File name: Pandora55s1_QueensNY_20230912_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T122139.2Z 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_20230912_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: 20230912 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 20230912T142125.3Z 8655.598210 245 1 50.63 2 49.75 127.20 25.71 148.30 0.00 1 0.00 1 0 17 9.326e-03 6.402e-03 1.525e-03 8.745e-04 1.975533e-01 4.614300e-04 2.410798e-03 -6.000000e+00 5.570107e-03 229.50 -2.00 3.51 -2.00 315.65 0.00e+00 -6.886375e-05 4.624368e-05 3.935161e-05 -6.000000e+00 2.504802e-04 288.20 -2.00 20.00 -2.00 314.92 0.00e+00 1.545 0.000 302.00 328.00 3 3.8697e+00 1.1938e-03 1.8537e-02 -6.0000e+00 1.3857e-02 2.6128e-02 1.3275e-03 1.0264e-02 -6.0000e+00 1.4978e-02 5.8105e-03 7.5935e-04 5.0103e-03 -6.0000e+00 8.9493e-03 -5.0642e-03 3.3942e-04 1.3860e-03 -6.0000e+00 3.7708e-03 1.9010e-03 -3.5952e-04 2.6876e-05 1.9616e-05 -6.0000e+00 2.7840e-04 7.2009e-04 0.0000e+00 11 8 0 10 0 0 99.98 19.27 0.17 0.00072 -0.00198 131 25 1 5 0 386.380 26.00 20.00 19.27 29.02 36.4 1066.49 -1789 -2301 -746 -4410 -2008 566 181 3249 1338 -561 -539 958 584 -730 1556 -387 -1074 -27 1485 1049 499 814 1108 20 658 18 326 -623 -132 853 1374 2001 1284 -1286 -699 817 -60 245 604 -488 -1482 -939 -1592 -1274 -873 -660 -1241 -726 -626 222 799 377 236 1019 774 572 1074 516 755 808 1487 1601 1102 215 -535 -435 121 190 1110 949 23 -186 -497 -476 -536 -205 280 751 1168 139 -251 -488 -1330 -1200 -1059 -921 -677 -363 -448 -584 -237 60 130 1124 1392 1050 754 683 -239 -492 -517 -502 150 981 282 -610 -269 -711 -161 113 17 -334 -232 -146 -206 404 729 813 683 -125 -793 -412 -170 -91 162 201 398 1322 908 267 446 35 294 167 339 -228 -53 90 -358 -487 -242 -273 -203 -59 -430 -601 -198 -1171 -485 126 41 763 350 -157 -152 268 172 -237 544 -148 -429 -11 608 443 215 353 480 9 304 9 157 -295 -59 366 585 880 597 -628 -337 377 -28 125 347 -317 -1048 -694 -1211 -979 -669 -505 -942 -540 -455 159 573 280 183 811 633 477 907 439 639 679 1248 1378 995 204 -521 -416 110 164 947 850 22 -188 -514 -492 -540 -197 252 634 959 118 -229 -477 -1376 -1291 -1175 -1063 -812 -448 -564 -734 -290 70 144 1173 1424 1107 840 809 -300 -635 -663 -622 177 1128 333 -753 -343 -935 -217 155 24 -488 -339 -209 -283 527 917 1015 874 -167 -1103 -583 -241 -126 221 265 509 1637 1123 340 589 48 405 232 480 -334 -80 138 -557 -764 -376 -418 -304 -88 SS 20230912T143201.1Z 8655.605568 248 1 50.01 2 48.19 130.03 24.78 153.68 0.00 1 0.00 1 0 17 1.398e-02 7.661e-03 2.387e-03 1.432e-03 1.917466e-01 7.570560e-04 2.332989e-03 -6.000000e+00 8.347990e-03 229.50 -2.00 3.51 -2.00 315.47 0.00e+00 1.324662e-04 7.315106e-05 3.439707e-05 -6.000000e+00 3.753989e-04 288.20 -2.00 20.00 -2.00 314.75 0.00e+00 1.497 0.000 302.00 328.00 3 4.8756e+00 1.9543e-03 1.7962e-02 -6.0000e+00 2.0768e-02 3.3606e-02 2.1711e-03 9.9385e-03 -6.0000e+00 2.2448e-02 3.8101e-03 1.2410e-03 4.8511e-03 -6.0000e+00 1.3412e-02 -2.5491e-03 5.5112e-04 1.3499e-03 -6.0000e+00 5.6513e-03 7.3368e-04 -3.3907e-04 4.3931e-05 1.9141e-05 -6.0000e+00 4.1725e-04 7.5065e-04 0.0000e+00 12 9 1 12 1 1 99.99 19.30 0.23 0.00075 -0.00180 30 6 1 5 0 1612.980 26.00 20.00 19.30 29.67 36.2 1069.70 -2508 -2363 4331 -5361 -253 2560 -247 5529 2360 -383 -1899 -268 -47 -4057 3432 -289 -1308 -6074 2986 1432 1891 642 1296 -40 354 21 2047 -999 -110 49 1004 2631 736 -2192 -796 1984 -1037 -354 810 115 -1611 -392 -1654 -1561 -629 -77 -1750 0 -666 754 258 259 -148 1435 859 898 1628 326 1067 956 1319 1500 1230 -96 -64 -455 452 -129 1076 883 -570 -211 -290 -658 -15 -477 100 1131 368 -456 -702 -189 -1089 -838 -1265 -920 -1117 -363 -573 -453 -262 94 355 1114 1109 1091 507 681 -193 -415 -385 -409 -474 870 106 -497 -373 -763 21 347 356 -429 -121 -437 -244 483 527 920 745 255 -740 -310 -7 -278 195 49 268 1182 962 118 619 240 301 427 296 -221 49 0 -405 -677 -104 -376 -301 -77 -656 -665 1186 -1545 -65 600 -60 1366 654 -114 -578 -80 -15 -1428 1247 -116 -551 -2714 1273 631 846 292 587 -19 171 11 1013 -494 -51 22 445 1194 356 -1115 -397 938 -509 -187 479 77 -1169 -296 -1288 -1227 -492 -60 -1361 0 -495 549 189 196 -117 1160 714 757 1390 281 913 813 1124 1311 1123 -93 -63 -439 412 -113 928 798 -554 -215 -302 -683 -15 -463 91 960 306 -392 -647 -185 -1132 -900 -1409 -1063 -1345 -449 -721 -569 -321 110 392 1164 1138 1152 566 805 -241 -534 -491 -504 -560 1000 125 -611 -476 -1000 28 475 503 -622 -175 -622 -333 625 657 1141 944 337 -1021 -435 -10 -385 263 64 341 1454 1181 149 807 322 409 586 414 -320 73 0 -624 -1048 -159 -569 -446 -113 SS 20230912T144044.4Z 8655.611625 251 1 10.86 2 46.95 132.45 24.14 158.36 0.00 1 0.00 1 0 25 8.739e-03 6.871e-03 9.187e-04 6.208e-04 1.872202e-01 3.295238e-04 2.296556e-03 -6.000000e+00 5.219867e-03 229.50 -2.00 3.51 -2.00 314.99 0.00e+00 5.944510e-05 2.897802e-05 3.892670e-05 -6.000000e+00 2.347319e-04 288.20 -2.00 20.00 -2.00 314.31 0.00e+00 1.462 0.000 302.00 328.00 3 1.8944e+00 8.4606e-04 1.7550e-02 -6.0000e+00 1.2986e-02 1.7897e-02 9.3792e-04 9.7145e-03 -6.0000e+00 1.4036e-02 1.1337e-03 5.3641e-04 4.7487e-03 -6.0000e+00 8.3866e-03 -2.3856e-03 2.3410e-04 1.3209e-03 -6.0000e+00 3.5336e-03 1.5224e-02 -3.8807e-04 1.8945e-05 1.9511e-05 -6.0000e+00 2.6090e-04 7.8637e-04 0.0000e+00 12 9 1 12 1 1 99.97 19.28 0.18 0.00079 -0.00213 94 84 1 5 0 114.240 26.00 19.98 19.28 30.60 36.2 1076.10 -792 -1786 -2416 -3587 -1095 -294 1345 1072 1209 -816 -217 928 1370 496 439 -279 -641 340 492 724 155 1024 1189 1071 545 55 -607 -868 396 1266 1478 1599 1673 -1246 -794 197 427 650 506 -542 -1343 -950 -1311 -1165 -1015 -855 -1235 -746 -843 437 834 541 696 648 463 473 860 296 644 790 1407 1288 1018 407 -794 -287 -182 565 1289 1111 118 -374 -714 -420 -681 -152 103 448 1370 383 151 -748 -1402 -1272 -980 -982 -722 -554 -476 -611 -181 188 284 1311 1455 1338 899 778 -358 -590 -362 -425 133 921 187 -821 -255 -870 -92 -134 -54 -396 -334 -193 -116 509 869 883 678 40 -598 -481 -220 -303 237 224 583 1450 1139 397 447 -98 227 100 266 -326 -210 47 -421 -442 -275 -206 -323 98 -254 -594 -832 -1202 -348 -86 385 335 419 -288 -77 324 500 202 189 -132 -302 163 242 365 80 529 614 568 289 31 -341 -471 210 629 726 821 913 -688 -429 107 235 376 328 -378 -1012 -763 -1049 -945 -823 -689 -985 -600 -656 328 629 429 558 545 404 405 746 260 560 678 1207 1151 938 388 -788 -275 -167 496 1156 1028 117 -388 -742 -432 -701 -150 95 392 1187 335 141 -749 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