File name: Pandora55s1_QueensNY_20240217_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T131936.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c18p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v18d20230426.txt Level 1 file used: Pandora55s1_QueensNY_20240217_L1_smca1c18d20230426p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20240217 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: Based on session 17 for new VP from 20230426 First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0111 305.1511 305.2911 305.4311 305.5710 305.7110 305.8510 305.9909 306.1308 306.2708 306.4107 306.5506 306.6905 306.8303 306.9702 307.1101 307.2499 307.3897 307.5296 307.6694 307.8092 307.9490 308.0888 308.2286 308.3683 308.5081 308.6478 308.7876 308.9273 309.0670 309.2067 309.3464 309.4861 309.6257 309.7654 309.9050 310.0447 310.1843 310.3239 310.4635 310.6031 310.7427 310.8823 311.0219 311.1614 311.3010 311.4405 311.5800 311.7195 311.8590 311.9985 312.1380 312.2775 312.4169 312.5564 312.6958 312.8352 312.9747 313.1141 313.2535 313.3929 313.5322 313.6716 313.8110 313.9503 314.0896 314.2290 314.3683 314.5076 314.6469 314.7861 314.9254 315.0647 315.2039 315.3432 315.4824 315.6216 315.7608 315.9000 316.0392 316.1784 316.3175 316.4567 316.5958 316.7350 316.8741 317.0132 317.1523 317.2914 317.4305 317.5695 317.7086 317.8476 317.9867 318.1257 318.2647 318.4037 318.5427 318.6817 318.8207 318.9596 319.0986 319.2375 319.3765 319.5154 319.6543 319.7932 319.9321 320.0710 320.2098 320.3487 320.4875 320.6264 320.7652 320.9040 321.0428 321.1816 321.3204 321.4592 321.5979 321.7367 321.8754 322.0141 322.1529 322.2916 322.4303 322.5689 322.7076 322.8463 322.9849 323.1236 323.2622 323.4008 323.5394 323.6780 323.8166 323.9552 324.0938 324.2323 324.3709 324.5094 324.6479 324.7864 324.9249 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20240217T174425.6Z 8813.739185 301 1 2.71 2 53.34 190.73 74.36 69.09 0.00 1 0.00 1 0 25 1.094e-02 6.578e-03 4.274e-03 1.570e-03 3.343620e-01 8.122456e-04 4.061635e-03 -6.000000e+00 6.416366e-03 225.00 -2.00 3.51 -2.00 316.83 0.00e+00 1.315261e-04 1.036269e-04 8.674541e-05 -6.000000e+00 2.786068e-04 275.46 -2.00 20.00 -2.00 316.26 0.00e+00 1.670 0.000 302.00 328.00 3 1.8725e+00 2.1116e-03 2.3875e-02 -6.0000e+00 1.5864e-02 3.7358e-02 2.3646e-03 1.6874e-02 -6.0000e+00 1.7247e-02 -1.6157e-02 1.3995e-03 8.4197e-03 -6.0000e+00 1.0261e-02 2.6949e-03 6.7295e-04 2.4007e-03 -6.0000e+00 4.3046e-03 9.6463e-03 -4.1832e-04 4.7472e-05 3.1591e-05 -6.0000e+00 3.2604e-04 6.2518e-03 0.0000e+00 12 9 1 12 1 1 98.51 22.58 0.24 0.00625 0.00311 17 64 1 5 0 150.350 25.90 20.00 22.58 8.27 35.1 1043.72 -4501 -2425 -2974 -5850 -2701 -1201 -1874 1678 81 -1269 -1248 -609 578 -673 709 -1420 -269 -729 428 918 -666 582 1382 1083 -91 744 -1157 -786 -822 1778 1019 1713 1344 -741 -743 56 429 331 476 -457 -578 -889 -710 -1003 -724 -528 -686 -211 -940 683 1292 642 782 836 223 826 845 155 760 983 1335 1428 1332 87 -671 97 110 336 1411 1021 45 -217 -915 -795 -942 -108 200 804 838 421 109 -780 -1166 -1602 -1158 -1229 -922 -635 -561 -692 -77 279 680 1455 1337 1349 891 784 -397 -419 -616 -566 123 884 -142 -906 -482 -707 -89 -82 87 -467 -99 -181 164 588 843 790 461 -10 -638 -172 -259 -314 98 309 499 1574 959 506 312 -67 339 250 96 -400 -77 84 -268 -460 -292 -413 -123 -38 -528 -314 -407 -804 -360 -148 -237 226 12 -196 -198 -99 102 -139 156 -361 -68 -196 119 265 -200 175 416 340 -31 247 -397 -261 -276 566 336 573 496 -296 -295 21 167 137 221 -240 -326 -543 -430 -623 -450 -327 -424 -135 -597 427 831 423 527 598 168 612 641 119 575 730 991 1105 1069 74 -599 85 94 272 1143 869 41 -207 -906 -776 -909 -99 172 662 678 352 99 -770 -1178 -1737 -1275 -1394 -1074 -773 -698 -853 -91 313 749 1540 1408 1461 1037 951 -518 -557 -812 -719 148 1040 -173 -1146 -623 -930 -122 -115 128 -704 -147 -270 235 801 1117 1040 632 -15 -931 -254 -379 -458 137 423 669 2068 1235 675 436 -96 505 371 149 -640 -125 137 -447 -770 -478 -668 -194 -58 SS 20240217T182230.6Z 8813.765631 329 1 7.10 2 55.36 201.93 67.69 74.24 0.00 1 0.00 1 0 25 2.151e-02 7.258e-03 1.017e-02 2.979e-03 3.524699e-01 1.534137e-03 4.249744e-03 -6.000000e+00 1.261960e-02 225.00 -2.00 3.51 -2.00 317.24 0.00e+00 -2.950084e-04 2.184009e-04 1.251135e-04 -6.000000e+00 5.480517e-04 275.46 -2.00 20.00 -2.00 316.65 0.00e+00 1.754 0.000 302.00 328.00 3 3.8292e+00 4.0163e-03 2.5111e-02 -6.0000e+00 3.1202e-02 3.7427e-02 4.5146e-03 1.7777e-02 -6.0000e+00 3.3923e-02 -8.4162e-03 2.7401e-03 8.8780e-03 -6.0000e+00 2.0183e-02 -1.9879e-04 1.3518e-03 2.5277e-03 -6.0000e+00 8.4646e-03 1.2199e-03 -3.0813e-04 8.9831e-05 3.2025e-05 -6.0000e+00 6.4142e-04 7.6928e-03 0.0000e+00 12 9 1 12 1 1 93.49 22.58 0.26 0.00769 0.00538 5 8 1 5 0 1181.590 25.90 20.03 22.58 8.47 35.1 1043.18 -7814 -9018 914 -12407 -229 -3693 -4331 5743 -2118 -3441 -3572 -3916 -2297 -3459 3237 -2779 -2338 8654 2344 3207 2606 -265 505 -207 168 -1050 1460 -235 -741 -686 784 1771 -686 -2215 461 1850 383 -705 1915 -302 -1050 -983 -1328 -1384 -87 -848 -1674 -117 -263 989 -409 40 24 2107 516 578 1487 -135 1692 1301 1965 2206 1125 407 -1086 -478 304 706 886 527 -486 -362 -620 -271 -696 -303 223 1658 790 -165 -475 -397 -1435 -1149 -1497 -1038 -1057 -845 -621 -803 250 149 770 1406 1236 1047 786 1003 -281 -272 -292 -611 23 724 -133 -205 -426 -977 224 163 -22 -270 -192 -387 -42 623 716 751 527 -557 -478 -28 -383 -163 57 111 259 1346 932 26 370 340 269 395 466 -388 33 -84 -289 -544 -419 -305 -296 268 -723 -945 92 -1377 -21 -338 -408 544 -240 -421 -451 -513 -325 -562 567 -570 -512 1813 539 758 634 -67 128 -55 47 -308 427 -68 -208 -188 219 528 -225 -768 157 609 130 -265 804 -146 -557 -550 -767 -811 -51 -498 -985 -67 -151 568 -243 25 16 1414 362 414 1082 -100 1228 937 1413 1626 880 336 -934 -407 249 559 708 447 -442 -344 -600 -261 -650 -269 186 1305 622 -136 -424 -380 -1464 -1219 -1645 -1179 -1244 -1022 -760 -979 295 170 830 1455 1279 1130 902 1226 -365 -364 -387 -784 28 857 -161 -257 -553 -1304 306 229 -32 -409 -293 -584 -61 871 972 1016 729 -801 -707 -42 -567 -237 82 153 350 1763 1231 36 530 503 406 606 732 -629 54 -143 -494 -933 -709 -505 -478 426 SS 20240217T190437.5Z 8813.794879 351 1 40.49 2 59.06 213.37 60.11 79.93 0.00 1 0.00 1 0 25 1.823e-02 6.259e-03 3.640e-03 8.000e-04 3.876576e-01 4.119328e-04 4.650797e-03 -6.000000e+00 1.069615e-02 225.01 -2.00 3.51 -2.00 317.71 0.00e+00 1.287442e-04 6.667795e-05 1.436741e-04 -6.000000e+00 4.644045e-04 275.46 -2.00 20.00 -2.00 317.12 0.00e+00 1.937 0.000 302.00 328.00 3 2.8642e+00 1.0879e-03 2.7699e-02 -6.0000e+00 2.6446e-02 4.2666e-02 1.2265e-03 1.9610e-02 -6.0000e+00 2.8750e-02 -1.1529e-02 7.7454e-04 9.7872e-03 -6.0000e+00 1.7105e-02 -5.6922e-04 3.9344e-04 2.7999e-03 -6.0000e+00 7.1765e-03 2.5378e-03 -2.9292e-04 2.4112e-05 3.4720e-05 -6.0000e+00 5.4343e-04 5.5783e-03 0.0000e+00 12 1 1 12 1 1 99.97 22.57 0.19 0.00558 0.00338 118 28 1 5 0 340.170 25.90 19.99 22.57 7.19 35.1 1037.07 -7802 -9512 1171 -10433 -6132 -1973 -3984 1156 -2547 -2647 -4913 -1447 -2171 -1424 2914 -761 -1661 -35 1963 1825 666 1335 1042 -538 361 -74 797 -998 -498 -489 900 1542 564 -1969 -972 844 -367 -472 583 -501 -1521 -798 -1347 -1121 -716 138 -1006 -300 -254 665 569 630 677 1285 801 733 871 420 875 840 1426 1453 1565 144 -380 -148 153 386 1315 895 27 -284 -564 -729 -569 -203 593 838 1103 245 -176 -467 -1491 -1294 -1200 -1249 -919 -628 -406 -553 -101 271 524 1395 1330 1177 975 769 -268 -553 -505 -470 20 729 -77 -787 -468 -876 -94 25 -150 -358 -150 -69 -79 629 765 901 588 -88 -695 -372 -258 -159 173 172 457 1409 849 333 466 54 286 108 251 -306 -185 76 -325 -446 -233 -260 -157 54 -505 -707 84 -815 -432 -128 -269 82 -209 -233 -457 -136 -228 -172 390 -119 -282 -6 359 348 132 265 211 -115 81 -18 190 -238 -114 -110 208 385 155 -584 -286 240 -108 -153 215 -212 -714 -396 -693 -587 -375 73 -529 -156 -132 348 307 358 406 802 522 489 595 289 597 566 960 1008 1145 113 -308 -120 120 293 1004 728 24 -261 -529 -679 -512 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