File name: Pandora55s1_QueensNY_20200812_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T162204.4Z 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_20200812_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: 20200812 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 20200812T110949.9Z 7529.465161 486 1 49.78 2 78.66 80.22 23.76 174.96 0.00 1 0.00 1 0 17 3.816e-01 3.661e-02 1.227e-01 6.184e-03 5.812029e-01 3.495861e-03 6.722680e-03 -6.000000e+00 2.362930e-01 231.87 -2.00 3.51 -2.00 320.65 0.00e+00 5.219261e-03 1.408610e-03 1.325681e-03 -6.000000e+00 1.147628e-02 290.24 -2.00 20.00 -2.00 319.93 0.00e+00 4.911 0.002 302.00 328.00 3 3.2255e+00 1.1163e-02 5.7871e-02 -6.0000e+00 5.9369e-01 2.7437e-01 1.3892e-02 3.0826e-02 -6.0000e+00 6.4458e-01 -3.7113e-01 1.0974e-02 1.6289e-02 -6.0000e+00 3.8103e-01 1.5784e-01 5.4241e-03 6.5281e-03 -6.0000e+00 1.5907e-01 8.0978e-05 -5.5601e-04 1.9369e-04 9.0471e-05 -6.0000e+00 1.1925e-02 -2.3757e-03 -5.7394e-05 12 9 8 11 32 0 61.45 23.07 0.40 -0.00238 -0.00655 14 3 1 5 0 3555.200 25.90 19.98 23.07 32.54 26.3 1050.68 -26046 900000 -186936 900000 -129312 -139715 900000 -22686 61266 -105154 -63433 -111226 71893 900000 40099 15601 -4000 900000 900000 900000 30666 900000 -62391 -8431 -37271 900000 108786 -43418 15479 37483 68039 -19766 15817 63682 900000 -10735 -19913 51332 84334 6481 64640 -15845 -5615 54843 95011 -8397 43927 30083 18951 -11596 1654 -5731 57898 46889 34003 18575 22714 13793 6403 12975 33671 1934 -5176 21719 7534 22654 -5407 16803 772 -1816 -3770 6039 -7896 14770 -2500 -858 8308 -1087 -1397 -6998 18029 2577 2623 -8518 -1967 -5838 -2478 -5872 -447 -3648 -1870 3797 -2762 -1162 -3665 -4178 -3698 -140 -4171 142 -1571 1520 6062 1787 -2690 16 22 1092 -404 -717 -2409 1027 -1590 -1423 -1082 703 2474 2402 -1008 -2447 594 3449 3852 707 2275 -1010 1366 324 833 1568 3068 909 682 592 -74 740 285 -372 -937 595 -3060 -145 -2027 -396 900000 -13898 900000 -4897 -5790 900000 -363 465 -4019 -1737 -5500 770 900000 849 470 -158 900000 900000 900000 1010 900000 -5038 -433 -2616 900000 1940 -3152 655 1404 2206 -1677 1048 2752 900000 -918 -2051 3190 4529 817 5156 -2831 -945 5325 6447 -1510 4925 3933 2853 -2459 337 -1368 8237 7861 6694 4346 5177 3384 1650 3149 7028 590 -1868 6644 2706 6927 -2101 5495 320 -856 -1947 2955 -4314 6268 -1153 -356 3011 -436 -616 -3725 8725 1590 1738 -6575 -1516 -4911 -2121 -5289 -383 -3128 -1500 2740 -2033 -861 -3018 -3868 -3823 -155 -5088 168 -1810 1588 5779 1773 -2894 18 25 1324 -529 -1018 -3714 1605 -2546 -2216 -1615 1003 3492 3487 -1569 -3984 954 5316 5775 1060 3269 -1445 1878 457 1252 2548 5265 1657 1290 1168 -153 1578 625 -830 -2103 1297 -6631 -295 -4089 SS 20200812T111208.0Z 7529.466759 488 1 50.02 2 78.23 80.58 23.72 176.30 0.00 1 0.00 1 0 25 4.115e-01 3.094e-02 1.283e-01 5.125e-03 5.825992e-01 2.915816e-03 6.852272e-03 -6.000000e+00 2.543628e-01 231.87 -2.00 3.51 -2.00 320.58 0.00e+00 6.683362e-03 1.168704e-03 1.660573e-03 -6.000000e+00 1.294448e-02 290.24 -2.00 20.00 -2.00 319.86 0.00e+00 4.746 0.002 302.00 328.00 3 3.0857e+00 9.2164e-03 5.6660e-02 -6.0000e+00 6.3895e-01 2.0762e-01 1.1639e-02 3.1220e-02 -6.0000e+00 6.9267e-01 -2.4433e-01 9.6631e-03 1.7862e-02 -6.0000e+00 4.0874e-01 9.5804e-02 4.7628e-03 8.0865e-03 -6.0000e+00 1.7408e-01 1.0811e-04 -5.1781e-04 1.5952e-04 1.0226e-04 -6.0000e+00 1.2835e-02 -4.0755e-03 8.4814e-05 12 9 8 11 32 0 49.70 23.08 0.69 -0.00408 -0.00797 18 3 1 5 0 2778.160 25.90 20.01 23.08 32.65 26.3 1051.52 900000 900000 -188671 900000 900000 -148529 900000 -12877 900000 -140177 -39514 -153507 10240 900000 49799 204234 -100345 900000 900000 900000 97552 900000 -34657 -44017 -30173 -10743 87638 -30892 32320 56951 43506 -20454 -2298 44731 5943 -9028 58592 42735 66243 -6169 33304 -14252 -14320 27997 67934 -9398 31912 19613 15927 -7691 16440 6553 42752 2778 17706 14864 18452 12653 8251 9811 20134 1375 -5478 14833 -5868 14609 -1378 16306 -1107 -100 -1662 5266 -4130 10260 -2044 -1087 8968 345 1304 -6783 12643 1359 918 -8104 -1013 -3072 -2341 -4670 -183 -3421 -2016 4254 -2347 -254 -1999 -2092 -2064 -2444 -2513 877 -919 -3289 5103 380 -1442 -661 -152 489 -577 16 -2029 890 38 -1068 -187 1574 1568 1155 -305 -2481 274 2408 3086 -376 1789 314 1483 -73 415 1288 1831 1131 1036 1095 266 769 155 373 -4419 1049 -1943 355 -838 900000 900000 -9896 900000 900000 -4722 900000 -130 900000 -5386 -618 -8318 145 900000 726 1019 -7779 900000 900000 900000 1379 900000 -1797 -2634 -1656 -502 1594 -1714 1004 1539 1558 -1561 -163 2092 392 -697 2633 2628 3856 -811 3312 -2350 -2465 3324 5670 -1641 3875 2748 2402 -1538 2866 1370 6907 693 4008 3570 4335 3121 2089 2448 4784 423 -1996 4883 -2408 4907 -525 5440 -472 -47 -857 2639 -2222 4653 -960 -465 3314 140 572 -3670 6544 865 631 -6333 -788 -2563 -2029 -4232 -159 -2979 -1654 3121 -1759 -190 -1645 -1926 -2127 -2787 -3049 1045 -1065 -3614 4966 385 -1549 -743 -178 597 -757 23 -3108 1388 60 -1654 -277 2229 2219 1690 -471 -4012 439 3728 4645 -566 2571 444 2031 -102 620 2073 3130 2039 1935 2124 540 1620 334 814 -9999 2256 -4133 713 -1661 SS 20200812T111421.7Z 7529.468307 490 1 49.38 2 77.82 80.93 23.70 177.59 0.00 1 0.00 1 0 25 4.339e-01 2.137e-02 1.733e-01 4.398e-03 5.668621e-01 2.474990e-03 6.495908e-03 -6.000000e+00 2.696549e-01 231.87 -2.00 3.51 -2.00 320.46 0.00e+00 4.144744e-03 9.735346e-04 5.483745e-04 -6.000000e+00 1.366042e-02 290.24 -2.00 20.00 -2.00 319.74 0.00e+00 4.596 0.002 302.00 328.00 3 3.0207e+00 7.7538e-03 5.5186e-02 -6.0000e+00 6.7565e-01 9.8962e-02 9.8078e-03 3.1529e-02 -6.0000e+00 7.3310e-01 -1.2150e-01 8.4410e-03 1.5530e-02 -6.0000e+00 4.3275e-01 4.6105e-02 4.1965e-03 7.4044e-03 -6.0000e+00 1.8289e-01 1.4010e-04 -6.4846e-04 1.3693e-04 7.0544e-05 -6.0000e+00 1.3579e-02 -3.2292e-03 1.6996e-05 12 9 8 11 32 0 34.06 23.08 0.36 -0.00323 -0.00810 21 4 1 5 0 2350.680 25.90 20.00 23.08 32.85 26.4 1052.93 900000 900000 -182321 900000 900000 -119436 900000 -195 206880 -108234 44550 -113038 188109 -54347 85155 -69869 123975 900000 900000 136100 31350 127237 -63092 -36319 -39338 900000 22199 -23007 -20419 15028 33993 -17469 -12143 40033 900000 -16244 -8326 14641 51314 -12172 24366 -13054 -9313 18797 42615 -7927 20176 16380 453 -1160 5111 -7628 -4979 26251 9353 6749 7958 6353 774 4888 14611 1152 -3026 8525 -2951 8309 -3202 10807 135 -2223 -1712 3658 -4002 8806 -964 -571 3815 1756 1777 -4135 8012 312 849 -4901 -885 -3369 -1482 -3630 -177 -3561 -1034 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