File name: Pandora55s1_QueensNY_20201018_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171226.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman 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_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20201018_L1_smca1c10d20200414p1-8.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: 20201018 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20201018T120213.6Z 7596.501547 62 1 51.29 2 81.44 111.03 103.43 99.16 0.00 1 0.00 1 0 25 4.991e-01 3.344e-02 1.493e-01 6.181e-03 6.887428e-01 3.583117e-03 7.815749e-03 -6.000000e+00 3.022469e-01 225.62 -2.00 3.51 -2.00 321.30 0.00e+00 1.058948e-02 1.786542e-03 2.384331e-03 -6.000000e+00 1.616478e-02 283.86 -2.00 20.00 -2.00 320.75 0.00e+00 6.329 0.005 302.00 328.00 3 1.7537e+00 1.2357e-02 7.5692e-02 -6.0000e+00 7.5203e-01 5.0288e-01 1.6025e-02 4.9102e-02 -6.0000e+00 8.2246e-01 -6.8301e-01 1.3963e-02 1.9156e-02 -6.0000e+00 4.8510e-01 2.8982e-01 6.6496e-03 1.4558e-02 -6.0000e+00 2.0758e-01 8.1157e-05 -1.8669e-03 1.9051e-04 1.3636e-04 -6.0000e+00 1.6174e-02 1.1148e-02 9.2443e-05 12 8 8 10 0 0 29.48 22.98 0.96 0.01115 -0.00288 27 5 1 5 0 1899.400 25.79 19.97 22.98 14.26 25.9 953.85 900000 900000 -169167 900000 -22032 -133665 900000 92848 900000 -91187 900000 -128153 900000 900000 -56032 -69931 -70394 900000 900000 900000 46258 900000 -47614 -72334 -34269 900000 32472 -44721 -101554 -7146 115788 63518 -32734 94491 900000 -30994 -1688 900000 186038 14721 121571 -13425 41406 72408 137311 14001 193470 92217 93848 35074 -741 -2229 38389 91592 32568 53172 41826 43273 15815 18416 39003 11601 -1697 24610 -3482 22816 -1661 27309 22715 -6203 5337 16732 -3321 19185 4839 7038 13643 -4797 -3383 -2818 15066 -1000 3118 -9572 1021 -5274 -6034 -4817 -3198 -8178 -3121 2852 -1271 -826 316 -3265 -284 -2442 -1197 -668 -515 598 2119 3260 -3039 -379 -453 -675 2396 -1396 -3390 -230 -504 -1027 -752 66 2500 -1891 -166 -2925 698 2163 5600 -278 2650 -104 2133 1170 -343 647 2822 2616 762 -258 -423 503 312 -552 -256 499 -1817 -335 -2267 900000 900000 -8470 900000 -219 -3813 900000 558 900000 -1921 900000 -4890 900000 900000 -2099 -3427 -3821 900000 900000 900000 899 900000 -2252 -4448 -1483 900000 725 -2077 -8419 -269 1574 1694 -2428 2093 900000 -2222 -99 900000 2408 1130 3638 -1542 2936 3895 4046 1367 3458 4551 4808 3362 -109 -366 4636 7095 4574 6306 5524 5541 2563 2898 5310 2252 -420 5235 -1005 5113 -465 6084 5818 -2306 1929 5595 -1306 5792 1535 1993 3475 -1498 -1170 -1134 5929 -511 1666 -6059 622 -3591 -4315 -3491 -2277 -5904 -2047 1683 -760 -510 214 -2614 -252 -2476 -1292 -726 -533 565 1857 2818 -2903 -374 -469 -747 2798 -1852 -4973 -346 -771 -1546 -1094 93 3468 -2800 -253 -4714 1094 3271 8002 -406 3684 -144 2847 1620 -522 1076 4998 4911 1514 -542 -929 1141 725 -1302 -604 1145 -4082 -710 -4744 SS 20201018T121647.4Z 7596.511659 67 1 50.75 2 78.89 113.59 100.86 101.39 0.00 1 0.00 1 0 25 2.948e-01 9.600e-03 1.243e-01 1.985e-03 5.844515e-01 1.062968e-03 6.787830e-03 -6.000000e+00 1.737039e-01 225.62 -2.00 3.51 -2.00 320.36 0.00e+00 2.609846e-03 4.091525e-04 1.227617e-03 -6.000000e+00 7.900544e-03 283.86 -2.00 20.00 -2.00 319.73 0.00e+00 5.005 0.002 302.00 328.00 3 1.2233e+00 3.2454e-03 5.8741e-02 -6.0000e+00 4.2886e-01 5.7273e-02 4.1085e-03 3.2629e-02 -6.0000e+00 4.6535e-01 -2.7543e-02 3.7836e-03 1.5518e-02 -6.0000e+00 2.7812e-01 -8.9884e-04 1.8965e-03 6.0537e-03 -6.0000e+00 1.1888e-01 5.8086e-04 -8.6525e-04 5.9611e-05 6.0509e-05 -6.0000e+00 8.8513e-03 9.9804e-03 6.2798e-05 12 8 8 10 0 0 6.65 22.98 0.24 0.00998 0.00348 99 19 1 5 0 507.360 25.79 20.00 22.98 15.56 26.0 960.62 -33619 900000 -143036 180388 -112438 -77690 79477 27472 -26055 -74369 -43611 -68656 14754 77507 -23239 -39594 -3528 27364 78364 10015 10315 -4374 -22030 -32069 -21021 45875 -13034 -8969 -50121 -6769 -1762 8159 -21671 113 25653 -14835 -6569 10784 7788 -4180 5785 -10179 2708 -2025 7529 -5080 10604 2130 7006 4448 -4491 -384 2470 8356 -112 3818 876 3171 -586 1500 4066 900 -541 520 -163 1562 531 2631 3405 -1540 13 47 -635 595 0 1264 1449 1276 -1390 233 473 -709 -1206 -2107 -984 -1345 -753 -1118 -815 -959 180 802 1693 1023 1669 298 721 -263 -409 -90 -611 607 729 394 -1458 -407 -686 -35 298 -287 -455 -425 -95 -119 836 889 1211 -269 -397 -1168 -362 76 314 -275 158 192 1254 1109 -67 412 318 574 493 259 -257 -86 46 -443 -1104 -29 -101 12 382 -220 900000 -2980 349 -1637 -847 213 139 -243 -1173 -564 -1326 163 587 -548 -1246 -88 561 1066 270 284 -142 -890 -1540 -978 1196 -587 -385 -3211 -321 -93 456 -1757 8 1374 -1189 -550 918 812 -560 779 -1686 415 -331 1157 -891 1656 370 1221 850 -1019 -92 627 2157 -33 1119 268 949 -178 450 1250 311 -209 216 -70 651 222 1117 1576 -822 8 27 -368 326 0 595 650 586 -714 134 306 -511 -933 -1732 -842 -1213 -703 -1067 -773 -887 158 664 1356 843 1481 295 789 -317 -519 -114 -745 689 787 429 -1678 -487 -853 -45 409 -425 -715 -692 -155 -190 1274 1318 1791 -412 -633 -1926 -596 122 494 -425 238 281 1791 1615 -104 691 565 1062 941 514 -532 -184 99 -978 -2449 -63 -214 24 763 SS 20201018T122301.3Z 7596.515987 70 1 50.63 2 77.81 114.71 99.77 102.35 0.00 1 0.00 1 0 25 1.407e-01 7.809e-03 3.748e-02 1.474e-03 5.414461e-01 7.807697e-04 6.338302e-03 -6.000000e+00 8.290384e-02 225.62 -2.00 3.51 -2.00 319.99 0.00e+00 2.079030e-03 2.652617e-04 9.346693e-04 -6.000000e+00 3.770963e-03 283.86 -2.00 20.00 -2.00 319.33 0.00e+00 4.597 0.002 302.00 328.00 3 1.1407e+00 2.2931e-03 5.3858e-02 -6.0000e+00 2.0468e-01 4.0620e-02 2.8113e-03 2.9473e-02 -6.0000e+00 2.2210e-01 -1.2621e-02 2.4528e-03 1.4151e-02 -6.0000e+00 1.3274e-01 -5.5395e-03 1.2567e-03 5.0648e-03 -6.0000e+00 5.6735e-02 9.7554e-04 -7.7858e-04 4.4218e-05 5.3307e-05 -6.0000e+00 4.2247e-03 1.0166e-02 5.5454e-05 11 8 0 10 0 0 29.93 22.98 0.29 0.01017 0.00432 133 25 1 5 0 377.760 25.79 20.00 22.98 16.32 26.1 964.99 -36088 900000 -77831 -40717 -35855 -57289 36200 -28555 -28986 -53639 -4996 -46248 -13475 22987 -23216 -20021 19813 24085 20634 -1608 -10367 2541 -11589 -15425 -9711 11910 -5679 -11378 -22144 -10093 2810 -1371 -11495 -610 12245 -8062 -3417 6673 1649 -2601 -939 -5626 -1593 530 2504 -2076 3846 58 4577 1574 -957 -1444 2984 3587 875 1853 893 978 571 1811 2802 1139 -423 397 -404 1943 208 2740 1350 -219 -159 -306 -1203 -254 248 365 1601 927 -15 -375 478 -1513 -1111 -1468 -1299 -1052 -944 -537 -555 -515 384 1185 1216 1735 1325 984 1057 -590 -577 -430 -396 387 1162 411 -1316 -721 -860 -104 117 -229 -571 -119 -215 15 539 950 1200 361 -335 -920 -721 -231 52 -284 234 117 1433 1145 171 367 253 517 168 258 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