File name: Pandora55s1_QueensNY_20240227_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T132033.5Z 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_20240227_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: 20240227 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 20240227T141219.8Z 8823.591896 324 1 18.04 2 63.60 129.98 105.20 276.84 0.00 1 0.00 1 0 25 1.816e-02 6.118e-03 4.263e-03 7.603e-04 4.142855e-01 3.918254e-04 4.944451e-03 -6.000000e+00 1.067030e-02 225.46 -2.00 3.51 -2.00 318.08 0.00e+00 3.380018e-04 7.019376e-05 1.678725e-04 -6.000000e+00 4.637089e-04 276.09 -2.00 20.00 -2.00 317.48 0.00e+00 2.236 0.000 302.00 328.00 3 1.6773e+00 1.0429e-03 3.0809e-02 -6.0000e+00 2.6404e-02 9.2529e-03 1.1796e-03 2.1051e-02 -6.0000e+00 2.8692e-02 -1.6962e-02 7.7199e-04 1.0489e-02 -6.0000e+00 1.7071e-02 1.4886e-03 3.9798e-04 3.0202e-03 -6.0000e+00 7.1590e-03 6.1616e-03 -4.0035e-04 2.2789e-05 3.6423e-05 -6.0000e+00 5.4134e-04 6.2730e-03 0.0000e+00 12 1 1 12 1 1 99.82 22.57 0.19 0.00627 0.00326 125 67 1 5 0 143.100 25.90 19.99 22.57 14.01 35.5 1059.87 -6259 -7462 -921 -8967 -6515 -7317 -4519 -4612 -19 -4745 -3454 -4226 -2776 -1354 707 -495 -1923 -781 -378 167 210 1107 992 511 564 -505 -47 -1693 -522 193 1726 991 1407 -1705 -850 428 -386 135 289 -292 -1658 -686 -1376 -920 -572 -372 -985 -293 -532 882 922 722 991 1075 937 737 949 357 537 842 1388 1330 1345 437 -449 205 254 604 1279 949 41 -191 -693 -587 -581 -247 302 498 1189 33 109 -756 -1549 -1343 -1108 -1125 -866 -424 -429 -530 -15 460 495 1512 1397 1257 828 699 -363 -584 -446 -672 -7 676 -232 -948 -447 -815 -48 -49 -72 -316 -301 -4 27 739 856 818 457 -96 -629 -367 -172 -374 207 63 502 1411 926 350 462 44 294 186 177 -324 -220 211 -458 -418 -247 -189 -163 95 -308 -427 -53 -549 -363 -390 -241 -274 -1 -346 -260 -337 -227 -130 79 -65 -280 -121 -57 26 34 182 166 90 107 -103 -10 -349 -102 37 343 222 351 -440 -218 106 -99 39 94 -113 -701 -312 -626 -428 -268 -175 -466 -138 -251 417 457 387 545 633 583 454 601 230 342 525 863 866 908 326 -342 155 191 437 939 733 34 -172 -619 -516 -505 -206 237 364 859 26 94 -683 -1499 -1394 -1169 -1218 -993 -490 -507 -621 -18 513 510 1513 1410 1319 941 860 -466 -793 -599 -877 -8 814 -278 -1175 -583 -1085 -67 -71 -109 -494 -468 -6 40 1081 1190 1132 660 -142 -955 -564 -258 -562 307 90 702 1884 1260 499 693 69 464 304 293 -554 -384 378 -841 -767 -442 -332 -282 159 SS 20240227T142029.8Z 8823.597567 330 1 50.45 2 62.43 131.82 106.71 278.16 0.00 1 0.00 1 0 25 1.856e-02 5.889e-03 4.282e-03 6.914e-04 3.973969e-01 3.560727e-04 4.738793e-03 -6.000000e+00 1.091084e-02 225.46 -2.00 3.51 -2.00 318.25 0.00e+00 2.896202e-04 6.709848e-05 2.009662e-04 -6.000000e+00 4.741519e-04 276.09 -2.00 20.00 -2.00 317.65 0.00e+00 2.150 0.000 302.00 328.00 3 2.5154e+00 9.5287e-04 2.9608e-02 -6.0000e+00 2.6999e-02 6.0679e-03 1.0810e-03 2.0241e-02 -6.0000e+00 2.9339e-02 -8.0405e-03 7.2176e-04 1.0083e-02 -6.0000e+00 1.7456e-02 -2.5066e-03 3.7426e-04 2.9023e-03 -6.0000e+00 7.3206e-03 2.9630e-03 -3.2824e-04 2.1033e-05 3.5117e-05 -6.0000e+00 5.5352e-04 6.0856e-03 0.0000e+00 10 0 0 10 0 0 99.98 22.56 0.19 0.00609 0.00362 318 60 1 5 0 158.630 25.90 20.00 22.56 15.01 35.7 1066.16 -7281 -7207 -818 -8662 -6488 -1406 -6602 4416 -3467 -3932 -5720 -3614 -3041 -2835 2191 -1491 -543 -2439 2702 139 1054 580 1191 -610 293 -24 529 -921 -1079 588 1014 2522 688 -1328 -982 1362 -552 -26 606 -587 -1488 -1250 -1440 -1482 -761 -285 -992 -635 -424 783 364 776 639 1120 682 755 884 280 597 822 1390 1566 1405 162 -286 -228 358 329 1366 1050 274 -225 -442 -481 -569 -118 485 926 1196 239 -196 -567 -1511 -1230 -1134 -1114 -765 -563 -432 -546 78 340 635 1281 1422 1183 855 731 -327 -424 -477 -535 -22 730 -168 -757 -518 -809 -86 38 -115 -382 -108 -74 58 553 820 722 555 -290 -757 -364 -277 -220 122 110 353 1312 830 344 482 47 272 184 203 -303 -177 158 -400 -406 -185 -203 -162 151 -344 -362 -41 -463 -341 -66 -338 225 -201 -248 -382 -248 -233 -256 223 -181 -67 -328 366 20 157 88 183 -100 51 -4 100 -172 -194 102 184 501 155 -307 -242 319 -136 -7 187 -206 -599 -546 -624 -660 -340 -127 -446 -283 -189 349 170 390 349 616 397 457 549 177 373 503 848 999 927 118 -211 -168 261 231 967 778 229 -194 -394 -422 -475 -94 366 648 830 182 -162 -507 -1442 -1256 -1174 -1229 -858 -662 -518 -649 89 372 667 1261 1404 1262 980 903 -433 -571 -636 -694 -27 850 -201 -936 -677 -1072 -119 54 -171 -605 -168 -117 87 793 1156 1013 812 -437 -1159 -563 -421 -335 178 160 486 1791 1153 496 728 74 441 298 345 -528 -312 288 -742 -755 -335 -365 -277 260 SS 20240227T142543.6Z 8823.601199 333 1 50.47 2 61.70 133.03 107.67 279.02 0.00 1 0.00 1 0 33 1.580e-02 5.951e-03 2.767e-03 5.160e-04 3.878191e-01 2.649830e-04 4.641796e-03 -6.000000e+00 9.288391e-03 225.46 -2.00 3.51 -2.00 318.03 0.00e+00 1.767155e-04 4.693030e-05 1.669263e-04 -6.000000e+00 4.036459e-04 276.09 -2.00 20.00 -2.00 317.43 0.00e+00 2.099 0.000 302.00 328.00 3 2.0363e+00 7.0630e-04 2.8902e-02 -6.0000e+00 2.2984e-02 3.1043e-03 7.9839e-04 1.9729e-02 -6.0000e+00 2.4976e-02 -9.3046e-03 5.1862e-04 9.8152e-03 -6.0000e+00 1.4860e-02 -1.8244e-03 2.6665e-04 2.8041e-03 -6.0000e+00 6.2320e-03 5.1050e-03 -3.1115e-04 1.5638e-05 3.4627e-05 -6.0000e+00 4.7121e-04 6.0979e-03 0.0000e+00 10 0 0 10 0 0 99.96 22.56 0.22 0.00610 0.00376 460 87 1 5 0 109.690 25.90 20.00 22.56 15.56 35.7 1068.80 -5690 -6026 -1567 -7877 -7408 -3593 -5394 905 -2467 -2939 -4598 -1770 -1547 -609 897 -971 -858 288 1387 322 248 510 1520 -144 160 -597 52 -1109 -184 828 1001 1765 951 -1144 -1115 513 -488 77 391 -378 -1383 -1006 -1348 -1168 -643 -501 -851 -430 -344 704 699 518 817 854 857 765 769 326 585 762 1507 1455 1318 394 -442 -2 311 501 1268 1024 276 -319 -490 -665 -584 -23 394 768 1192 206 -67 -628 -1573 -1322 -1137 -1037 -706 -493 -400 -492 12 385 584 1418 1368 1171 857 690 -399 -554 -449 -620 6 670 -169 -841 -407 -763 -143 -21 -23 -390 -213 -42 17 620 878 781 607 -280 -627 -318 -312 -302 77 39 498 1398 899 321 497 53 249 159 146 -299 -78 150 -445 -425 -185 -213 -157 97 -300 -365 -96 -507 -442 -195 -307 54 -171 -222 -367 -144 -141 -60 102 -129 -125 44 222 55 44 90 271 -27 30 -121 11 -224 -35 154 195 378 228 -300 -292 129 -128 23 128 -148 -585 -460 -649 -576 -318 -248 -423 -212 -169 346 338 270 460 514 513 476 492 212 375 480 945 955 892 294 -351 -2 231 357 913 810 233 -278 -441 -591 -517 -19 303 546 885 158 -55 -565 -1505 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