File name: Pandora64s1_NewHavenCT_20241108_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20241109T044137.2Z 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 v1.8.60 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20241108_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: 20241108 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 20241108T120554.0Z 9078.504097 56 1 48.63 2 85.07 117.50 151.91 57.30 0.00 1 0.00 1 0 25 7.508e-01 7.740e-02 2.480e-01 2.816e-02 9.398724e-01 1.644574e-02 1.546640e-02 -6.000000e+00 4.463498e-01 223.69 -2.00 3.52 -2.00 321.27 0.00e+00 6.680329e-02 4.898700e-03 2.500847e-03 -6.000000e+00 1.993139e-02 280.96 -2.00 20.00 -2.00 320.78 0.00e+00 9.926 0.018 302.00 328.00 3 -3.5459e-01 5.0223e-02 1.3528e-01 -6.0000e+00 1.0985e+00 2.7597e+00 5.6664e-02 1.4769e-01 -6.0000e+00 1.1920e+00 -2.6429e+00 2.9016e-02 2.2605e-02 -6.0000e+00 7.1169e-01 9.0843e-01 1.6832e-02 5.2753e-02 -6.0000e+00 3.0430e-01 8.0471e-06 -5.5620e-03 7.0792e-04 8.4528e-04 -6.0000e+00 2.2312e-02 5.7697e-03 -3.0840e-04 12 8 8 10 0 0 38.79 21.11 0.61 0.00577 -0.03603 21 5 1 5 0 2314.960 25.68 19.99 21.11 13.22 38.8 963.76 239031 245198 234616 221370 -35352 148437 102698 61009 48278 30888 -21246 29416 71186 112448 218099 189931 142636 177550 113331 216043 196809 900000 174972 92677 -5572 41746 -17024 -19931 52492 -80890 30721 58516 74614 78502 181470 82154 12446 -23657 17797 -2543 89136 2798 20290 -51977 37232 31442 86125 4718 79060 -38417 99855 79592 161415 30350 91979 9182 11331 -10061 96955 18690 20703 18559 63037 -10792 128069 31800 48069 60366 48980 18346 24983 21229 8719 -5764 -12427 -19540 67605 -20637 -17649 18785 -11106 -10868 10199 -990 2173 -1633 9902 2895 5851 -271 -11097 9034 -26256 -20858 -17186 12757 -4793 7103 1084 -660 -843 1975 -13942 2579 -9463 -8003 -8451 26135 -3162 2383 3411 -1664 -1659 4118 -3143 -5054 -1805 2088 522 5121 -696 4678 3618 11227 2994 -2129 -4783 6320 1394 1337 -909 -3452 -1452 -436 1280 -79 792 -489 1941 1010 -2826 -1259 19086 19578 19904 17123 -21795 11852 8456 5176 3373 2004 -2121 2275 5684 8979 8163 11374 14948 13734 15836 9703 8840 900000 5676 4856 -584 2292 -1572 -1989 3013 -23413 3986 6862 8192 7835 5977 5945 1708 -4486 2176 -374 5627 384 2481 -13748 4273 4080 7565 907 8246 -12270 9319 9394 8418 5225 8584 1604 1753 -1757 6121 2668 3182 3056 8478 -3124 10546 6110 7916 9776 8677 4761 6109 5191 2197 -1481 -2977 -4534 7237 -5407 -5505 4968 -4572 -4990 3995 -445 982 -787 4349 1365 2628 -122 -5178 3291 -13693 -11450 -10893 7289 -3899 5973 1039 -629 -739 1469 -10959 1724 -7532 -6550 -7549 18325 -3417 2819 4120 -2242 -2261 5209 -4163 -6797 -2456 2880 767 7204 -992 5971 4921 13671 3869 -2863 -6683 8957 2261 2502 -1954 -8260 -3660 -1163 3577 -230 2311 -1459 5536 2728 -7388 -3030 SS 20241108T121737.2Z 9078.512236 59 1 48.10 2 83.14 119.55 150.09 61.05 0.00 1 0.00 1 0 25 3.911e-01 2.958e-02 1.572e-01 6.078e-03 8.729568e-01 3.505502e-03 1.071412e-02 -6.000000e+00 2.325988e-01 223.69 -2.00 3.52 -2.00 321.94 0.00e+00 3.196430e-02 1.935345e-03 1.319474e-03 -6.000000e+00 1.034996e-02 280.96 -2.00 20.00 -2.00 321.49 0.00e+00 7.657 0.008 302.00 328.00 3 3.1836e-01 1.3042e-02 9.2512e-02 -6.0000e+00 5.7265e-01 1.1568e+00 1.6047e-02 6.7007e-02 -6.0000e+00 6.2137e-01 -1.4885e+00 1.2958e-02 2.5981e-02 -6.0000e+00 3.7092e-01 6.1303e-01 6.2741e-03 2.8179e-02 -6.0000e+00 1.5853e-01 6.7800e-05 -3.3326e-03 1.6678e-04 4.7467e-04 -6.0000e+00 1.1617e-02 3.1716e-03 -1.1260e-04 12 9 8 11 8 0 44.32 21.11 0.23 0.00317 -0.02187 82 20 1 5 0 586.510 25.68 19.99 21.11 14.26 38.9 969.06 -17554 21344 -3332 18145 -183837 -42200 -52556 -44706 -56980 -18761 -116204 -27305 -58090 21186 26255 76582 38632 128296 71492 105313 30824 136841 31092 35367 -3298 78867 -9276 27460 -9762 -48882 5437 79869 27769 84096 55396 37575 40382 35237 49219 60124 38461 52341 56607 15923 35560 44301 50487 46014 45125 26080 61149 46455 76072 36676 36551 21721 24923 12261 40287 13489 16689 19250 36585 17337 38485 24922 27948 26214 25395 15691 15812 9772 12484 1039 4886 -3978 10887 -1805 5801 1333 1798 -1501 1698 -3201 -700 -3362 -238 -2045 2626 219 -2900 -3632 -7834 -9115 -6138 -3297 -4913 -919 579 -1269 -1208 -1715 -6676 -2206 -3731 -3556 -4145 -1095 -3054 -957 -797 -991 -444 -290 -872 -1124 -250 884 1391 2816 1844 2842 2813 3409 2160 2536 -1436 1238 1972 1859 789 702 302 -33 192 -199 -1231 182 349 -736 -889 -2223 -463 414 -83 313 -18067 -932 -1104 -771 -1013 -233 -3506 -469 -1753 439 669 1407 1041 1673 1652 1685 950 1298 774 755 -94 935 -258 537 -307 -2554 235 1941 1167 2193 1740 1381 1508 1504 2013 2387 1983 2450 2684 1064 2031 2678 3022 2801 2942 2220 4052 3854 4959 3695 3643 2457 2645 1407 3386 1512 1960 2520 4652 3026 5660 4176 4698 4689 5103 3863 4055 2432 3101 264 1066 -868 2059 -427 1535 409 640 -628 739 -1536 -348 -1792 -127 -1126 1363 111 -1422 -1738 -3969 -5199 -4026 -2514 -4139 -858 567 -1239 -1092 -1386 -5247 -1844 -3114 -3106 -3959 -1120 -3635 -1281 -1191 -1453 -654 -449 -1321 -1694 -389 1322 2172 4353 2767 4329 4160 4836 3030 3484 -2069 1947 3341 3584 1708 1635 705 -81 510 -548 -3445 506 945 -1885 -2129 -5062 SS 20241108T122756.9Z 9078.519409 62 1 48.26 2 81.47 121.39 148.44 64.07 0.00 1 0.00 1 0 25 5.878e-01 1.508e-02 8.473e-02 2.461e-03 7.705708e-01 1.392206e-03 8.952993e-03 -6.000000e+00 3.495652e-01 223.69 -2.00 3.52 -2.00 321.42 0.00e+00 9.647250e-03 7.161266e-04 2.038307e-03 -6.000000e+00 1.555362e-02 280.95 -2.00 20.00 -2.00 320.93 0.00e+00 6.351 0.005 302.00 328.00 3 4.5412e-01 4.8661e-03 7.5383e-02 -6.0000e+00 8.6063e-01 2.8091e-01 6.7599e-03 4.2202e-02 -6.0000e+00 9.3381e-01 -3.6320e-01 6.8205e-03 2.5725e-02 -6.0000e+00 5.5743e-01 1.4660e-01 3.1975e-03 1.3063e-02 -6.0000e+00 2.3826e-01 2.7788e-04 -1.5342e-03 7.0019e-05 1.8407e-04 -6.0000e+00 1.7458e-02 2.3196e-03 -1.2509e-04 12 8 8 10 0 0 31.83 21.10 0.19 0.00232 -0.00921 181 44 1 5 0 266.630 25.68 20.02 21.10 15.70 38.8 975.67 -196078 -155748 -169825 -194911 -308857 -179902 -198303 -170246 -145623 -153464 -182702 -120549 -115861 -68834 -76124 -34172 -62352 -14264 -34193 -26851 -48309 -611 -34556 -30662 -49820 -19478 -46386 -15505 -35746 -34426 -21120 -2919 -10371 8233 -21521 9770 -7221 13338 -540 22028 6960 12661 6956 3213 6823 14098 14847 10011 11450 9167 15529 5671 19194 14990 12972 10174 8388 4965 7105 6627 6690 7793 9289 8446 10306 4764 5540 2626 4645 4033 3527 2350 1233 -82 161 -2641 571 -3522 -203 -488 -811 -990 -1430 -2160 -757 -1600 342 -916 1838 181 -432 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