File name: Pandora107s1_LynnMA_20240518_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T083955.4Z 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_20240518_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: 20240518 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 20240518T130143.2Z 8904.542861 267 1 30.13 2 50.99 98.78 137.53 359.19 0.00 1 0.00 1 0 25 1.936e-02 9.827e-03 1.188e-02 3.722e-03 2.626699e-01 1.966508e-03 3.157864e-03 -6.000000e+00 1.170383e-02 231.27 -2.00 3.54 -2.00 317.46 0.00e+00 1.052085e-03 2.940871e-04 2.019471e-04 -6.000000e+00 5.159115e-04 282.79 -2.00 20.00 -2.00 316.73 0.00e+00 1.585 0.000 302.00 328.00 3 5.5513e+00 5.2301e-03 2.1150e-02 -6.0000e+00 2.9314e-02 6.6785e-02 5.8609e-03 1.3786e-02 -6.0000e+00 3.1652e-02 -1.7512e-02 3.5194e-03 6.7510e-03 -6.0000e+00 1.8795e-02 8.0179e-04 1.7172e-03 1.9948e-03 -6.0000e+00 7.9342e-03 2.9586e-04 2.9255e-04 1.1506e-04 2.2552e-05 -6.0000e+00 5.7333e-04 -3.8770e-02 0.0000e+00 12 8 8 10 0 0 99.99 21.87 0.24 -0.03877 -0.03657 45 45 1 5 0 669.350 26.00 20.00 21.87 22.36 0.0 934.09 900000 -6915 -8384 -5294 -1532 298 -4396 1799 208 -6660 -1125 1215 -84 2627 -1399 -4643 -3266 3408 1140 2859 2127 355 3468 1421 3179 877 -2526 -1618 -25 614 -2611 5365 -1937 -2030 -1281 944 936 442 857 -1346 -3428 -1814 -825 -932 -689 328 -408 270 -279 1586 2560 924 1544 531 709 1314 283 230 810 2154 2113 2733 883 122 -1412 -1745 1169 1813 3460 617 -467 -921 -873 -340 -1621 -935 413 433 2200 556 -1219 -1802 -2499 -668 92 -159 -27 -250 -312 -205 -295 538 577 2089 1178 1200 685 -190 -1231 -1958 -1074 -545 862 1476 -1136 -1484 -1322 -852 509 414 128 -500 -220 -125 941 1725 1449 1511 672 5 -573 -462 585 410 433 -145 881 1691 770 153 -1166 -797 76 285 234 -399 127 7 -382 -386 -195 -281 104 900000 -817 -1047 -626 -164 29 -446 188 25 -893 -145 157 -12 406 -257 -969 -716 730 258 661 508 87 828 354 827 244 -722 -443 -6 153 -676 1389 -584 -630 -390 274 277 149 340 -623 -1780 -988 -461 -528 -391 185 -230 148 -151 842 1384 537 945 343 469 887 197 160 556 1450 1436 1948 683 100 -1198 -1445 881 1292 2514 501 -415 -863 -828 -314 -1449 -772 309 303 1530 423 -1044 -1690 -2509 -694 100 -181 -32 -312 -392 -251 -349 591 584 1998 1159 1264 788 -237 -1643 -2675 -1414 -666 988 1698 -1394 -1928 -1790 -1183 728 620 200 -801 -348 -190 1326 2293 1887 2006 943 8 -880 -711 873 596 609 -197 1140 2141 1010 214 -1733 -1208 116 446 382 -679 221 13 -686 -690 -340 -474 172 SS 20240518T143536.8Z 8904.608065 316 1 29.95 2 34.72 121.14 133.47 31.16 0.00 1 0.00 1 0 17 1.388e-02 1.044e-02 1.837e-03 9.941e-04 1.987621e-01 5.278452e-04 2.414140e-03 -6.000000e+00 8.393366e-03 231.28 -2.00 3.54 -2.00 315.94 0.00e+00 2.040823e-04 5.500728e-05 5.600429e-05 -6.000000e+00 3.699542e-04 282.80 -2.00 20.00 -2.00 315.25 0.00e+00 1.216 0.000 302.00 328.00 3 3.8642e+00 1.3742e-03 1.6106e-02 -6.0000e+00 2.1023e-02 4.8502e-02 1.5264e-03 1.0399e-02 -6.0000e+00 2.2698e-02 -1.2880e-02 8.7803e-04 5.0662e-03 -6.0000e+00 1.3478e-02 3.6474e-04 3.9816e-04 1.3965e-03 -6.0000e+00 5.6906e-03 2.6165e-03 2.5222e-04 3.0216e-05 1.8176e-05 -6.0000e+00 4.1110e-04 -3.9459e-02 0.0000e+00 12 9 8 11 8 0 99.99 22.18 0.38 -0.03946 -0.03756 177 177 1 5 0 169.140 26.32 20.00 22.18 23.34 0.0 938.27 900000 -2919 -3850 -4863 -1509 843 1551 1367 -718 -2588 -2238 1322 2074 713 -123 -1032 -852 1048 793 1671 243 1175 2282 2188 1101 -291 -1591 -1449 772 1965 2448 1719 436 -2904 -2665 456 1388 1368 605 -1537 -2109 -1449 -951 -1145 -454 -437 -922 -330 -178 1305 1976 1247 1028 1033 402 1044 754 330 1110 1797 1934 2101 1121 -337 -1907 -1405 763 1453 3119 756 -948 -1244 -1120 -613 -985 -489 258 1430 1941 271 -923 -1729 -2175 -1210 -379 -454 -439 -568 -435 -663 -213 299 1315 2507 2238 875 551 121 -1336 -1930 -1323 -332 1133 1552 -764 -1643 -854 -542 542 502 41 -669 -274 22 891 1790 2058 1503 1005 -184 -716 -589 9 -159 300 -48 853 1927 916 -243 -723 -771 19 358 190 -412 -175 -59 -459 -540 -281 -280 407 900000 -670 -918 -1123 -344 172 309 299 -180 -697 -601 345 563 199 -39 -359 -310 385 299 644 97 469 897 877 472 -132 -726 -631 311 743 911 680 188 -1324 -1187 190 583 653 347 -954 -1454 -1058 -712 -866 -341 -327 -680 -235 -122 869 1330 889 781 819 329 869 639 282 928 1477 1609 1834 978 -315 -1839 -1289 678 1196 2596 709 -918 -1278 -1165 -623 -953 -468 220 1109 1490 228 -878 -1686 -2285 -1329 -436 -518 -536 -722 -556 -830 -252 347 1361 2406 2182 930 645 144 -1729 -2569 -1674 -411 1305 1798 -959 -2064 -1120 -735 759 741 59 -995 -397 31 1175 2338 2604 1956 1297 -257 -1050 -869 13 -220 394 -60 1080 2351 1165 -310 -977 -1065 27 512 285 -611 -269 -93 -729 -855 -433 -413 623 SS 20240518T173457.0Z 8904.732604 416 1 30.04 2 25.45 211.09 108.68 73.59 0.00 1 0.00 1 0 25 1.386e-02 1.100e-02 7.411e-04 4.745e-04 1.833852e-01 2.554467e-04 2.237118e-03 -6.000000e+00 8.381825e-03 231.29 -2.00 3.54 -2.00 315.24 0.00e+00 1.056493e-04 2.283137e-05 2.961911e-05 -6.000000e+00 3.694944e-04 282.81 -2.00 20.00 -2.00 314.60 0.00e+00 1.107 0.000 302.00 328.00 3 2.7374e+00 6.6061e-04 1.4752e-02 -6.0000e+00 2.0994e-02 4.2895e-02 7.3023e-04 9.5782e-03 -6.0000e+00 2.2668e-02 -1.1180e-02 4.1789e-04 4.6738e-03 -6.0000e+00 1.3460e-02 4.6601e-04 1.8456e-04 1.2926e-03 -6.0000e+00 5.6821e-03 9.2817e-03 2.7635e-04 1.4398e-05 1.7837e-05 -6.0000e+00 4.1058e-04 -3.8669e-02 0.0000e+00 12 9 8 11 8 0 99.72 22.01 0.34 -0.03867 -0.03659 334 334 1 5 0 89.920 26.21 20.01 22.01 21.39 0.0 931.12 900000 -2613 -3281 -4517 -1379 1529 1808 1820 -760 -2278 -1868 1615 1879 754 299 -1255 -475 992 952 1455 309 1092 2494 1988 1218 -23 -1393 -1302 1090 2178 2690 1415 576 -3046 -2633 774 1194 1414 313 -1788 -2128 -1445 -978 -1167 -305 -695 -943 -330 -163 1413 1907 1119 1007 775 521 1156 783 369 866 1514 2168 2180 848 -231 -2078 -1321 552 1643 3140 700 -928 -1318 -1147 -878 -1144 -472 271 1237 2067 378 -1063 -1761 -2176 -1114 -269 -605 -563 -579 -431 -600 -303 262 1277 2661 2296 997 587 26 -1437 -1994 -1332 -356 1300 1507 -735 -1522 -893 -570 390 501 40 -611 -310 16 898 1921 2109 1649 1043 -251 -830 -679 -61 -125 391 112 950 2043 1059 -257 -746 -714 91 408 116 -464 -195 -45 -405 -627 -244 -323 371 900000 -826 -1070 -1426 -390 385 447 492 -236 -756 -618 516 626 282 116 -533 -209 442 433 678 148 525 1176 959 625 -12 -758 -676 522 976 1182 663 292 -1630 -1371 375 587 788 194 -1306 -1597 -1146 -795 -957 -248 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