File name: Pandora55s1_QueensNY_20201118_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T172818.9Z 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_20201118_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: 20201118 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 20201118T123735.6Z 7627.526106 68 1 17.10 2 82.39 123.88 121.05 98.02 0.00 1 0.00 1 0 25 6.226e-01 3.078e-02 2.783e-01 9.115e-03 1.024603e+00 5.453269e-03 1.202651e-02 -6.000000e+00 3.722402e-01 223.21 -2.00 3.51 -2.00 322.04 0.00e+00 1.297329e-04 3.161341e-03 1.232333e-02 -6.000000e+00 1.920654e-02 280.11 -2.00 20.00 -2.00 321.60 0.00e+00 7.017 0.006 302.00 328.00 3 3.4542e-01 2.0730e-02 1.1343e-01 -6.0000e+00 9.1968e-01 1.0622e+00 2.9443e-02 1.1199e-01 -6.0000e+00 1.0080e+00 -1.4188e+00 2.7616e-02 4.7025e-02 -6.0000e+00 5.9687e-01 5.6870e-01 1.2551e-02 9.7792e-03 -6.0000e+00 2.5520e-01 1.1591e-04 -2.7123e-03 2.4165e-04 2.2606e-04 -6.0000e+00 2.0029e-02 1.4357e-02 -1.3872e-05 12 9 9 12 1 1 1.10 22.88 0.30 0.01436 -0.00602 19 11 1 5 0 846.540 25.79 20.00 22.88 5.49 25.5 912.69 900000 900000 -152012 900000 -53744 -132586 900000 -115491 202492 -215834 900000 -171975 22190 900000 -57086 -86594 -64299 900000 900000 900000 21670 159589 -45069 -40889 -31810 900000 -26066 -21485 -21954 6114 900000 -33455 6494 92114 900000 -34247 45861 900000 237941 18987 21775 35174 79040 102686 188088 8513 102684 104971 68867 77257 22996 1652 131142 124482 84839 97357 102343 84632 77001 24343 99935 19662 5396 55349 -991 56229 -1722 39675 29141 14719 23109 37935 2601 30474 12567 7053 37398 7759 10855 -2546 21895 -2715 9013 -2493 3682 -3096 -1672 -2931 -742 -3417 -2164 938 1327 -925 -4166 -4723 -3892 -2605 -5048 -2322 -2911 -1456 3872 193 -1016 -3309 1771 -1374 429 -3216 -3807 -756 -2166 -10 -792 1570 1008 788 56 -2217 -217 2413 3670 476 2723 1651 4565 -175 -540 130 1770 2120 591 323 501 804 358 458 -2888 638 -700 -540 -1977 900000 900000 -4534 900000 -493 -2516 900000 -2069 1795 -10701 900000 -7302 197 900000 -1533 -3473 -2271 900000 900000 900000 334 1415 -1314 -1214 -898 900000 -661 -498 -521 126 900000 -1443 211 1342 900000 -1554 1067 900000 2110 886 1078 1596 2403 2458 1962 487 2497 2633 2620 2983 1642 160 4142 4510 4677 4952 4985 4698 4335 2146 4438 2024 723 5262 -169 5790 -312 5266 4770 3082 4813 6992 640 5336 2335 1247 4858 1423 2240 -711 5770 -1024 3359 -1100 1614 -1505 -831 -1497 -366 -1659 -990 401 574 -443 -2367 -3167 -3015 -2272 -4894 -2241 -2678 -1202 2794 140 -775 -2710 1469 -1268 433 -3816 -5099 -1071 -3230 -15 -1151 2204 1434 1157 85 -3514 -331 3451 4998 647 3561 2129 5715 -240 -831 226 3378 4360 1302 756 1232 2048 933 1195 -7646 1597 -1677 -1209 -4303 SS 20201118T124932.0Z 7627.534398 71 1 50.04 2 80.54 126.02 118.93 99.70 0.00 1 0.00 1 0 25 7.176e-01 1.066e-02 1.445e-01 1.867e-03 8.822135e-01 1.053449e-03 9.904128e-03 -6.000000e+00 4.267812e-01 223.21 -2.00 3.51 -2.00 321.45 0.00e+00 5.651490e-03 5.629051e-04 4.635376e-03 -6.000000e+00 1.907592e-02 280.11 -2.00 20.00 -2.00 320.98 0.00e+00 5.794 0.003 302.00 328.00 3 -3.7032e-02 3.7091e-03 7.9687e-02 -6.0000e+00 1.0538e+00 1.6300e-01 5.6951e-03 6.2611e-02 -6.0000e+00 1.1505e+00 -1.7470e-01 6.3527e-03 2.6772e-02 -6.0000e+00 6.8396e-01 6.1549e-02 2.9206e-03 1.2102e-02 -6.0000e+00 2.8841e-01 6.9618e-04 -1.5240e-03 5.0065e-05 1.1253e-04 -6.0000e+00 2.1991e-02 1.4057e-02 1.8764e-05 12 8 8 10 0 0 20.45 22.87 0.25 0.01406 0.00261 216 41 1 5 0 229.500 25.79 20.00 22.87 6.18 25.5 916.79 -200562 900000 -327457 -151553 -230359 -219275 900000 -214071 -178784 -294496 -194725 -259012 -171348 900000 -122343 -129241 900000 900000 -10344 17081 -63684 -90210 -84882 -90392 -62642 90824 -53402 -61255 -83091 -15525 329 -24406 -52573 -2383 104794 -31702 -24044 22285 16471 -12513 -5419 -6373 2520 7859 14809 -6780 12905 10192 11062 5022 474 -1233 11908 13525 6589 8853 6964 7758 4315 5969 5518 2746 -119 6042 1809 7809 -227 5816 4749 829 1232 1854 -1375 1395 -184 262 3284 1409 435 -323 1790 -557 -749 -1737 -965 -1904 -1104 -1402 -667 -79 8 1082 1101 917 571 158 618 -701 -1011 -439 -187 394 1060 44 -1172 -1181 -994 -520 -29 -738 -874 -264 -85 -47 838 1097 1092 165 -324 -941 -305 149 292 39 -29 509 1730 932 -127 343 459 618 427 270 -556 -151 5 -300 -954 -6 -143 142 309 -588 900000 -4136 -341 -1048 -985 900000 -1168 -765 -4196 -1271 -3952 -1506 900000 -1175 -1633 900000 900000 -61 80 -688 -1240 -1192 -1480 -842 292 -737 -885 -1629 -198 5 -511 -1684 -49 774 -900 -722 513 493 -559 -255 -329 126 386 702 -417 693 609 721 391 42 -127 1201 1470 821 1130 925 1011 567 768 754 437 -22 1174 394 1639 -53 1389 1300 256 413 637 -475 435 -55 71 841 394 144 -125 803 -282 -420 -1053 -591 -1243 -747 -970 -453 -51 5 652 661 594 410 130 571 -755 -1149 -502 -200 389 984 41 -1146 -1176 -1049 -593 -36 -1005 -1300 -407 -136 -74 1300 1649 1648 262 -520 -1555 -490 235 438 56 -42 713 2358 1351 -204 595 868 1232 913 602 -1297 -359 13 -738 -2340 -13 -330 303 652 SS 20201118T130746.6Z 7627.547068 85 1 49.27 2 77.81 129.40 115.69 102.24 0.00 1 0.00 1 0 33 3.678e-01 7.711e-03 4.663e-02 8.854e-04 7.218527e-01 4.724554e-04 8.303937e-03 -6.000000e+00 2.145779e-01 223.21 -2.00 3.51 -2.00 320.62 0.00e+00 3.201929e-03 1.985442e-04 1.870736e-03 -6.000000e+00 9.577196e-03 280.10 -2.00 20.00 -2.00 320.08 0.00e+00 4.596 0.002 302.00 328.00 3 -9.2997e-02 1.4629e-03 5.9962e-02 -6.0000e+00 5.2758e-01 7.6113e-02 1.9384e-03 4.0610e-02 -6.0000e+00 5.7396e-01 -5.6205e-02 1.9620e-03 1.9538e-02 -6.0000e+00 3.4264e-01 1.1834e-02 9.6783e-04 7.5281e-03 -6.0000e+00 1.4587e-01 2.6708e-03 -1.1833e-03 2.4224e-05 7.6199e-05 -6.0000e+00 1.1032e-02 1.3480e-02 1.5479e-05 11 8 0 10 0 0 2.82 22.87 0.19 0.01348 0.00459 427 81 1 5 0 113.990 25.79 19.99 22.87 6.98 25.6 920.21 -147099 -13723 -169195 -85986 -141261 -130214 -89734 -133434 -85259 -144062 -79548 -120142 -35910 -53377 -32309 -54759 12458 -9984 -12617 -13202 -22760 -14619 -37660 -15546 -30868 5906 -25181 -15433 -29015 -10385 -1347 -5558 -8449 -9283 9458 -10632 -1168 -1274 1966 -4491 -862 -2293 -446 322 935 374 1814 3508 1977 2600 -218 2376 3029 3372 1188 2113 789 497 1587 862 3230 1025 1581 732 1344 2299 1254 2641 2098 538 -93 266 -928 185 53 737 750 1399 90 -158 69 -1543 -1182 -1812 -1179 -1247 -778 -748 -413 -98 558 831 1517 1342 746 637 516 -184 -653 -178 -328 445 833 -455 -1360 -911 -868 -370 22 -318 -438 -233 115 101 777 1099 975 392 -591 -932 -546 -161 -298 22 60 486 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