File name: Pandora55s1_QueensNY_20200916_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T165437.1Z 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_20200916_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: 20200916 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 20200916T115711.5Z 7564.498050 104 1 51.09 2 75.79 99.35 62.40 98.82 0.00 1 0.00 1 0 25 9.537e-01 8.438e-02 7.368e-02 4.014e-03 4.221845e-01 2.135346e-03 9.547238e-03 -6.000000e+00 5.768511e-01 229.04 -2.00 3.51 -2.00 319.48 0.00e+00 6.707467e-02 6.138293e-04 6.840172e-03 -6.000000e+00 2.732490e-02 287.74 -2.00 20.00 -2.00 318.78 0.00e+00 3.983 0.001 302.00 328.00 3 3.3956e+00 6.0843e-03 4.6052e-02 -6.0000e+00 1.4320e+00 7.8265e-01 6.8109e-03 5.4610e-02 -6.0000e+00 1.5512e+00 -1.0808e+00 4.0272e-03 2.3654e-02 -6.0000e+00 9.1982e-01 5.1929e-01 2.2054e-03 4.1956e-02 -6.0000e+00 3.9061e-01 1.4956e-04 -1.8086e-03 1.1543e-04 6.7690e-04 -6.0000e+00 2.9573e-02 1.2051e-02 5.5320e-05 12 8 8 10 0 0 80.55 22.95 0.56 0.01205 -0.00154 13 2 1 5 0 3929.190 25.79 19.97 22.95 22.12 26.1 990.75 398408 900000 240235 900000 900000 252160 900000 131308 252270 81579 80628 90282 221235 900000 194789 170555 -66320 368246 254728 386364 167661 224977 112028 88771 48144 210089 61301 31795 80012 85981 156623 130484 112565 125668 201514 86177 70031 90115 63391 30511 40440 9587 21260 44014 56698 53045 70471 66487 68556 52462 46846 35962 48589 37525 21364 13548 746 -1125 -4903 3420 16050 10926 12427 21838 12629 23776 4846 16126 4893 1004 -5284 -4415 -15086 -3672 -11868 -8928 -1948 -5486 -4281 -3190 2818 -4222 -3270 -11130 -8024 -11573 -11143 -10435 -6862 -6499 -7065 -4355 -8547 -8804 -8269 -6369 -2942 -1461 -378 1967 1406 736 2836 -1289 -4132 -2495 -450 -95 3055 1715 -1735 376 -678 -590 -446 250 2255 2129 2224 823 3855 6023 6602 2712 4967 2353 5113 3464 2726 4798 5052 3786 3177 2322 -637 -544 -1734 -2251 -3234 -2216 -3822 -2241 -5368 4334 900000 12690 900000 900000 5993 900000 5470 2608 3556 3445 4403 4580 900000 9620 12437 -44541 4844 9966 4141 12909 8418 9509 7194 4624 3904 4590 3411 6386 8068 9502 11939 13022 12518 8961 10477 9699 10501 9581 6247 7635 2502 5411 9938 12497 12996 15589 15694 16089 14470 14004 12259 15002 12565 7815 4969 285 -421 -1915 1322 6179 4996 6275 11008 7018 11612 2641 7839 2733 622 -3601 -2998 -10835 -2273 -7341 -4983 -977 -2912 -2490 -2114 1987 -3399 -2737 -10213 -7469 -11556 -11525 -11011 -7086 -6557 -6829 -3856 -7423 -7680 -7720 -6569 -3326 -1798 -491 2526 1737 852 3070 -1439 -4903 -3068 -569 -126 4200 2538 -2765 604 -1088 -912 -660 358 3204 3138 3440 1332 6181 9421 10044 4134 7221 3381 7030 4879 4070 7573 8368 6533 5610 4237 -1220 -1071 -3498 -4596 -6659 -4464 -7566 -4237 -10113 SS 20200916T120706.4Z 7564.504935 107 1 50.77 2 73.94 101.06 60.62 100.58 0.00 1 0.00 1 0 25 1.925e-01 1.102e-02 4.465e-02 2.064e-03 4.404527e-01 1.085497e-03 5.229552e-03 -6.000000e+00 1.148266e-01 229.04 -2.00 3.51 -2.00 319.08 0.00e+00 1.211228e-03 2.719518e-04 6.376700e-04 -6.000000e+00 5.175372e-03 287.74 -2.00 20.00 -2.00 318.29 0.00e+00 3.553 0.001 302.00 328.00 3 2.9250e+00 3.0260e-03 4.2384e-02 -6.0000e+00 2.8539e-01 5.1808e-02 3.5223e-03 2.3719e-02 -6.0000e+00 3.0875e-01 -1.2309e-02 2.5604e-03 1.1299e-02 -6.0000e+00 1.8433e-01 -2.2873e-03 1.3353e-03 3.5401e-03 -6.0000e+00 7.8115e-02 4.8501e-04 -7.3284e-04 6.3229e-05 3.9746e-05 -6.0000e+00 5.7847e-03 1.2211e-02 2.6989e-05 12 8 8 10 0 0 78.53 22.95 0.37 0.01221 0.00670 34 6 1 5 0 1492.890 25.79 20.01 22.95 22.56 26.0 993.12 -18411 179948 -50465 14595 15621 -20365 63868 -46259 3859 -39091 -20687 -26057 7006 36418 -9062 -17915 -26353 20013 2385 19388 -10555 9287 -12455 -3097 -7652 23053 -3906 -16063 -4068 -4125 10291 2162 -5817 2381 20253 -2014 -3245 7864 3129 -2321 614 -5017 -2543 1725 2213 -858 1181 1274 3238 1954 -100 -2822 3446 3440 1821 -324 2353 1854 1180 2530 2657 1619 -960 551 -1912 2362 -1489 3087 1342 25 -1347 -319 -2294 969 -725 920 2388 1211 7 -596 863 -2094 -1126 -2338 -759 -1230 -1342 -1199 -613 -170 23 1239 1114 1635 1531 373 708 -197 -935 -431 -306 -92 1852 312 -1139 -434 -440 -274 492 50 -798 -155 -311 275 626 738 848 271 -552 -1379 -487 -71 584 -260 440 -199 1405 931 196 590 784 640 450 628 -438 27 3 -309 -727 -130 -779 146 -165 -514 824 -2060 307 310 -582 915 -2099 119 -1883 -890 -1327 313 1471 -645 -1534 -2629 1392 206 1480 -1086 810 -1394 -341 -930 2173 -466 -2080 -469 -503 1229 312 -972 375 2659 -333 -604 1565 759 -667 186 -1673 -858 568 733 -293 398 432 1106 704 -39 -1218 1504 1582 877 -164 1179 927 587 1250 1360 897 -584 350 -1248 1446 -915 1864 884 18 -1046 -253 -1829 728 -521 607 1478 756 5 -446 700 -1877 -1056 -2308 -775 -1318 -1491 -1355 -687 -186 24 1212 1051 1550 1534 408 838 -251 -1248 -573 -391 -111 2131 367 -1408 -557 -583 -376 703 75 -1263 -249 -497 425 927 1060 1214 400 -848 -2195 -778 -113 901 -394 648 -286 1953 1312 291 924 1281 1080 775 1113 -807 52 6 -607 -1434 -253 -1483 268 -299 SS 20200916T121837.1Z 7564.512929 110 1 50.13 2 71.81 103.08 58.58 102.68 0.00 1 0.00 1 0 25 5.443e-02 8.425e-03 1.055e-02 1.490e-03 3.927927e-01 7.804271e-04 4.680110e-03 -6.000000e+00 3.247945e-02 229.04 -2.00 3.51 -2.00 318.49 0.00e+00 3.300429e-04 1.623177e-04 3.396213e-04 -6.000000e+00 1.463755e-03 287.74 -2.00 20.00 -2.00 317.67 0.00e+00 3.161 0.001 302.00 328.00 3 2.7773e+00 2.1255e-03 3.7625e-02 -6.0000e+00 8.0724e-02 3.2074e-02 2.4305e-03 2.0684e-02 -6.0000e+00 8.7329e-02 -1.8942e-04 1.6275e-03 1.0020e-02 -6.0000e+00 5.2138e-02 -5.2220e-03 8.4282e-04 2.8287e-03 -6.0000e+00 2.2098e-02 8.7741e-04 -5.2745e-04 4.5857e-05 3.4163e-05 -6.0000e+00 1.6361e-03 1.1352e-02 2.6577e-05 11 8 0 10 0 0 14.84 22.95 0.30 0.01135 0.00739 49 9 1 5 0 1022.750 25.79 20.02 22.95 23.15 26.1 996.34 -7089 31390 -29054 1685 -4277 -12391 13962 -17286 -5835 -19180 -10468 -10613 -1748 15022 -5955 -9547 -5283 6809 1968 4648 -3855 4849 -5316 -2686 -3375 5960 -2064 -7373 -2517 680 4720 2421 -4194 768 7275 -1299 -1639 3268 761 -2260 660 -2576 -1779 -856 1337 -981 529 -757 1790 712 282 -903 2049 2033 1262 1368 649 1314 709 2267 1790 1406 -219 -63 -999 1561 -262 1864 1303 -213 -752 -524 -1478 -144 -414 961 1459 1113 507 -608 93 -1562 -1073 -1731 -974 -1095 -861 -920 -614 -396 147 1137 1570 1652 1263 626 747 -393 -839 -526 -470 -35 1187 179 -990 -338 -432 -307 435 123 -678 -491 -214 0 686 900 1127 466 -396 -1126 -628 -360 222 -143 561 105 1455 1105 272 486 357 401 315 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