File name: Pandora55s1_QueensNY_20201109_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171342.6Z 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_20201109_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: 20201109 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 20201109T122711.3Z 7618.518881 288 1 50.61 2 82.11 120.70 26.08 199.91 0.00 1 0.00 1 0 25 4.962e-01 1.837e-02 1.471e-01 3.675e-03 6.715563e-01 2.094700e-03 7.688201e-03 -6.000000e+00 2.982110e-01 223.71 -2.00 3.51 -2.00 321.29 0.00e+00 6.563306e-03 1.056726e-03 3.749580e-03 -6.000000e+00 1.573520e-02 281.16 -2.00 20.00 -2.00 320.76 0.00e+00 6.801 0.006 302.00 328.00 3 4.8656e-01 7.2092e-03 8.0108e-02 -6.0000e+00 7.3439e-01 1.7383e-01 9.9462e-03 5.0004e-02 -6.0000e+00 8.0336e-01 -2.1071e-01 9.9944e-03 1.9051e-02 -6.0000e+00 4.7480e-01 7.8218e-02 4.7126e-03 1.0873e-02 -6.0000e+00 2.0412e-01 2.0908e-04 -1.3213e-03 1.1507e-04 8.7759e-05 -6.0000e+00 1.5605e-02 1.0648e-02 1.5716e-05 12 8 8 10 0 0 -6.01 22.91 0.42 0.01065 0.00072 81 15 1 5 0 624.620 25.79 20.01 22.91 18.11 26.7 978.14 900000 900000 -237041 900000 900000 -200450 900000 -177372 -33357 -230950 900000 -194013 900000 900000 -50548 -54383 -87881 900000 146520 900000 -57615 35214 -62271 -71260 -49574 900000 -3994 -9603 -83038 -127 97463 -40383 -33214 -21238 900000 -40218 -13128 60995 44146 15342 2142 -6080 16064 22219 24955 -2577 38300 24514 26245 1049 -1694 -9263 27482 17570 7175 17155 17409 18242 1937 6092 10314 4253 -4175 14419 -2729 9843 -1599 12701 4312 -670 1765 7627 -3367 4538 2859 32 11087 -1053 1095 -2381 6494 -3278 -117 -3828 611 -2553 -2699 -1634 -1867 -881 -1851 3135 480 1003 -52 -1708 -102 -1240 -1601 -309 -160 68 1746 286 -596 -1567 -738 -274 920 -827 -1538 58 -1102 -219 32 1301 1357 -121 -659 -1622 -218 535 1528 -197 1369 132 2010 719 -65 286 1402 1160 1082 594 -376 321 32 -142 -2120 322 -309 -32 -544 900000 900000 -5411 900000 900000 -3014 900000 -2578 -129 -6472 900000 -5164 900000 900000 -703 -918 -2311 900000 524 900000 -1416 360 -1708 -2272 -1365 900000 -74 -188 -3429 -3 980 -1802 -1553 -916 900000 -2108 -598 1647 1664 873 152 -500 1128 1516 1712 -235 2478 1882 2119 116 -213 -1383 3180 2407 1134 2572 2649 2743 332 1011 1736 838 -1005 3214 -746 2384 -433 3155 1285 -233 651 2756 -1323 1578 934 10 2967 -327 374 -980 2837 -1749 -66 -2360 385 -1742 -1932 -1188 -1354 -616 -1243 1913 294 637 -37 -1397 -93 -1275 -1765 -339 -168 66 1573 261 -576 -1607 -788 -310 1114 -1114 -2249 88 -1704 -331 46 1825 1917 -178 -1017 -2596 -345 825 2280 -292 1946 185 2722 1017 -101 483 2527 2213 2150 1243 -828 732 74 -337 -5090 747 -696 -70 -1150 SS 20201109T123920.4Z 7618.527319 291 1 50.73 2 80.16 122.87 27.00 205.98 0.00 1 0.00 1 0 25 2.664e-01 9.332e-03 7.317e-02 1.930e-03 5.716383e-01 1.033343e-03 6.651586e-03 -6.000000e+00 1.569955e-01 223.70 -2.00 3.51 -2.00 320.58 0.00e+00 3.267690e-03 4.186215e-04 1.556289e-03 -6.000000e+00 7.064524e-03 281.16 -2.00 20.00 -2.00 319.99 0.00e+00 5.591 0.003 302.00 328.00 3 5.8925e-01 3.1991e-03 6.3527e-02 -6.0000e+00 3.8669e-01 4.1963e-02 4.1098e-03 3.3070e-02 -6.0000e+00 4.2076e-01 -3.3797e-02 3.9131e-03 1.5363e-02 -6.0000e+00 2.5019e-01 4.1232e-03 1.9441e-03 6.2592e-03 -6.0000e+00 1.0658e-01 6.6316e-04 -1.1303e-03 5.8743e-05 6.2466e-05 -6.0000e+00 8.1305e-03 1.0868e-02 -2.0015e-05 12 8 8 10 0 0 94.03 22.91 0.26 0.01087 0.00237 169 32 1 5 0 298.340 25.79 20.02 22.91 19.65 26.8 986.64 -44617 900000 -127179 -25672 -26966 -119317 900000 -62534 -28053 -121069 -31701 -110037 15243 109698 -14529 -21469 -16166 86062 10424 22941 -20146 -8202 -29683 -30157 -20023 41058 -7696 -15147 -30899 -8152 3277 -9385 -15022 -10301 29543 -14180 -6215 6733 5318 -1902 -2114 -6142 -201 1860 3576 -2780 6301 3901 4983 608 -857 -2376 5021 6024 1411 2960 2383 2383 269 652 2963 1681 -525 2384 -594 3286 -136 4125 2587 156 6 1139 -2352 11 47 569 3346 1329 -238 -648 1236 -1536 -1102 -2005 -895 -1367 -1111 -970 -568 -207 462 1350 1752 1605 1028 333 692 -359 -1129 -268 -328 -54 1316 -116 -1277 -943 -659 -187 284 -316 -651 -319 -294 80 397 1239 1167 560 -405 -1192 -807 -61 276 -88 405 125 1710 815 363 177 408 615 440 460 -453 -73 152 -326 -1076 -181 -143 208 98 -296 900000 -2101 -155 -158 -1757 900000 -677 -239 -2660 -328 -2808 151 547 -286 -517 -411 913 242 493 -664 -247 -1160 -1275 -825 998 -294 -615 -1486 -351 148 -552 -1025 -694 1372 -1016 -465 532 507 -222 -272 -874 -28 264 510 -429 918 600 796 108 -169 -524 1124 1427 366 786 649 646 73 179 834 524 -185 889 -235 1235 -52 1579 1104 75 3 606 -1278 6 22 249 1364 563 -113 -350 744 -1047 -803 -1551 -726 -1169 -990 -883 -514 -182 385 1057 1332 1254 873 317 731 -418 -1398 -332 -389 -59 1372 -123 -1431 -1105 -805 -239 385 -464 -1016 -515 -477 126 601 1815 1711 848 -643 -1961 -1334 -98 436 -136 608 183 2435 1193 568 300 733 1152 852 925 -954 -160 339 -737 -2446 -402 -310 432 200 SS 20201109T124556.4Z 7618.531903 295 1 50.76 2 79.12 124.08 27.58 209.12 0.00 1 0.00 1 0 37 1.435e-01 6.900e-03 3.846e-02 1.210e-03 5.308145e-01 6.358174e-04 6.220305e-03 -6.000000e+00 8.390135e-02 223.70 -2.00 3.51 -2.00 320.12 0.00e+00 2.274377e-03 2.226760e-04 9.295723e-04 -6.000000e+00 3.752961e-03 281.16 -2.00 20.00 -2.00 319.51 0.00e+00 5.102 0.002 302.00 328.00 3 2.9463e-01 1.8747e-03 5.7715e-02 -6.0000e+00 2.0644e-01 2.9741e-02 2.3055e-03 2.8877e-02 -6.0000e+00 2.2444e-01 -1.8582e-02 2.0625e-03 1.3943e-02 -6.0000e+00 1.3402e-01 -1.5384e-03 1.0545e-03 5.0421e-03 -6.0000e+00 5.7076e-02 1.4727e-03 -8.6971e-04 3.6645e-05 5.4670e-05 -6.0000e+00 4.3048e-03 1.1219e-02 2.3150e-05 11 8 0 10 0 0 12.51 22.91 0.23 0.01122 0.00468 247 47 1 5 0 203.810 25.79 20.00 22.91 20.45 26.9 991.12 -36184 67395 -75901 -25136 -40162 -48525 22185 -39984 -22849 -64058 -11913 -54044 -1071 11446 -8376 -14119 4803 12814 520 298 -12936 -2454 -11832 -11761 -10810 7356 -10034 -2661 -16051 753 293 -2093 -7404 -5854 12402 -7286 -2675 434 2162 -2320 -1921 -3760 -1078 -399 1600 -1753 1341 1449 1046 1177 -376 -285 2333 2633 1053 1596 1071 1004 111 745 2771 943 392 404 461 1654 440 2495 2197 180 -269 181 -1055 -225 -502 466 1570 1138 303 -116 180 -1220 -1266 -1517 -829 -1058 -727 -554 -412 -323 432 879 1384 1492 862 732 942 -404 -759 -378 -308 93 992 52 -1037 -803 -820 -86 84 -190 -409 -419 -227 -48 658 1137 964 423 -310 -917 -645 -238 -119 32 272 305 1527 1103 69 345 146 350 334 298 -268 -108 81 -417 -773 -141 -52 11 235 -393 286 -1288 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