File name: Pandora64s1_NewHavenCT_20231213_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240123T151258.4Z 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_20231213_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: 20231213 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 20231213T125510.4Z 8747.538315 62 1 43.02 2 83.67 128.61 92.98 126.56 0.00 1 0.00 1 0 25 8.223e-01 6.072e-02 3.336e-01 2.242e-02 9.367123e-01 1.307127e-02 1.154232e-02 -6.000000e+00 4.902733e-01 222.75 -2.00 3.52 -2.00 321.70 0.00e+00 2.366584e-02 4.763404e-03 1.689613e-03 -6.000000e+00 2.156781e-02 277.13 -2.00 20.00 -2.00 321.18 0.00e+00 8.183 0.010 302.00 328.00 3 1.3340e+00 4.0880e-02 9.5210e-02 -6.0000e+00 1.2077e+00 1.9829e+00 4.7715e-02 5.5986e-02 -6.0000e+00 1.3134e+00 -2.0148e+00 3.0723e-02 2.5349e-02 -6.0000e+00 7.8218e-01 7.0283e-01 1.6468e-02 2.0272e-02 -6.0000e+00 3.3282e-01 1.0592e-05 -3.0733e-03 5.9618e-04 3.2693e-04 -6.0000e+00 2.4424e-02 -6.0737e-04 -1.0380e-04 12 9 9 12 1 1 96.54 21.57 0.22 -0.00061 -0.02370 13 4 1 5 0 3072.170 26.00 20.00 21.57 10.58 36.9 955.25 34239 177979 57736 208196 -53302 228656 26205 -4507 57043 132019 -71675 147919 -47347 6991 8355 157789 9029 900000 32047 466303 32592 900000 98232 213208 -49725 224126 -43762 49733 -35092 -72061 -22664 117221 68667 101046 49003 301140 12101 4257 26777 24634 109605 43117 55355 -37680 8046 28974 152545 -1351 41505 -41753 134455 77030 300985 9729 102524 9013 71235 7108 98879 -6248 48033 6237 40286 27457 71945 -8935 56489 43159 76390 5001 73783 30109 39181 -8778 8346 -13180 86092 -17293 898 7791 -126 -39748 11655 -1959 3458 -3524 17251 6798 12849 6455 38 1868 -14037 -6989 -1554 10490 -3253 5439 2285 -2282 -10062 -4340 -16447 1569 -11582 -1844 -7493 14495 -6100 6764 4244 2420 -945 4713 -5014 -401 -1995 189 -4367 4979 -944 3723 -817 10251 5102 4109 -7702 4544 335 -1054 -2520 417 -371 271 1652 -77 -486 1828 1247 95 -1859 -2924 3242 4618 4453 4550 -7765 4997 1314 -272 1792 2885 -6910 3232 -5721 638 924 4741 1195 900000 3378 10190 2849 900000 3757 4659 -6392 4898 -4613 2106 -3428 -12042 -2884 4483 4689 4830 3480 6581 1223 471 2743 2759 5389 4181 4839 -7798 1055 3324 5556 -212 4705 -10895 7443 7575 6577 1901 8261 1692 7297 1215 6752 -1132 5642 1171 6492 5294 9728 -2515 9027 7711 11476 1588 12899 7547 8310 -2697 1899 -3354 8583 -4979 257 2504 -51 -25382 5034 -954 1675 -1891 8160 3367 6194 3128 18 855 -7225 -3725 -926 6597 -2749 4833 2225 -2266 -9944 -3572 -13997 1136 -10124 -1524 -7096 12142 -7176 8056 5511 3390 -1388 6429 -7318 -553 -2894 280 -7076 7336 -1410 5027 -1118 12806 6559 5253 -10594 6234 564 -2057 -5582 971 -887 691 4430 -217 -1385 5120 3423 246 -4583 -7180 SS 20231213T130521.6Z 8747.545389 65 1 11.50 2 82.19 130.44 91.53 128.15 0.00 1 0.00 1 0 25 5.295e-01 3.154e-02 3.273e-01 1.830e-02 8.670886e-01 1.053501e-02 1.054365e-02 -6.000000e+00 3.160318e-01 222.75 -2.00 3.52 -2.00 321.67 0.00e+00 8.000383e-03 4.992008e-03 6.824566e-03 -6.000000e+00 1.517849e-02 277.13 -2.00 20.00 -2.00 321.20 0.00e+00 6.864 0.006 302.00 328.00 3 1.7752e+00 3.5743e-02 8.7116e-02 -6.0000e+00 7.7609e-01 1.0868e+00 4.4305e-02 5.7137e-02 -6.0000e+00 8.4362e-01 -1.3683e+00 3.5592e-02 3.0473e-02 -6.0000e+00 5.0144e-01 5.5182e-01 1.7509e-02 1.0012e-02 -6.0000e+00 2.1416e-01 3.5122e-05 -1.6722e-03 5.0999e-04 2.4157e-04 -6.0000e+00 1.5853e-02 -3.0617e-03 -7.2466e-05 12 9 9 12 1 1 86.99 21.57 0.29 -0.00306 -0.01563 6 7 1 5 0 1641.710 26.00 20.01 21.57 10.80 36.7 956.18 107936 -51902 68003 -28396 900000 -95320 -63792 -132373 38194 900000 -109193 -32646 -88632 -52319 -21537 154016 -65440 190542 -26374 77995 -15309 174733 22802 300582 10072 900000 -43929 -30199 3335 -68453 -10994 91010 -2168 114446 18289 72619 -9651 104962 7084 38424 73600 39785 74446 12389 13203 94140 16212 47853 59174 6684 33038 89353 84023 32139 30890 30509 3900 11910 6144 21314 19826 21578 14001 28294 39363 12306 16993 10959 25246 11239 13627 11123 13092 884 -75 -9483 21704 2808 -2499 1220 2040 -15844 -2443 -3500 1737 -5335 -1833 -6498 3643 -5818 -1675 -661 -2231 -7103 -4863 -4001 322 -2309 -113 -2259 -640 -4194 -4991 207 -1114 -2441 -1908 195 -1963 -212 2459 -1025 239 817 -807 -803 1400 -201 903 912 664 3520 707 3038 4604 1726 -3752 2735 755 970 29 -964 -1352 1664 778 -866 -228 613 383 823 -1639 -2458 1925 -2232 1213 -804 900000 -4200 -2008 -7869 681 900000 -5613 -925 -5579 -2854 -1039 2747 -5576 3398 -1688 1826 -803 3116 813 5360 404 900000 -2673 -1521 130 -5888 -646 2333 -148 2551 978 2266 -699 2925 572 2539 3856 2838 4066 1170 1233 4197 1514 3413 4221 820 3466 6175 6555 4214 4180 4193 653 1862 967 2840 2808 3350 2658 5194 6648 2548 3485 2519 5653 3229 4010 3361 3658 255 -20 -2462 4349 695 -772 434 835 -8357 -1213 -1853 928 -3190 -1092 -4074 2024 -3364 -873 -350 -1156 -4280 -3355 -3222 289 -2298 -116 -2309 -596 -3799 -4248 173 -1004 -2330 -1862 205 -2391 -290 3470 -1576 365 1216 -1181 -1161 2042 -310 1444 1459 1023 5267 1057 4274 6223 2352 -5430 4148 1290 1870 59 -2147 -3230 3945 1981 -2306 -607 1628 992 1982 -3946 -5598 SS 20231213T131514.6Z 8747.552252 68 1 48.33 2 80.80 132.26 90.15 129.72 0.00 1 0.00 1 0 25 5.309e-01 1.906e-02 7.017e-02 2.464e-03 7.775059e-01 1.387909e-03 9.091265e-03 -6.000000e+00 3.148135e-01 222.75 -2.00 3.52 -2.00 321.38 0.00e+00 1.335820e-02 6.741380e-04 1.779004e-03 -6.000000e+00 1.383051e-02 277.13 -2.00 20.00 -2.00 320.92 0.00e+00 5.942 0.004 302.00 328.00 3 8.3061e-01 4.6496e-03 7.2116e-02 -6.0000e+00 7.7451e-01 3.7031e-01 6.2947e-03 4.2930e-02 -6.0000e+00 8.4124e-01 -5.0766e-01 6.3232e-03 2.6449e-02 -6.0000e+00 5.0136e-01 2.1169e-01 3.0071e-03 1.6476e-02 -6.0000e+00 2.1414e-01 2.7049e-04 -1.6795e-03 6.8609e-05 2.2058e-04 -6.0000e+00 1.5766e-02 -1.2838e-03 -6.5163e-05 12 9 8 11 8 0 8.09 21.61 0.19 -0.00128 -0.01390 172 41 1 5 0 280.930 26.11 19.98 21.61 10.92 37.0 957.24 -158788 -124946 -159617 -161182 -294649 -156656 -180558 -155003 -149638 -152005 -147856 -112764 -104054 -81947 -50111 -30290 -34275 -22144 -7652 -2940 -22151 -13459 1673 -31363 -13085 -40211 -22868 -39080 -3555 -42265 -404 -3171 27402 9440 21420 -3492 21673 7122 26903 18842 24092 11987 25050 10837 24266 18824 26035 16875 21134 10107 25860 18575 24138 13030 17590 10301 8549 7208 7961 5173 11014 9581 10572 12558 12210 6840 7580 5467 4950 5535 3679 3313 1266 9 -1259 -2386 -766 -2547 -2034 609 -1092 -1910 -2579 -2550 -2038 -1138 -754 -95 370 752 -1024 -560 -3400 -3126 -2098 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