File name: Pandora38s1_BayonneNJ_20241021_L2Fit_fout2c5d20230101p1-8.txt File generation date: 20241022T045200.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 38 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora38_OF_v4d20201028.txt Instrument calibration file used: Pandora38s1_CF_v5d20230101.txt Level 1 file used: Pandora38s1_BayonneNJ_20241021_L1_smca1c5d20230101p1-8.txt Full location name: Bayonne NJDEP (USEPA AQS ID 34-017-0006) Short location name: BayonneNJ Country of location: USA Location latitude [deg]: 40.6703 Location longitude [deg]: -74.1261 Location altitude [m]: 3 Local noon date: 20241021 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: None First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.1040 305.2447 305.3854 305.5261 305.6667 305.8074 305.9480 306.0886 306.2292 306.3698 306.5104 306.6510 306.7916 306.9321 307.0727 307.2132 307.3537 307.4942 307.6347 307.7752 307.9157 308.0561 308.1966 308.3370 308.4775 308.6179 308.7583 308.8987 309.0391 309.1794 309.3198 309.4601 309.6005 309.7408 309.8811 310.0214 310.1617 310.3020 310.4423 310.5825 310.7228 310.8630 311.0032 311.1434 311.2836 311.4238 311.5640 311.7042 311.8443 311.9844 312.1246 312.2647 312.4048 312.5449 312.6850 312.8250 312.9651 313.1052 313.2452 313.3852 313.5252 313.6652 313.8052 313.9452 314.0852 314.2251 314.3651 314.5050 314.6449 314.7848 314.9247 315.0646 315.2045 315.3443 315.4842 315.6240 315.7639 315.9037 316.0435 316.1833 316.3231 316.4628 316.6026 316.7423 316.8821 317.0218 317.1615 317.3012 317.4409 317.5806 317.7202 317.8599 317.9995 318.1391 318.2788 318.4184 318.5580 318.6975 318.8371 318.9767 319.1162 319.2558 319.3953 319.5348 319.6743 319.8138 319.9533 320.0927 320.2322 320.3716 320.5110 320.6505 320.7899 320.9293 321.0686 321.2080 321.3474 321.4867 321.6261 321.7654 321.9047 322.0440 322.1833 322.3226 322.4618 322.6011 322.7403 322.8795 323.0188 323.1580 323.2972 323.4363 323.5755 323.7147 323.8538 323.9930 324.1321 324.2712 324.4103 324.5494 324.6884 324.8275 324.9666 --------------------------------------------------------------------------------------- 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 20241021T120452.8Z 9060.503389 277 1 49.05 2 81.83 112.15 46.50 272.24 0.00 1 0.00 1 0 17 5.827e-01 1.380e-02 3.686e-01 8.289e-03 7.849065e-01 4.792365e-03 8.458011e-03 -6.000000e+00 3.444963e-01 225.39 -2.00 3.51 -2.00 322.07 0.00e+00 2.345347e-03 2.986533e-03 1.113359e-03 -6.000000e+00 1.634810e-02 283.67 -2.00 20.00 -2.00 321.58 0.00e+00 6.591 0.005 302.00 328.00 3 1.2895e+00 1.9583e-02 7.8672e-02 -6.0000e+00 8.4994e-01 2.7436e-01 2.8924e-02 4.5823e-02 -6.0000e+00 9.2563e-01 -4.1144e-01 2.9251e-02 2.3848e-02 -6.0000e+00 5.4902e-01 1.6557e-01 1.3113e-02 8.3726e-03 -6.0000e+00 2.3087e-01 9.9953e-05 -7.0314e-04 2.5147e-04 1.1544e-04 -6.0000e+00 1.7564e-02 -1.0089e-03 3.7611e-05 12 8 8 10 0 0 93.25 21.47 0.35 -0.00101 -0.00629 118 27 1 5 0 415.630 26.62 20.00 21.47 19.48 36.6 1016.71 -112320 -224439 900000 38921 -198079 900000 -280564 900000 -261884 -107698 -167970 -10982 900000 -112620 -82131 -147997 -72259 -62097 112290 -62921 -12578 -28195 -95347 133251 -38427 900000 -78252 33311 -21535 -92849 109201 -36013 26527 -52855 46095 -46056 72706 -11304 -9967 54930 -17437 57591 -15718 47899 -10658 13192 20163 3555 9275 5891 35286 1457 18230 8129 5825 21350 3900 23145 -3758 25046 400 15542 5348 8103 16020 7542 16155 230 13348 5602 6247 2627 743 7548 -4248 2125 -3883 5575 -3513 3417 1337 -3589 2087 -4005 1335 -2204 343 -172 1361 1511 -1701 4270 925 2041 -1344 1551 -287 -1535 370 -1802 -1674 -1149 285 -2983 -1473 -1269 -2343 15 -1214 92 -716 -369 -256 -817 122 143 1110 -622 495 -140 778 707 657 1916 -233 595 159 1431 -135 1234 -422 516 448 -212 -106 -221 305 -72 -206 170 -109 242 -1227 -907 -2307 900000 314 -1600 900000 -5150 900000 -4999 -870 -1480 -89 900000 -1158 -862 -3260 -934 -802 907 -915 -112 -296 -2079 1076 -559 900000 -1770 269 -278 -2775 882 -902 407 -1878 596 -1525 822 -356 -378 1287 -944 1581 -939 1547 -628 629 928 204 539 390 1966 128 1502 808 573 2069 460 2225 -417 2266 48 1808 719 1190 2294 1180 2360 42 2411 1246 1504 677 190 1685 -967 412 -770 1064 -849 923 435 -1405 849 -1852 626 -1134 180 -93 716 761 -832 1872 417 976 -762 1005 -221 -1371 350 -1737 -1507 -928 210 -2289 -1183 -1079 -2147 15 -1339 114 -995 -545 -383 -1199 170 195 1519 -906 751 -219 1182 1032 923 2574 -310 758 201 1921 -210 2159 -832 1086 1005 -513 -273 -599 840 -201 -569 449 -270 561 -2816 SS 20241021T122052.5Z 9060.514497 282 1 48.85 2 79.05 114.96 49.44 274.59 0.00 1 0.00 1 0 17 3.039e-01 8.206e-03 3.306e-01 7.738e-03 6.288744e-01 4.280702e-03 7.048595e-03 -6.000000e+00 1.779142e-01 225.38 -2.00 3.51 -2.00 321.44 0.00e+00 4.373299e-03 2.219208e-03 7.235477e-04 -6.000000e+00 8.063795e-03 283.66 -2.00 20.00 -2.00 320.87 0.00e+00 5.072 0.002 302.00 328.00 3 2.6056e+00 1.5268e-02 6.0512e-02 -6.0000e+00 4.3983e-01 7.2194e-02 2.1256e-02 3.4318e-02 -6.0000e+00 4.7899e-01 -1.1028e-01 2.1259e-02 1.8529e-02 -6.0000e+00 2.8609e-01 4.3354e-02 9.9694e-03 7.7796e-03 -6.0000e+00 1.2069e-01 1.3046e-04 -6.0577e-04 2.4127e-04 9.8130e-05 -6.0000e+00 8.9633e-03 8.6331e-05 3.8201e-05 11 9 0 11 8 0 99.93 21.46 0.30 0.00009 -0.00447 162 37 1 5 0 301.510 26.62 19.99 21.46 19.87 36.6 1018.66 -160630 900000 -126510 -20292 -144115 43646 -86420 -60916 -35143 -126214 -2130 -73067 -64008 30588 -9213 -44939 -6914 900000 -23908 28050 11955 -11068 -25475 -60598 22861 -25798 1708 -63084 -8376 -34750 -4374 18381 -6604 54109 -17312 1826 -10292 -9893 2974 -534 472 -10447 23493 -2709 20481 654 -1067 -2208 -350 8903 12279 8722 -4423 8279 553 -1158 -1086 -1075 376 -3402 10551 -2475 5166 315 1025 253 -852 2203 2235 5781 411 3380 -149 468 1380 1377 1183 -4108 2252 -2749 -1207 -1190 -2694 6 -1249 451 -1361 745 -1079 -1054 255 1270 821 -361 1298 841 1216 427 -590 120 -538 412 -1126 -77 -1220 -969 -1835 -807 196 358 843 -639 100 374 321 246 424 476 -876 -134 -354 345 3 866 -427 464 1855 404 699 -437 -263 -398 3 684 -601 118 21 -90 -232 26 -145 150 33 -1542 900000 -1041 -153 -1285 329 -652 -460 -265 -1385 -16 -661 -676 231 -90 -678 -89 900000 -433 317 162 -192 -538 -1787 345 -662 33 -2120 -183 -1101 -122 485 -254 1184 -757 68 -481 -502 161 -35 34 -910 1531 -236 1447 58 -99 -215 -35 885 1314 1077 -682 1215 93 -205 -196 -192 65 -611 1737 -516 1130 80 268 66 -223 585 661 1871 153 1261 -57 166 443 401 329 -1245 724 -1095 -550 -614 -1537 3 -800 302 -972 533 -781 -732 163 758 479 -223 885 666 1106 442 -659 132 -558 383 -997 -68 -1171 -982 -1990 -932 247 500 1281 -1030 159 572 467 347 603 707 -1393 -218 -573 536 5 1247 -598 621 2408 561 1080 -764 -500 -805 6 1531 -1450 295 53 -234 -600 65 -342 333 71 SS 20241021T122600.1Z 9060.518057 285 1 48.86 2 78.17 115.88 50.37 275.33 0.00 1 0.00 1 0 25 2.679e-01 5.759e-03 8.622e-02 1.873e-03 5.897290e-01 1.017517e-03 6.613506e-03 -6.000000e+00 1.559785e-01 225.38 -2.00 3.51 -2.00 321.08 0.00e+00 1.464642e-03 4.786234e-04 4.822487e-04 -6.000000e+00 7.124800e-03 283.66 -2.00 20.00 -2.00 320.46 0.00e+00 4.726 0.002 302.00 328.00 3 9.7796e-01 3.4307e-03 5.6281e-02 -6.0000e+00 3.8483e-01 2.3316e-02 4.5645e-03 3.1517e-02 -6.0000e+00 4.1853e-01 -2.8052e-02 4.4030e-03 1.6089e-02 -6.0000e+00 2.5005e-01 3.1027e-03 2.1167e-03 5.2441e-03 -6.0000e+00 1.0571e-01 9.7085e-04 -6.1397e-04 5.8231e-05 6.5942e-05 -6.0000e+00 8.0047e-03 -8.5218e-04 -1.0041e-05 10 0 0 10 0 0 98.79 21.46 0.20 -0.00085 -0.00547 428 98 1 5 0 114.140 26.62 19.99 21.46 20.02 36.4 1019.60 -114660 -5558 -127620 900000 -124909 -44539 -95441 -103766 -56273 -105014 -19503 -88427 -16056 -43674 -5198 -27339 -22705 -14046 -30052 -4157 -29319 11466 -12692 -2823 -1346 -12631 852 -24987 2399 -18772 4924 -9222 -1507 -114 -8047 1020 -11640 10432 -7086 3407 -1658 -1160 994 -1265 2629 -2246 6008 -649 2444 2302 2403 4051 -104 4403 -1102 3888 -127 1605 798 341 3024 1042 3682 1084 2516 499 971 1014 738 2028 -289 1094 -417 1010 -136 46 352 -1128 681 -1625 222 -1456 -1263 -1837 -1291 -980 -1016 151 -395 939 294 765 396 631 744 264 1223 206 448 -563 -392 -338 -547 -87 -1378 -544 -798 -310 -33 -42 116 -35 230 71 595 111 769 213 -52 -383 -213 -103 -409 560 -54 471 914 394 378 71 159 -283 177 -236 -121 -79 42 -120 -318 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