File name: Pandora55s1_QueensNY_20210125_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175343.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210125_L1_smca1c11d20210101p1-8.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: 20210125 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 20210125T130313.3Z 7695.543904 223 1 50.58 2 82.19 123.22 113.49 340.55 0.00 1 0.00 1 0 25 7.272e-01 5.309e-02 2.117e-01 1.121e-02 9.552139e-01 6.723960e-03 1.116840e-02 -6.000000e+00 4.466809e-01 224.13 -2.00 3.51 -2.00 321.82 0.00e+00 -7.385504e-04 2.694135e-03 6.801700e-03 -6.000000e+00 2.135980e-02 275.30 -2.00 20.00 -2.00 321.36 0.00e+00 6.865 0.006 302.00 328.00 3 1.8522e+00 2.1592e-02 9.1840e-02 -6.0000e+00 1.1093e+00 1.6291e+00 2.5422e-02 6.7445e-02 -6.0000e+00 1.2152e+00 -1.9855e+00 1.7205e-02 2.7301e-02 -6.0000e+00 7.1364e-01 7.5490e-01 9.0912e-03 8.2427e-03 -6.0000e+00 3.0083e-01 2.6873e-05 -3.7176e-03 3.1372e-04 1.4831e-04 -6.0000e+00 2.3867e-02 2.1357e-03 -3.9579e-05 12 9 8 11 32 0 99.93 22.81 0.63 0.00214 -0.02580 21 4 1 5 0 2407.770 25.68 20.00 22.81 1.62 25.8 1019.96 38573 900000 900000 -40465 900000 340145 101824 900000 900000 61450 -66470 87665 519 190208 900000 130865 -26423 -11272 900000 900000 900000 131460 156421 58362 3422 26992 900000 22760 35599 -41822 33791 900000 73305 -22803 100464 900000 46257 14220 900000 900000 68390 124431 -781 36471 180947 900000 8774 900000 169090 900000 -8959 87781 4608 900000 900000 142460 900000 160408 366371 55251 77457 162085 27482 -27801 76132 -16719 75596 22771 83599 51623 -7699 35602 14073 231 44777 -3960 42999 102678 -4233 5884 -3068 48637 14478 12506 -7139 9995 -10006 -3656 -17876 9491 5267 -5075 11824 -4285 -12715 -3131 -16524 -4909 -1002 -7419 -3059 -1514 281 5533 12084 2473 722 4356 711 11514 1922 -6704 -73 -2125 -3439 260 1178 4792 -4543 3092 -5086 1590 8306 735 -1288 2586 -987 -2150 -407 -3672 462 3586 2947 1294 1884 -903 2070 2064 1614 -8028 1576 612 767 -2152 2688 900000 900000 -5497 900000 3703 2327 900000 900000 2046 -7252 2269 34 2392 900000 3865 -3687 -1405 900000 900000 900000 3534 3085 2904 291 1837 900000 1412 1795 -4240 1810 900000 3529 -2865 3846 900000 2622 1149 900000 900000 4760 5380 -111 3594 4345 900000 1006 900000 4300 900000 -1365 5892 730 900000 900000 7191 900000 6832 3989 5629 6071 5690 3711 -7001 8013 -4388 8381 4167 9152 8388 -2410 7912 3856 69 8074 -1002 6306 8219 -971 1397 -939 10705 4958 4768 -3458 4335 -5431 -1932 -10885 4417 2445 -2443 4646 -1959 -6735 -1733 -12083 -3753 -842 -7167 -2895 -1336 221 3799 7654 1776 557 3433 625 10250 2116 -8938 -100 -3070 -5013 359 1584 6297 -6673 4436 -7967 2320 10958 992 -1724 3271 -1256 -2731 -535 -5579 773 6503 5829 2751 4237 -2197 5133 5228 4122 -21929 3865 1428 1669 -4591 SS 20210125T131438.5Z 7695.551834 226 1 50.95 2 80.40 125.27 114.12 343.19 0.00 1 0.00 1 0 25 7.216e-01 1.330e-02 1.444e-01 2.048e-03 8.603842e-01 1.137748e-03 9.539935e-03 -6.000000e+00 4.272453e-01 224.13 -2.00 3.51 -2.00 321.32 0.00e+00 5.571406e-03 5.514104e-04 2.550978e-03 -6.000000e+00 1.871484e-02 275.30 -2.00 20.00 -2.00 320.87 0.00e+00 5.722 0.003 302.00 328.00 3 4.7597e-01 3.7493e-03 7.4604e-02 -6.0000e+00 1.0578e+00 2.6195e-01 5.5326e-03 5.2027e-02 -6.0000e+00 1.1542e+00 -2.6953e-01 6.1695e-03 2.5541e-02 -6.0000e+00 6.8694e-01 9.9613e-02 2.9043e-03 1.0402e-02 -6.0000e+00 2.8649e-01 4.4040e-04 -1.6911e-03 5.4820e-05 1.1104e-04 -6.0000e+00 2.1602e-02 2.8441e-04 -3.4835e-05 12 8 8 10 0 0 61.52 22.81 0.18 0.00028 -0.01242 152 29 1 5 0 332.920 25.68 19.98 22.81 2.38 25.8 1020.68 -237955 -150180 900000 -296801 -189743 -197438 -228003 272723 -202647 -132920 -298168 -162209 -214243 -77954 900000 -86985 -128748 900000 900000 -2944 44787 -62882 -17980 -80255 -48931 -68595 103265 -65860 -44986 -82332 -56096 23503 -30002 -21776 -11885 145332 -21092 -3413 21493 21421 -837 2901 -4894 -3298 14626 20230 655 10133 17119 12264 -1089 9151 1405 16248 14280 11315 9660 9445 6068 4901 2555 9869 3786 -125 6219 691 8462 1152 7806 4641 1416 2445 3928 -411 1438 -103 2363 3950 -1599 1638 -833 2287 -1521 -524 -2902 -946 -2160 -961 -1761 -1036 559 244 1173 102 259 183 -782 -66 -747 -1332 -788 -567 -153 1366 -263 -1320 -1167 -622 -546 206 -312 -999 -321 -208 70 433 1228 1059 572 -194 -683 -36 844 524 -113 205 132 1494 847 -101 453 457 558 506 231 -522 -34 75 -305 -1096 54 -167 124 -68 -1612 -545 900000 -5114 -1151 -1240 -1998 544 -1725 -639 -7440 -1304 -3569 -481 900000 -990 -2595 900000 900000 -25 250 -997 -192 -1633 -808 -1457 446 -1430 -815 -2272 -1437 357 -911 -692 -360 1001 -713 -111 662 790 -44 163 -318 -222 857 1159 46 695 1178 959 -107 916 170 1890 1836 1580 1430 1418 933 741 393 1493 678 -26 1390 172 2005 299 2032 1392 489 899 1462 -155 500 -33 687 1106 -500 570 -350 1078 -834 -310 -1855 -625 -1505 -688 -1289 -749 386 161 737 64 174 138 -680 -65 -820 -1563 -927 -635 -158 1296 -250 -1313 -1214 -676 -631 257 -431 -1507 -508 -335 111 671 1854 1610 896 -315 -1133 -59 1320 796 -169 299 187 2079 1231 -162 798 872 1124 1066 509 -1204 -81 181 -742 -2665 127 -377 267 -144 SS 20210125T133219.5Z 7695.564115 239 1 51.03 2 77.72 128.54 114.92 347.35 0.00 1 0.00 1 0 25 3.572e-01 7.033e-03 4.666e-02 9.879e-04 7.128362e-01 5.256323e-04 8.195057e-03 -6.000000e+00 2.088556e-01 224.13 -2.00 3.51 -2.00 320.53 0.00e+00 3.097087e-03 2.050846e-04 1.833517e-03 -6.000000e+00 9.093545e-03 275.30 -2.00 20.00 -2.00 320.03 0.00e+00 4.567 0.002 302.00 328.00 3 3.9824e-01 1.5681e-03 5.9334e-02 -6.0000e+00 5.1540e-01 1.1284e-01 2.0562e-03 3.9864e-02 -6.0000e+00 5.6069e-01 -6.6862e-02 2.1204e-03 1.9483e-02 -6.0000e+00 3.3378e-01 1.3849e-02 1.0592e-03 6.9359e-03 -6.0000e+00 1.4022e-01 1.6607e-03 -1.4994e-03 2.7170e-05 7.3895e-05 -6.0000e+00 1.0646e-02 6.1376e-05 -4.9800e-05 11 8 0 10 0 0 99.62 22.82 0.22 0.00006 -0.01121 350 66 1 5 0 144.140 25.68 19.98 22.82 3.55 26.0 1019.69 -158428 -99663 -5613 -143742 -108873 -132956 -122361 -108209 -105001 -102851 -125662 -89541 -91763 -44371 -13965 -30882 -46234 -8209 3755 -3717 -12310 -10388 -13873 -20114 -21623 -19058 -2195 -19542 -17671 -24614 -13252 -5818 -4547 -12575 -3237 6851 -5914 -3678 1371 1148 -2888 -1670 -3996 -2121 -272 4257 -755 2760 1533 3090 -192 2244 1520 3530 2982 1448 1894 163 1304 483 1650 1987 2040 176 986 850 2133 1225 2581 1699 31 282 -157 -498 -570 -419 516 1713 1149 80 60 -359 -1457 -1465 -1527 -1232 -1167 -794 -625 -314 174 539 1026 1591 1073 915 467 665 -281 -585 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