File name: Pandora55s1_QueensNY_20240829_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240830T053556.9Z 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_20240829_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: 20240829 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 20240829T131450.1Z 9007.551969 288 1 49.60 2 58.10 106.95 13.70 164.01 0.00 1 0.00 1 0 17 2.879e-02 8.901e-03 4.816e-03 1.893e-03 2.557295e-01 9.952234e-04 3.055154e-03 -6.000000e+00 1.726475e-02 230.58 -2.00 3.51 -2.00 316.73 0.00e+00 -2.615749e-04 1.268965e-04 5.151562e-05 -6.000000e+00 7.764105e-04 289.19 -2.00 20.00 -2.00 315.90 0.00e+00 1.885 0.000 302.00 328.00 3 4.9170e+00 2.6142e-03 2.3101e-02 -6.0000e+00 4.3050e-02 1.9030e-02 2.9226e-03 1.3290e-02 -6.0000e+00 4.6482e-02 2.2981e-03 1.6993e-03 6.4554e-03 -6.0000e+00 2.7766e-02 -1.9562e-03 8.0065e-04 1.7818e-03 -6.0000e+00 1.1688e-02 4.3047e-04 -3.9581e-04 5.8235e-05 2.2965e-05 -6.0000e+00 8.5957e-04 -6.7190e-04 0.0000e+00 11 9 0 11 32 0 99.29 22.56 0.24 -0.00067 -0.00365 20 4 1 5 0 2479.450 26.21 20.00 22.56 29.87 38.2 1075.56 -6315 -4155 17468 -9629 493 3528 -1917 15578 2066 -777 -4503 -1458 -3501 -331 9865 -56 -3376 -9064 7237 3583 -1606 1922 1117 -2391 110 -205 922 -2041 -1129 -802 807 2807 310 -970 -1533 -1442 -1736 -2273 1564 -298 -1752 340 -2086 -1051 -570 1728 -1965 799 -350 1116 661 -108 -555 2382 1454 799 2364 856 1287 435 1168 2107 809 -638 -17 -1331 1072 -462 1049 1608 354 -27 20 -944 631 -647 139 1647 276 -510 -1336 -87 -1535 -1148 -1716 -938 -1355 -338 -503 -511 18 -250 258 1074 718 942 189 589 -308 -543 -394 -548 109 1148 502 -724 -234 -897 55 760 256 -919 262 -122 -481 11 776 1066 718 -136 -692 185 236 264 -65 253 -230 891 519 161 746 99 345 100 526 -121 243 -59 -345 -736 -493 -29 -463 102 -910 -648 2336 -1600 70 456 -263 1989 331 -136 -831 -265 -690 -71 2162 -15 -958 -2796 2009 1061 -507 597 351 -798 38 -74 331 -733 -384 -263 262 947 114 -375 -592 -541 -665 -956 730 -160 -1042 210 -1353 -688 -373 1111 -1288 505 -220 689 416 -71 -385 1681 1069 602 1797 661 986 333 894 1645 670 -560 -15 -1194 904 -377 846 1361 324 -27 20 -937 604 -595 119 1317 218 -420 -1192 -82 -1563 -1216 -1891 -1070 -1619 -414 -627 -636 22 -290 282 1113 737 999 214 708 -394 -717 -517 -694 132 1341 601 -909 -304 -1202 75 1068 374 -1392 397 -181 -690 15 1020 1392 961 -190 -1006 272 345 382 -93 347 -307 1152 672 215 1035 141 504 148 795 -189 391 -97 -573 -1233 -818 -47 -738 160 SS 20240829T131939.4Z 9007.555317 291 1 50.90 2 57.22 107.92 13.49 168.37 0.00 1 0.00 1 0 25 1.129e-02 6.581e-03 1.830e-03 8.715e-04 2.499829e-01 4.601085e-04 3.030037e-03 -6.000000e+00 6.770507e-03 230.58 -2.00 3.51 -2.00 316.25 0.00e+00 -7.539193e-05 5.247680e-05 6.072261e-05 -6.000000e+00 3.044690e-04 289.19 -2.00 20.00 -2.00 315.45 0.00e+00 1.841 0.000 302.00 328.00 3 3.5834e+00 1.2007e-03 2.2597e-02 -6.0000e+00 1.6882e-02 1.1748e-02 1.3382e-03 1.3039e-02 -6.0000e+00 1.8228e-02 1.9457e-03 7.6943e-04 6.3443e-03 -6.0000e+00 1.0888e-02 -2.9197e-03 3.5333e-04 1.7421e-03 -6.0000e+00 4.5839e-03 1.7283e-03 -3.9482e-04 2.6674e-05 2.3681e-05 -6.0000e+00 3.3707e-04 -1.0358e-03 0.0000e+00 11 8 0 10 0 0 99.77 22.56 0.23 -0.00104 -0.00400 58 11 1 5 0 877.430 26.21 20.01 22.56 29.94 38.2 1076.29 -2251 -4739 809 -5301 -2820 146 -866 4735 965 -636 -1905 -151 -532 605 1653 -682 -1295 327 2189 1232 -83 519 1814 -72 657 3 896 -819 -3 864 1080 1690 1103 -1189 -1310 1597 -395 -484 604 -584 -1398 -680 -1424 -1277 -1050 -475 -1204 -532 -422 467 704 274 289 1067 1051 579 1089 480 865 610 1374 1595 1113 182 -537 -508 289 159 1343 965 231 -239 -340 -679 -470 -391 176 828 1163 237 -439 -548 -1559 -1153 -1055 -902 -722 -542 -632 -496 -163 75 357 1279 1468 1065 806 652 -326 -565 -406 -536 -75 931 233 -694 -441 -717 -92 228 -57 -426 -173 -177 -184 378 918 682 656 -157 -727 -480 -70 -100 109 131 346 1253 1112 449 543 136 346 299 283 -238 -118 80 -368 -548 -295 -435 -139 -8 -398 -937 159 -1069 -521 25 -150 843 195 -138 -425 -34 -126 157 469 -214 -429 111 749 438 -30 191 663 -27 260 1 370 -336 -1 325 407 666 462 -524 -575 669 -171 -227 315 -343 -895 -456 -985 -894 -736 -331 -839 -364 -284 312 475 192 211 804 815 457 873 389 695 488 1098 1304 955 164 -498 -466 252 134 1122 848 217 -235 -343 -683 -461 -367 155 691 952 201 -400 -532 -1606 -1232 -1162 -1031 -856 -662 -783 -614 -198 87 393 1338 1516 1136 908 780 -413 -737 -526 -673 -91 1087 278 -864 -567 -948 -124 316 -82 -628 -257 -258 -258 507 1189 881 866 -215 -1035 -693 -101 -142 151 177 455 1601 1419 591 742 192 494 433 418 -363 -185 127 -593 -890 -475 -691 -215 -12 SS 20240829T132513.1Z 9007.559180 294 1 50.65 2 56.23 109.04 13.33 173.52 0.00 1 0.00 1 0 25 9.397e-03 6.424e-03 1.382e-03 6.737e-04 2.437468e-01 3.557964e-04 2.955478e-03 -6.000000e+00 5.636715e-03 230.58 -2.00 3.51 -2.00 316.18 0.00e+00 -1.624339e-05 3.996948e-05 5.403737e-05 -6.000000e+00 2.534782e-04 289.19 -2.00 20.00 -2.00 315.39 0.00e+00 1.793 0.000 302.00 328.00 3 3.1104e+00 9.2770e-04 2.2018e-02 -6.0000e+00 1.4055e-02 1.3750e-02 1.0335e-03 1.2712e-02 -6.0000e+00 1.5175e-02 1.0829e-03 5.9361e-04 6.1857e-03 -6.0000e+00 9.0649e-03 -2.7722e-03 2.7167e-04 1.6998e-03 -6.0000e+00 3.8164e-03 2.9350e-03 -3.6019e-04 2.0653e-05 2.3196e-05 -6.0000e+00 2.8061e-04 -1.3139e-03 0.0000e+00 11 8 0 10 0 0 99.94 22.55 0.15 -0.00131 -0.00402 128 24 1 5 0 395.650 26.21 19.98 22.55 30.33 38.3 1078.92 -1057 -2363 -1141 -5024 -1728 -657 776 2567 1090 -706 -1250 798 370 623 983 -388 -1321 89 1188 712 -767 870 1189 318 568 -88 520 -941 204 723 1520 2022 1241 -1297 -882 847 77 528 556 -411 -1414 -776 -1400 -1321 -871 -405 -1302 -639 -679 528 609 416 591 928 758 714 857 231 699 681 1433 1506 1159 302 -542 -336 149 306 1298 846 -12 -224 -600 -601 -550 -369 208 789 1221 352 37 -507 -1348 -1169 -1151 -942 -756 -519 -415 -597 -215 196 405 1266 1391 1330 762 687 -266 -585 -452 -537 -57 857 127 -853 -365 -730 -133 -13 -1 -409 -268 -111 -126 582 777 856 623 32 -663 -433 -273 -273 162 239 407 1388 992 360 526 117 240 143 314 -248 -227 146 -407 -520 -221 -253 -271 63 -193 -476 -235 -1048 -327 -116 137 481 227 -158 -286 182 89 165 288 -125 -448 31 419 260 -288 326 447 123 229 -37 219 -393 81 276 579 805 526 -580 -391 361 33 248 294 -244 -916 -526 -977 -935 -616 -286 -916 -441 -462 355 415 293 433 704 592 567 693 188 565 548 1152 1240 1000 273 -505 -310 131 259 1088 745 -12 -222 -607 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