File name: Pandora107s1_LynnMA_20240523_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T084018.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 107 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora107_OF_v1d20230601.txt Instrument calibration file used: Pandora107s1_CF_v7d20230718.txt Level 1 file used: Pandora107s1_LynnMA_20240523_L1_smca1c7d20230718p1-8.txt Full location name: Lynn Massachusetts Department of Environmental Protection Short location name: LynnMA Country of location: United States Location latitude [deg]: 42.4746 Location longitude [deg]: -70.9708 Location altitude [m]: 52 Local noon date: 20240523 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 6 First and last pixel inside fitting window: 220 362 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1791 305.3200 305.4608 305.6017 305.7426 305.8834 306.0242 306.1650 306.3059 306.4467 306.5874 306.7282 306.8690 307.0097 307.1505 307.2912 307.4319 307.5727 307.7134 307.8540 307.9947 308.1354 308.2761 308.4167 308.5573 308.6980 308.8386 308.9792 309.1198 309.2604 309.4009 309.5415 309.6820 309.8226 309.9631 310.1036 310.2441 310.3846 310.5251 310.6656 310.8060 310.9465 311.0869 311.2273 311.3678 311.5082 311.6485 311.7889 311.9293 312.0697 312.2100 312.3504 312.4907 312.6310 312.7713 312.9116 313.0519 313.1922 313.3324 313.4727 313.6129 313.7531 313.8934 314.0336 314.1738 314.3139 314.4541 314.5943 314.7344 314.8746 315.0147 315.1548 315.2949 315.4350 315.5751 315.7152 315.8552 315.9953 316.1353 316.2754 316.4154 316.5554 316.6954 316.8354 316.9753 317.1153 317.2552 317.3952 317.5351 317.6750 317.8149 317.9548 318.0947 318.2346 318.3744 318.5143 318.6541 318.7939 318.9338 319.0736 319.2134 319.3531 319.4929 319.6327 319.7724 319.9121 320.0519 320.1916 320.3313 320.4710 320.6107 320.7503 320.8900 321.0296 321.1693 321.3089 321.4485 321.5881 321.7277 321.8673 322.0068 322.1464 322.2859 322.4255 322.5650 322.7045 322.8440 322.9835 323.1230 323.2624 323.4019 323.5413 323.6808 323.8202 323.9596 324.0990 324.2384 324.3777 324.5171 324.6564 324.7958 324.9351 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20240523T100816.0Z 8909.422408 223 1 28.69 2 81.87 69.30 103.14 248.58 0.00 1 0.00 1 0 25 4.875e-01 4.908e-02 4.304e-01 4.237e-02 8.691209e-01 2.465146e-02 1.014688e-02 -6.000000e+00 2.953907e-01 231.58 -2.00 3.54 -2.00 321.73 0.00e+00 -1.669131e-02 8.910206e-03 1.408569e-03 -6.000000e+00 1.322265e-02 283.29 -2.00 20.00 -2.00 321.09 0.00e+00 6.620 0.005 302.00 328.00 3 3.4056e+00 8.0094e-02 8.3722e-02 -6.0000e+00 7.4123e-01 1.3888e+00 9.5941e-02 5.9801e-02 -6.0000e+00 8.0054e-01 -1.8422e+00 6.1434e-02 2.2962e-02 -6.0000e+00 4.7577e-01 7.0160e-01 3.1534e-02 1.5777e-02 -6.0000e+00 1.9987e-01 9.3282e-06 -1.2487e-03 1.1889e-03 2.1574e-04 -6.0000e+00 1.4365e-02 -3.6961e-02 0.0000e+00 12 8 8 10 0 0 96.74 22.18 1.74 -0.03696 -0.04634 8 8 1 5 0 3584.960 26.32 19.98 22.18 25.70 0.0 946.46 98645 22191 900000 63178 62958 47679 -20661 98167 -70913 99411 8920 130895 24611 43874 58880 -4696 4456 7762 155620 900000 7655 55643 -32997 -34422 17315 -27437 13663 -79133 146498 138066 43469 9903 -6573 44273 -35025 1913 61167 72285 119048 106593 5216 31465 93615 56623 102449 191222 37938 205988 -30846 12333 19083 -9002 -17380 44100 39614 27381 27853 2253 51229 46451 -101 -10054 2190 59256 9954 15689 40309 10308 4104 -4202 24452 48388 54490 28730 4928 1135 8301 31372 -19347 -21112 17732 -24455 2242 6632 7746 -1260 10541 2861 13095 3313 1370 3622 -965 -9500 -2266 -10444 2561 -6599 -2883 -1108 -5720 -8496 4617 -605 -11624 3785 -5658 10258 -2664 -4457 2584 -5099 1778 -2356 -307 -118 2701 3362 5241 -2967 -606 -1916 5456 -2034 4319 -1542 8568 3703 3893 699 -1116 1103 -2097 1 -2134 2425 -134 1792 2473 -2370 1572 -2401 -2529 4075 2000 900000 3084 2601 1969 -1629 4055 -11184 4106 670 5407 1663 2636 3316 -529 468 787 6428 900000 690 2925 -4089 -4524 1495 -3915 1231 -16046 6051 5703 2122 744 -642 2660 -4472 158 3032 3583 4917 5283 725 3899 6187 5145 5501 7899 3447 8508 -5479 1477 2286 -1562 -3589 5283 5236 4298 4487 465 6136 5372 -18 -1952 407 6853 2015 3046 5994 2086 966 -1215 5858 9594 10128 6527 1283 272 1680 4924 -5434 -6976 4687 -11414 898 2767 3392 -635 4964 1501 6166 1656 662 1616 -434 -4787 -1179 -6859 1724 -5587 -2620 -1044 -5482 -7580 3261 -434 -9699 2893 -5048 8305 -2707 -5265 3245 -7624 2614 -3630 -451 -167 3704 4721 7619 -4878 -976 -3015 7595 -2957 5780 -2121 10334 4803 5628 1213 -2245 2368 -4990 3 -5370 6192 -365 4831 6594 -6460 4265 -6228 -6205 SS 20240523T110938.7Z 8909.465031 253 1 10.36 2 70.99 78.94 113.62 257.49 0.00 1 0.00 1 0 33 6.797e-02 1.024e-02 3.449e-02 3.311e-03 4.635095e-01 1.757654e-03 5.501526e-03 -6.000000e+00 4.111104e-02 231.58 -2.00 3.54 -2.00 318.96 0.00e+00 2.344821e-03 4.180673e-04 7.235045e-04 -6.000000e+00 1.810771e-03 283.29 -2.00 20.00 -2.00 318.25 0.00e+00 3.033 0.000 302.00 328.00 3 3.1431e+00 4.8589e-03 3.9209e-02 -6.0000e+00 1.0303e-01 7.6739e-02 5.5965e-03 2.4672e-02 -6.0000e+00 1.1115e-01 -5.5396e-02 4.0552e-03 1.2414e-02 -6.0000e+00 6.6073e-02 1.3143e-02 2.1160e-03 4.0076e-03 -6.0000e+00 2.7732e-02 6.0598e-04 -2.0654e-04 9.7738e-05 4.4480e-05 -6.0000e+00 2.0006e-03 -3.6921e-02 0.0000e+00 12 9 9 12 9 1 81.15 22.17 0.39 -0.03692 -0.03847 10 32 1 5 0 941.140 26.32 20.00 22.17 25.35 0.0 945.28 -18989 -14846 -2250 -27957 7111 -24577 -21635 -22211 -29103 -25563 -25964 -13061 -20622 -11018 -2799 -1529 1673 -3625 1287 -251 -2386 -515 -91 2170 -5063 -3325 -3878 -6389 -3628 -1931 3004 -4226 -107 -5563 -3393 1991 -1231 3285 -1326 -2358 -3019 -2712 -252 -228 1401 101 1846 710 925 2087 2691 2993 2681 2249 1644 1702 1249 -460 425 1189 2585 2139 2116 1851 -458 -199 1323 1825 1553 578 -546 -1616 -1199 -1815 -1212 -751 512 1324 1741 -128 -1281 -1155 -2442 -1057 -458 -375 -350 -389 138 -254 -66 304 1237 1776 906 989 204 -336 -874 -2453 -1204 -785 963 1270 -955 -2128 -1226 -363 430 755 429 -749 331 379 1109 1687 2208 1234 962 -391 -1085 -305 -132 -253 27 -250 770 1843 1147 -585 -711 -990 325 574 -143 -451 -92 74 -524 -583 -107 -103 708 -472 -417 -60 -966 165 -738 -636 -732 -1165 -1065 -1132 -536 -1039 -612 -174 -110 130 -322 116 -24 -245 -53 -9 228 -620 -387 -502 -831 -452 -238 375 -589 -16 -957 -575 314 -207 607 -311 -660 -959 -857 -82 -76 466 34 622 244 321 738 1004 1213 1192 1075 828 893 625 -235 213 631 1373 1123 1223 1175 -313 -135 840 1121 1017 398 -422 -1338 -1000 -1479 -919 -517 341 836 1141 -89 -1040 -987 -2312 -1057 -452 -394 -391 -426 161 -289 -71 304 1208 1681 912 1041 231 -427 -1148 -3388 -1578 -987 1099 1522 -1157 -2784 -1584 -487 611 1102 679 -1196 525 608 1655 2492 3180 1843 1444 -627 -1707 -495 -207 -382 40 -368 1070 2519 1682 -913 -1147 -1680 565 992 -264 -839 -177 145 -1034 -1136 -200 -190 1249 SS 20240523T111517.5Z 8909.468952 256 1 29.99 2 69.97 79.82 114.60 258.31 0.00 1 0.00 1 0 25 4.294e-02 9.768e-03 6.253e-03 6.403e-04 4.401309e-01 3.386203e-04 5.192758e-03 -6.000000e+00 2.597091e-02 231.58 -2.00 3.54 -2.00 318.90 0.00e+00 2.339919e-03 7.831096e-05 4.517808e-04 -6.000000e+00 1.143825e-03 283.29 -2.00 20.00 -2.00 318.18 0.00e+00 2.888 0.000 302.00 328.00 3 1.1529e+00 9.3428e-04 3.7229e-02 -6.0000e+00 6.5085e-02 4.6457e-02 1.0742e-03 2.3336e-02 -6.0000e+00 7.0215e-02 -4.1961e-02 7.7070e-04 1.1695e-02 -6.0000e+00 4.1740e-02 8.1602e-03 4.0234e-04 3.9321e-03 -6.0000e+00 1.7520e-02 5.3266e-03 -3.7865e-05 1.9028e-05 4.0773e-05 -6.0000e+00 1.2637e-03 -3.7366e-02 0.0000e+00 12 8 8 10 0 0 2.00 22.20 0.31 -0.03737 -0.03765 309 309 1 5 0 97.030 26.32 20.00 22.20 25.51 0.0 946.35 -12796 -13108 -10853 -15140 -11125 -14248 -14805 -15508 -14722 -13403 -13158 -10278 -9124 -6072 -3005 -1466 -100 -9 -493 787 241 465 2256 237 -1021 -2985 -4615 -3871 -2342 656 788 179 579 -3337 -2911 -469 400 471 -420 -1770 -2800 -1964 -1558 -1195 -296 54 0 311 830 1824 2847 1825 1969 1665 939 1334 322 -371 -34 1202 2209 2539 1974 596 -1032 -261 1419 2277 3221 1065 -456 -950 -1166 -1024 -1136 -335 549 893 1518 68 -969 -1456 -2060 -1153 -314 -599 -505 -580 -367 -511 48 617 1374 2158 1990 694 557 175 -1376 -1941 -1385 -336 1367 1469 -1001 -1927 -1167 -619 479 469 -41 -629 -369 130 888 1901 2110 1509 755 -736 -874 -548 123 -43 76 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