133 7175 9588 7033 5993 12116 6237 11122 9991 8349 6711 5066 4742 5052 4201 4391 4471 7075 7690 4622 1464 2456 2471 2234 4008 2224 2088 739 202 -1071 -2136 -1264 -2838 -959 -9 -563 -1613 -1937 -2611 -952 -906 258 -7 1279 436 -413 -677 -1461 -1675 -146 -437 -555 686 603 -282 -508 -1808 -2483 -94 179 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