File name: Pandora75s1_EssexMD_20241031_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20241101T050937.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20241031_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20241031 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: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 20241031T120614.1Z 9070.504330 63 1 50.19 2 84.89 113.27 76.33 119.72 0.00 1 0.00 1 0 17 7.088e-01 8.422e-02 5.043e-01 7.223e-02 8.443954e-01 4.276807e-02 9.862945e-03 -6.000000e+00 4.328875e-01 224.76 -2.00 3.48 -2.00 321.46 0.00e+00 -2.001292e-02 1.337266e-02 5.140666e-03 -6.000000e+00 2.023134e-02 283.42 -2.00 20.00 -2.00 320.81 0.00e+00 9.655 0.016 302.00 328.00 3 2.9684e-01 1.3330e-01 1.1469e-01 -6.0000e+00 1.0682e+00 1.9158e+00 1.5256e-01 7.9723e-02 -6.0000e+00 1.1566e+00 -1.8352e+00 9.1898e-02 2.1292e-02 -6.0000e+00 6.8780e-01 5.9819e-01 5.1056e-02 2.1718e-02 -6.0000e+00 2.9900e-01 9.4954e-06 3.5395e-04 2.1930e-03 3.1805e-04 -6.0000e+00 2.2976e-02 -2.6950e-02 1.1250e-05 12 9 8 11 16 0 23.65 23.68 2.06 -0.02695 -0.02429 15 2 1 5 0 3345.360 26.41 20.00 23.68 22.62 5.4 973.79 900000 147810 -8038 52722 5086 -9767 900000 58576 -27632 900000 72849 27862 900000 316578 39017 55387 12952 47580 50516 -45384 114335 73542 76468 108289 144819 36364 318468 55376 900000 -44656 -18748 -51496 -60044 38994 87311 900000 -32402 900000 -67702 14490 -8937 113803 28099 -10021 936 107474 900000 -50941 17405 -16497 -17580 54295 73125 -16819 201210 -33118 2708 44457 159475 -36874 43415 14151 -5143 13859 71247 363714 23901 74531 79138 488 46803 34106 84442 44379 19751 46769 10782 137464 -26493 37508 35032 -20435 9014 21913 -2484 11497 -5262 1085 25600 -7134 21530 -5531 41205 -2066 -18644 22908 2616 -8235 13113 19875 -10763 -10265 10329 766 508 -18661 1193 -11043 11159 15266 7296 -5559 -2044 -4389 -868 -3771 3218 2315 1147 584 1550 -2976 8145 2676 5831 -6911 -13428 -1754 -932 1871 5067 2686 627 1212 561 -2650 -141 -3765 178 166 4442 479 900000 10394 -1130 3707 440 -973 900000 4119 -4210 900000 5123 2612 900000 22262 3887 4868 1746 4461 4440 -9840 8040 5171 5377 7615 10184 3836 22395 3894 900000 -7065 -2417 -9958 -13371 3199 6140 900000 -5127 900000 -21027 2501 -2114 8003 4491 -2178 168 7558 900000 -13352 2337 -3269 -3821 6248 7479 -4516 14149 -11432 658 6821 11214 -10843 5551 2533 -1217 2924 8654 25576 4584 9053 10118 153 9873 8285 11876 8511 4293 6877 2137 9666 -8807 7673 8510 -9798 3515 7985 -1223 5145 -2859 555 9983 -3648 7707 -2475 12749 -1061 -12848 12082 1950 -7702 10512 14675 -10066 -8662 6610 544 382 -17978 1007 -11493 10436 15565 8978 -8287 -2989 -6451 -1190 -5224 4232 3208 1677 870 2234 -4311 10195 3425 7012 -9233 -19357 -2455 -1481 3288 9585 5648 1445 2992 1491 -7602 -403 -11253 501 443 10619 1127 SS 20241031T121750.7Z 9070.512393 66 1 51.83 2 82.84 115.21 74.48 121.85 0.00 1 0.00 1 0 17 4.548e-01 2.400e-02 1.512e-01 4.760e-03 6.854479e-01 2.698051e-03 9.100652e-03 -6.000000e+00 2.730078e-01 224.76 -2.00 3.48 -2.00 321.46 0.00e+00 1.305977e-02 1.344256e-03 7.033330e-03 -6.000000e+00 1.212698e-02 283.42 -2.00 20.00 -2.00 320.94 0.00e+00 7.386 0.007 302.00 328.00 3 5.7555e-01 9.3642e-03 8.6113e-02 -6.0000e+00 6.7291e-01 6.0800e-01 1.2022e-02 4.7122e-02 -6.0000e+00 7.2754e-01 -8.7238e-01 1.0063e-02 2.8311e-02 -6.0000e+00 4.3481e-01 3.6126e-01 4.7915e-03 1.1765e-02 -6.0000e+00 1.8698e-01 1.0038e-04 -2.5623e-03 1.4359e-04 2.7149e-04 -6.0000e+00 1.3990e-02 -2.8849e-02 1.2113e-04 12 8 8 10 0 0 58.80 23.70 0.88 -0.02885 -0.04810 73 12 1 5 0 709.930 26.41 20.01 23.70 23.54 5.5 981.16 -160442 -117462 -13293 -98858 -120340 -97314 21294 -101175 -143210 -114796 -135861 -75267 -18071 -38601 -70686 107293 23703 33778 56229 73013 24868 81822 195282 -10679 20196 -15596 85714 -19987 12981 -52612 17173 -10284 47288 73245 27217 117244 -14030 59520 34114 5211 15504 16183 35910 53065 34075 44681 42356 16374 53019 40738 34924 18514 37868 58276 14988 23222 6510 27988 11693 18124 2725 13470 9333 15697 11910 -3080 9617 2866 13824 16034 7629 6508 6951 -3490 4130 1742 -1949 -486 -3773 -2274 -2897 -7918 -1462 675 -651 -2412 1061 526 1286 -3287 -1120 -6118 -2822 -7099 -4048 -875 -1454 696 -929 -65 -2853 -2538 -2499 -1501 -2123 -2261 -1039 -1998 364 -385 1441 -223 -155 -930 96 -1068 107 -169 222 1547 1941 3663 3062 1765 1502 354 801 -1166 701 354 604 -301 105 -56 -54 154 172 649 75 -466 -894 -1846 -8395 -4659 -196 -3295 -4418 -2546 162 -2604 -5680 -3439 -5045 -1651 -275 -928 -2953 905 520 727 1020 1140 619 1105 906 -351 486 -533 1049 -683 318 -2686 566 -530 1558 1972 1124 1905 -886 2017 1726 404 1195 1314 2500 3202 2531 3049 3028 1566 3667 3385 3356 2303 4201 5626 2324 3374 1121 3819 1824 2625 478 2332 1906 3359 2797 -838 2294 756 3555 4532 2560 2293 2400 -1259 1259 492 -540 -136 -1231 -865 -1300 -4263 -811 392 -409 -1488 663 340 907 -2134 -737 -3995 -1743 -4788 -2980 -662 -1294 694 -1021 -72 -3047 -2473 -2263 -1347 -2030 -2304 -1118 -2362 466 -512 2082 -347 -244 -1438 141 -1548 155 -259 357 2545 3163 5696 4639 2618 2156 546 1222 -1769 1173 669 1254 -627 231 -131 -134 404 428 1631 188 -1213 -2207 -4370 SS 20241031T122819.4Z 9070.519670 69 1 51.70 2 81.02 117.00 72.85 123.82 0.00 1 0.00 1 0 17 4.188e-01 1.381e-02 3.778e-02 1.893e-03 5.996415e-01 1.042788e-03 7.725149e-03 -6.000000e+00 2.514887e-01 224.76 -2.00 3.48 -2.00 320.72 0.00e+00 4.457649e-03 4.358274e-04 4.950225e-03 -6.000000e+00 1.116867e-02 283.42 -2.00 20.00 -2.00 320.14 0.00e+00 6.070 0.004 302.00 328.00 3 5.1568e-01 3.2899e-03 7.1116e-02 -6.0000e+00 6.1988e-01 1.5729e-01 4.1964e-03 4.1848e-02 -6.0000e+00 6.7012e-01 -2.5862e-01 3.8107e-03 2.0564e-02 -6.0000e+00 4.0050e-01 1.0216e-01 1.8817e-03 5.5421e-03 -6.0000e+00 1.7228e-01 4.3564e-04 -1.4462e-03 5.7673e-05 1.3073e-04 -6.0000e+00 1.2883e-02 -2.9953e-02 1.6933e-04 12 8 8 10 0 0 61.97 23.70 0.62 -0.02995 -0.04082 169 28 1 5 0 305.880 26.41 20.00 23.70 24.88 5.4 989.10 -194459 -147803 -108609 -140888 -123672 -137699 -140617 -118785 -127875 -118740 -110683 -102109 -71784 -75148 -76001 -19644 -33705 -15363 -11732 -11972 -15650 -24827 -4312 -23846 -21815 -13374 -5900 -17214 -15690 -33044 -7086 -11711 5136 -5906 -5109 4129 -13529 990 2798 2055 2946 3745 6151 11762 8309 10581 12284 5285 8416 5225 7312 7887 9988 10363 4036 6500 2957 3760 1853 3351 301 2110 5140 5785 3912 1007 3046 1128 3069 4099 3432 2450 1853 107 226 -2258 -3697 -3791 -3614 -2507 -2108 -3111 -1681 -1336 -713 -475 764 1073 1128 98 -370 -1406 -1375 -2691 -1899 -692 -32 518 224 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