File name: Pandora55s1_QueensNY_20211207_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T105107.3Z 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_20211207_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: 20211207 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 20211207T131449.6Z 8011.551962 76 1 50.12 2 80.26 131.59 115.83 101.54 0.00 1 0.00 1 0 25 5.297e-01 1.499e-02 1.542e-01 2.948e-03 7.149067e-01 1.629179e-03 8.124585e-03 -6.000000e+00 3.141494e-01 222.94 -2.00 3.51 -2.00 321.03 0.00e+00 6.318012e-03 7.516918e-04 2.212797e-03 -6.000000e+00 1.534172e-02 278.13 -2.00 20.00 -2.00 320.52 0.00e+00 5.646 0.003 302.00 328.00 3 1.2780e+00 5.2537e-03 6.8931e-02 -6.0000e+00 7.7173e-01 1.6877e-01 7.2416e-03 4.3558e-02 -6.0000e+00 8.4310e-01 -1.4692e-01 7.5347e-03 2.0099e-02 -6.0000e+00 4.9965e-01 4.9462e-02 3.6171e-03 9.6867e-03 -6.0000e+00 2.1107e-01 2.5169e-04 -2.3287e-03 8.4835e-05 8.9641e-05 -6.0000e+00 1.6347e-02 -2.3005e-03 -7.0830e-05 12 8 8 10 0 0 98.08 22.68 0.26 -0.00230 -0.01980 68 13 1 5 0 736.860 25.58 20.01 22.68 9.29 29.6 963.05 -128816 900000 900000 -242683 900000 900000 -114682 900000 -118635 -114380 -222335 -32405 -190236 -150363 900000 -47929 -134988 9422 900000 79456 211187 -14707 64037 -45314 -11788 -34099 900000 -7667 -41704 -75189 -10724 44660 22335 -33560 11121 201688 -7876 -10100 40081 21279 1291 11644 -11661 -3729 8033 26544 -3519 18475 13147 20762 8424 266 -844 20952 12874 6098 9488 3453 7285 1196 5839 13141 7479 -2190 8561 -2113 8011 -610 5304 840 -166 78 2920 -1340 4295 5 1572 4008 321 -288 -1186 1096 -1245 -1010 -3652 -1908 -2556 -1062 -1213 -1154 -1794 -299 414 1308 1390 1198 -1256 -273 -82 -1345 -347 -586 515 2194 333 -1096 -801 -1387 323 379 -40 -1691 -315 14 -62 269 1238 1670 270 -106 -824 -308 430 1065 -111 261 330 1379 746 -132 220 463 531 740 359 -477 -14 -17 -443 -712 -437 -307 108 167 -682 900000 900000 -5245 900000 900000 -710 900000 -944 -946 -5497 -150 -4929 -3510 900000 -681 -5071 103 900000 526 606 -252 533 -1122 -229 -867 900000 -158 -1194 -3141 -286 861 630 -1757 395 1172 -345 -512 1526 1147 95 864 -1144 -356 709 2037 -366 1636 1288 2033 1010 38 -136 3023 2142 1136 1777 690 1394 238 1118 2495 1672 -602 2347 -662 2286 -191 1664 306 -68 34 1265 -589 1694 2 541 1310 114 -117 -565 583 -752 -655 -2559 -1388 -1961 -834 -972 -916 -1384 -217 285 886 987 947 -1144 -278 -92 -1607 -411 -661 532 2120 328 -1140 -869 -1581 385 489 -56 -2597 -498 22 -97 405 1809 2452 411 -168 -1341 -497 671 1610 -164 377 466 1907 1076 -208 378 848 1020 1478 750 -1043 -32 -39 -1026 -1651 -987 -669 224 341 SS 20211207T132226.7Z 8011.557254 81 1 49.43 2 79.19 133.01 114.47 102.59 0.00 1 0.00 1 0 25 3.393e-01 1.118e-02 1.659e-01 1.862e-03 6.575426e-01 9.881026e-04 7.579858e-03 -6.000000e+00 1.970520e-01 222.94 -2.00 3.51 -2.00 320.61 0.00e+00 5.288503e-03 4.012301e-04 1.429548e-03 -6.000000e+00 8.844158e-03 278.13 -2.00 20.00 -2.00 320.08 0.00e+00 5.137 0.002 302.00 328.00 3 9.8196e-01 3.0199e-03 6.1981e-02 -6.0000e+00 4.8450e-01 1.2902e-01 3.9071e-03 3.7119e-02 -6.0000e+00 5.2767e-01 -1.0563e-01 3.8524e-03 1.7836e-02 -6.0000e+00 3.1510e-01 3.3890e-02 1.9144e-03 8.0281e-03 -6.0000e+00 1.3324e-01 5.8461e-04 -2.0892e-03 5.3052e-05 7.6879e-05 -6.0000e+00 1.0130e-02 -1.3803e-03 -7.0631e-05 12 8 8 10 0 0 99.45 22.68 0.26 -0.00138 -0.01708 116 22 1 5 0 426.040 25.58 19.99 22.68 9.71 29.7 965.39 67739 -9198 900000 -176365 112879 -91691 -54566 103639 -33762 -97409 -133156 -36473 -112097 -65885 61251 -27820 -73229 -114703 35360 35651 -735 -12142 5868 -23962 -12101 -29465 84070 -19904 -4535 -45327 3840 2470 8157 -15923 -3500 35467 -6153 83 7925 6611 -5729 1369 -6577 1153 662 7818 -2314 5636 6584 8119 7323 1706 3175 8329 7639 2477 4784 877 4144 955 2173 5618 2965 1428 2055 -87 3478 1526 2383 2349 -228 -146 485 -1700 1135 -615 1489 1495 931 -482 -272 -287 -1273 -1692 -2456 -1358 -2018 -966 -1496 -319 -739 372 379 1441 898 691 219 248 -36 -852 -93 -560 541 1074 -22 -1186 -696 -1237 38 339 -123 -745 -66 -26 -162 887 792 1389 271 -341 -659 -478 61 204 -30 286 738 1494 873 -267 325 140 449 678 368 -421 -212 -38 -656 -621 -421 73 98 227 123 -34 900000 -3598 205 -775 -337 188 -212 -1218 -2506 -308 -2378 -1167 412 -533 -2469 -6344 531 570 -17 -319 134 -764 -372 -1124 1149 -716 -143 -2194 135 105 384 -1028 -206 1442 -383 6 586 586 -648 159 -874 149 88 1000 -333 780 946 1223 1204 326 658 1793 1768 627 1229 235 1071 250 567 1507 900 490 760 -34 1299 583 950 1034 -113 -77 261 -910 563 -287 632 615 402 -235 -152 -181 -891 -1271 -1952 -1124 -1756 -865 -1367 -286 -645 306 298 1107 722 609 217 273 -43 -1083 -117 -672 603 1134 -23 -1339 -818 -1518 49 464 -182 -1178 -107 -43 -259 1363 1190 2085 421 -553 -1092 -790 99 320 -47 426 1071 2126 1290 -428 559 257 856 1335 754 -899 -466 -85 -1484 -1402 -931 154 201 458 SS 20211207T132849.0Z 8011.561678 84 1 48.42 2 78.32 134.22 113.35 103.47 0.00 1 0.00 1 0 25 2.049e-01 7.093e-03 5.357e-02 1.124e-03 6.178360e-01 5.882363e-04 7.243648e-03 -6.000000e+00 1.189823e-01 222.94 -2.00 3.51 -2.00 320.25 0.00e+00 2.560308e-03 2.130823e-04 1.571041e-03 -6.000000e+00 5.272636e-03 278.13 -2.00 20.00 -2.00 319.69 0.00e+00 4.783 0.002 302.00 328.00 3 4.2893e-01 1.7327e-03 5.7667e-02 -6.0000e+00 2.9254e-01 8.0890e-02 2.1731e-03 3.4137e-02 -6.0000e+00 3.1862e-01 -4.3848e-02 2.0670e-03 1.6336e-02 -6.0000e+00 1.9014e-01 6.4810e-03 1.0508e-03 5.4763e-03 -6.0000e+00 8.0095e-02 1.5010e-03 -2.0298e-03 3.2285e-05 6.2018e-05 -6.0000e+00 6.1090e-03 -1.2382e-03 -7.0869e-05 11 8 0 10 0 0 89.77 22.69 0.22 -0.00124 -0.01649 234 44 1 5 0 206.880 25.58 19.99 22.69 9.99 29.7 967.21 -77389 -34244 79545 -91718 -28591 -84827 -51279 -9863 -40380 -62443 -75645 -49166 -61761 -48850 -8794 -20063 -32775 -44173 10179 7621 -7637 -3754 -4595 -8554 -8361 -9750 11550 -11683 -8797 -17879 652 -1983 -31 -9464 1780 6674 -4230 67 1548 901 -2320 -668 -4312 -1597 -1184 2742 -2357 1505 2055 3410 2154 980 1594 3176 2789 685 1887 -705 1404 -52 1744 2585 1933 224 413 437 1477 1129 1657 1218 269 -420 -313 -1080 -233 -234 698 1243 1526 -233 -72 -526 -1414 -1557 -1661 -1263 -1085 -558 -669 -519 -12 799 732 1884 1472 1243 717 565 -224 -618 -272 -418 478 1119 -59 -1131 -608 -849 -91 134 -17 -705 -214 -108 12 800 1054 1072 293 -482 -926 -513 -130 -296 74 51 505 1326 864 -57 324 -77 382 325 232 -368 -100 84 -473 -498 -219 -22 147 250 -643 -222 198 -1173 -185 -938 -426 -61 -387 -821 -1223 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