File name: Pandora55s1_QueensNY_20220217_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T113040.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220217_L1_smca1c19d20211111p1-8.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: 20220217 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20220217T125652.5Z 8083.539497 280 1 50.20 2 78.40 117.01 94.06 289.90 0.00 1 0.00 1 0 17 5.014e-01 1.705e-02 1.473e-01 3.349e-03 5.791408e-01 1.801248e-03 6.618796e-03 -6.000000e+00 2.990535e-01 224.99 -2.00 3.51 -2.00 320.40 0.00e+00 4.498831e-03 6.598477e-04 5.406363e-04 -6.000000e+00 1.356618e-02 275.45 -2.00 20.00 -2.00 319.87 0.00e+00 4.812 0.002 302.00 328.00 3 2.5279e+00 5.3403e-03 5.6486e-02 -6.0000e+00 7.4083e-01 1.1857e-01 6.6754e-03 3.1149e-02 -6.0000e+00 8.0776e-01 -1.3282e-01 6.2371e-03 1.5828e-02 -6.0000e+00 4.7488e-01 5.2663e-02 3.1449e-03 6.7262e-03 -6.0000e+00 1.9783e-01 1.8815e-04 -1.6227e-03 1.0165e-04 7.0224e-05 -6.0000e+00 1.5521e-02 1.6967e-04 -6.1714e-05 12 9 8 11 8 0 95.19 22.69 0.26 0.00017 -0.01202 30 6 1 5 0 1672.920 25.58 20.00 22.69 15.73 30.9 1071.45 -30182 130735 900000 -172866 900000 900000 -103796 900000 900000 -101803 -138857 -22863 -111639 -43331 900000 29463 -71003 -23797 151501 113087 147302 -12500 43510 -48745 -6112 -33421 370411 -22287 -22463 -47307 7700 21058 2752 -15567 9126 108014 -8751 -3354 19046 25852 -9680 13504 -11930 -264 6232 24189 -3529 18000 12901 11963 6535 -2047 -2667 10465 14681 2893 12700 5529 8111 1484 2033 9542 1714 -1825 5047 -2562 3890 -2440 1190 2782 -3766 -626 3540 -3069 5950 -2145 3038 4324 2 229 -2579 1324 -687 -1016 -3361 -592 -2993 -246 -2616 -376 -1803 -1107 402 240 -195 -822 67 -596 -236 -971 -26 -905 781 1574 745 -423 -1154 -910 -30 1607 428 -1555 163 -73 -769 208 952 1644 3 -406 -930 -204 1012 1541 324 171 485 1075 -198 -339 844 508 528 1053 134 -290 113 9 -349 -694 -429 -367 -26 -429 -238 427 900000 -6597 900000 900000 -1963 900000 900000 -2478 -5033 -308 -4107 -1059 900000 537 -3718 -887 1174 1338 1299 -500 1055 -2927 -264 -1957 1209 -1194 -1196 -3289 360 1012 181 -1314 620 2887 -721 -297 1637 2455 -1444 1776 -2084 -43 979 3289 -630 2703 2092 2057 1266 -469 -673 2520 3622 825 3435 1606 2284 438 602 2786 592 -718 2008 -1109 1562 -1029 507 1291 -2040 -352 1957 -1762 2999 -1078 1349 1830 1 115 -1516 848 -490 -774 -2747 -499 -2692 -224 -2474 -347 -1630 -948 323 189 -159 -735 67 -657 -281 -1221 -32 -1075 857 1647 796 -478 -1367 -1121 -39 2179 629 -2452 262 -116 -1203 312 1382 2391 4 -641 -1510 -330 1591 2360 489 252 695 1506 -288 -529 1407 896 970 1988 263 -594 240 19 -760 -1512 -917 -757 -51 -844 SS 20220217T130221.7Z 8083.543307 283 1 50.18 2 77.47 118.00 95.02 290.78 0.00 1 0.00 1 0 25 2.266e-01 8.971e-03 7.587e-02 2.119e-03 5.545245e-01 1.115750e-03 6.416145e-03 -6.000000e+00 1.335065e-01 224.99 -2.00 3.51 -2.00 320.11 0.00e+00 2.131429e-03 3.774822e-04 9.689965e-04 -6.000000e+00 5.842612e-03 275.45 -2.00 20.00 -2.00 319.58 0.00e+00 4.483 0.002 302.00 328.00 3 2.0306e+00 3.2402e-03 5.3111e-02 -6.0000e+00 3.3051e-01 5.3239e-02 3.9732e-03 2.9872e-02 -6.0000e+00 3.5987e-01 -3.7203e-02 3.6484e-03 1.4648e-02 -6.0000e+00 2.1330e-01 6.8471e-03 1.8701e-03 4.8232e-03 -6.0000e+00 8.9179e-02 4.4001e-04 -1.5620e-03 6.3722e-05 5.5062e-05 -6.0000e+00 6.8724e-03 3.9226e-04 -6.4438e-05 11 8 0 10 0 0 79.36 22.69 0.28 0.00039 -0.01135 69 13 1 5 0 727.090 25.58 19.99 22.69 15.94 31.0 1073.15 -47855 34962 900000 -109696 -9572 66224 -72157 900000 18226 -86346 -87276 -55797 -46122 -45164 110932 -3428 -43455 -24384 16056 36237 23264 -2709 3662 -22000 -11211 -7007 35547 -6222 -16826 -24066 -3850 6618 1617 -15052 3334 27776 -2040 -5033 9861 5379 -3069 -1061 -6325 -3158 -1825 9104 -3965 5335 2904 4624 918 1252 -1988 5892 5877 1653 6081 672 3486 -537 1690 3973 1959 -1945 1651 -1273 1236 -712 1294 1024 -1635 -399 99 -1520 1018 -353 1162 2192 157 53 -1504 427 -622 -1003 -1717 -1045 -1465 -625 -866 -546 -514 156 437 1250 654 1054 135 518 -98 -524 -248 -410 691 1203 149 -697 -440 -415 112 413 346 -994 -104 -158 -303 424 544 1357 217 -307 -798 -221 -9 394 -41 -16 282 1041 484 -325 369 -180 446 313 225 -493 92 283 -441 -387 -120 -114 -31 68 -474 185 900000 -2477 -80 259 -1117 900000 152 -2086 -2269 -1189 -1063 -1275 885 -95 -1967 -1015 497 986 740 -112 147 -1193 -593 -379 1335 -341 -1003 -1575 -232 419 123 -1443 273 1798 -182 -527 1074 721 -504 -187 -1231 -620 -359 1660 -823 1041 594 974 214 319 -569 1691 1794 546 1999 235 1180 -185 578 1397 769 -867 761 -611 567 -330 616 536 -962 -248 62 -955 596 -195 588 1056 79 30 -958 298 -479 -823 -1489 -946 -1394 -612 -861 -538 -492 142 376 1045 566 985 140 590 -121 -677 -318 -502 787 1316 167 -820 -538 -527 149 580 519 -1584 -169 -256 -476 640 802 1999 330 -488 -1304 -360 -14 615 -62 -23 409 1477 706 -508 614 -317 810 585 437 -999 192 598 -946 -828 -252 -232 -62 133 SS 20220217T130824.5Z 8083.547506 286 1 49.97 2 76.47 119.12 96.06 291.75 0.00 1 0.00 1 0 25 2.485e-01 7.497e-03 9.349e-02 1.681e-03 5.180885e-01 8.726845e-04 6.040991e-03 -6.000000e+00 1.454241e-01 224.99 -2.00 3.51 -2.00 319.79 0.00e+00 1.714244e-03 2.658768e-04 6.598372e-04 -6.000000e+00 6.326359e-03 275.45 -2.00 20.00 -2.00 319.24 0.00e+00 4.172 0.001 302.00 328.00 3 1.9457e+00 2.4799e-03 4.9315e-02 -6.0000e+00 3.5952e-01 3.8720e-02 2.9646e-03 2.7326e-02 -6.0000e+00 3.9122e-01 -2.5869e-02 2.5630e-03 1.3507e-02 -6.0000e+00 2.3274e-01 2.7180e-03 1.3327e-03 4.2411e-03 -6.0000e+00 9.7364e-02 6.7289e-04 -1.4172e-03 5.0427e-05 4.9826e-05 -6.0000e+00 7.4143e-03 -1.8879e-05 -5.7351e-05 11 8 0 10 0 0 98.71 22.69 0.19 -0.00002 -0.01067 91 17 1 5 0 549.020 25.58 19.99 22.69 16.23 31.0 1074.60 -49761 27554 235409 -66096 -25976 41 -61263 65364 -8748 -44943 -54839 -35587 -37157 -28540 39176 -2234 -22469 -24936 9827 11696 9758 -1884 2712 -9083 -5168 -9450 12891 -8325 -9489 -13454 2064 4981 1072 -10872 -435 14916 -1880 -3297 7219 2501 -3245 354 -4738 -1578 -716 4308 -3382 2324 922 3371 1105 1226 -936 2771 3087 943 2763 7 2098 180 1053 2518 1836 -434 1084 -429 1349 -286 1449 1373 -689 -494 -21 -587 407 -398 609 2212 658 -313 -811 -493 -1109 -1403 -1599 -1095 -1035 -809 -873 -377 -68 428 773 1368 1112 1086 483 756 -243 -494 -295 -524 325 964 127 -654 -509 -1012 -43 151 137 -645 -139 -131 -177 413 948 1187 327 -184 -841 -259 -56 51 134 -256 413 1466 400 -65 427 -18 395 114 181 -236 3 -3 -426 -454 -157 -122 71 141 -764 240 386 -1467 -379 0 -1261 462 -139 -1079 -1528 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