File name: Pandora55s1_QueensNY_20200804_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T162018.0Z 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_20200804_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: 20200804 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 20200804T194925.1Z 7521.825985 3701 1 4.15 2 43.23 249.22 147.06 52.16 0.00 1 0.00 1 0 25 9.872e-03 7.479e-03 2.540e-03 1.824e-03 1.721592e-01 9.858513e-04 2.099247e-03 -6.000000e+00 5.964774e-03 232.14 -2.00 3.51 -2.00 314.76 0.00e+00 1.032944e-04 8.199273e-05 3.830941e-05 -6.000000e+00 2.681482e-04 290.07 -2.00 20.00 -2.00 314.07 0.00e+00 1.371 0.000 302.00 328.00 3 2.7790e+00 2.5403e-03 1.6437e-02 -6.0000e+00 1.4927e-02 1.5676e-02 2.8035e-03 9.0291e-03 -6.0000e+00 1.6097e-02 1.7030e-03 1.6028e-03 4.3725e-03 -6.0000e+00 9.5989e-03 -1.4602e-03 6.9521e-04 1.2064e-03 -6.0000e+00 4.0579e-03 7.1066e-03 1.3879e-04 5.6089e-05 1.8229e-05 -6.0000e+00 2.9699e-04 4.7142e-03 1.1380e-04 12 9 1 12 1 1 99.84 23.06 0.21 0.00471 0.00576 9 24 1 5 0 397.660 25.90 20.02 23.06 29.66 26.1 1038.49 -1405 -2389 -4566 -1334 -63 1660 1033 2093 -1176 58 857 1529 1224 615 -127 -601 102 -44 771 -277 1357 942 1589 671 -186 -1141 -988 959 1107 2486 1139 2098 -1397 -958 512 855 -19 820 -820 -1663 -1011 -1527 -1097 -1189 -418 -1268 -810 -1043 387 894 729 539 649 725 599 841 211 645 597 1527 1235 1045 248 -684 -99 -140 673 1434 1123 45 -162 -999 -583 -1041 122 62 663 1626 691 193 -671 -1375 -1150 -794 -866 -680 -688 -621 -636 -576 311 233 1208 1300 1834 448 586 -522 -771 -632 -274 133 1059 538 -701 -178 -952 -218 -153 86 -401 -501 -239 -44 519 716 1103 449 57 -486 -421 -120 -77 20 402 441 1367 1141 148 675 -62 312 -50 635 -130 -151 92 -422 -620 -115 -304 -497 -69 -522 -915 -1734 -465 -21 533 352 764 -459 23 330 607 520 282 -62 -304 52 -23 406 -149 727 506 865 377 -108 -670 -568 523 582 1283 608 1156 -806 -547 282 473 -11 535 -593 -1294 -818 -1262 -916 -993 -347 -1047 -657 -830 302 695 582 445 550 628 526 746 189 575 528 1350 1116 981 242 -684 -97 -132 603 1265 1031 44 -165 -1047 -611 -1070 121 57 583 1385 604 179 -661 -1426 -1232 -874 -988 -803 -837 -769 -786 -698 362 257 1263 1331 1914 492 678 -636 -967 -787 -331 154 1198 621 -846 -221 -1218 -284 -203 117 -559 -703 -328 -59 653 869 1329 554 73 -646 -569 -162 -104 26 513 547 1644 1365 182 854 -80 410 -66 854 -180 -215 134 -620 -917 -168 -441 -709 -97 SS 20200804T195409.2Z 7521.829273 3705 1 50.41 2 44.07 250.32 146.37 53.67 0.00 1 0.00 1 0 17 1.063e-02 7.162e-03 2.052e-03 1.274e-03 1.715680e-01 6.855777e-04 2.065060e-03 -6.000000e+00 6.464007e-03 232.14 -2.00 3.51 -2.00 315.43 0.00e+00 -2.797137e-04 6.488283e-05 4.110314e-05 -6.000000e+00 2.888641e-04 290.07 -2.00 20.00 -2.00 314.68 0.00e+00 1.390 0.000 302.00 328.00 3 4.6060e+00 1.7778e-03 1.6566e-02 -6.0000e+00 1.6180e-02 -5.6320e-02 1.9635e-03 8.9809e-03 -6.0000e+00 1.7405e-02 1.0595e-02 1.1237e-03 4.3373e-03 -6.0000e+00 1.0379e-02 -4.3395e-03 5.0215e-04 1.2096e-03 -6.0000e+00 4.4283e-03 1.1507e-03 7.2605e-04 3.9230e-05 1.6896e-05 -6.0000e+00 3.1916e-04 -6.4080e-02 -5.5053e-04 11 8 0 10 0 0 95.28 23.06 0.37 -0.06408 -0.05862 30 6 1 5 0 1679.770 25.90 19.98 23.06 29.86 26.1 1040.28 1304 2358 -4981 -1546 -465 -2724 3060 1359 703 -306 -80 -2079 -429 1916 198 -2277 -509 1613 1023 956 -28 1201 312 -653 -33 2558 -320 -100 542 58 733 506 -720 -297 904 -1811 -3389 -768 30 -1254 -376 -1799 -1174 -402 2 -1033 -295 -341 -488 -709 581 677 2014 1901 980 1043 1252 865 470 858 623 822 594 1336 734 334 -1232 -273 -248 377 20 286 -12 392 337 116 70 -732 -1801 -546 -77 -944 -1151 -2423 -1365 -898 82 -31 499 385 155 460 -389 -448 462 198 474 453 436 767 -367 -929 -487 -367 -292 -130 -713 -136 -315 460 334 778 553 -119 -459 -726 -388 257 -263 -67 526 307 116 199 402 171 66 -551 30 972 907 284 -472 19 -121 518 432 22 -490 352 -292 -276 -1005 366 683 -1515 -430 -119 -696 787 388 215 -96 -25 -676 -148 705 80 -975 -220 698 455 434 -13 552 146 -319 -17 1285 -162 -48 249 26 336 243 -360 -149 436 -887 -1780 -440 19 -884 -279 -1387 -915 -312 1 -800 -224 -254 -356 -518 430 519 1586 1541 814 879 1062 736 399 726 537 736 555 1280 704 307 -1089 -233 -219 352 20 291 -13 396 329 107 61 -614 -1529 -487 -73 -951 -1210 -2654 -1540 -1053 99 -39 619 472 184 517 -416 -463 480 216 544 549 549 969 -456 -1111 -564 -428 -353 -163 -925 -181 -428 640 477 1121 787 -164 -606 -922 -484 323 -344 -91 733 431 162 273 535 222 84 -688 37 1261 1212 388 -654 27 -174 766 654 34 -763 546 -449 -417 -1507 SS 20200804T195622.3Z 7521.830814 3707 1 50.61 2 44.46 250.82 146.04 54.37 0.00 1 0.00 1 0 17 1.113e-02 7.548e-03 2.073e-03 1.284e-03 1.721922e-01 6.912003e-04 2.077352e-03 -6.000000e+00 6.768739e-03 232.14 -2.00 3.51 -2.00 315.44 0.00e+00 -3.490110e-04 6.552248e-05 3.612698e-05 -6.000000e+00 3.025529e-04 290.07 -2.00 20.00 -2.00 314.69 0.00e+00 1.399 0.000 302.00 328.00 3 4.6171e+00 1.7926e-03 1.6667e-02 -6.0000e+00 1.6943e-02 -5.7522e-02 1.9799e-03 9.0297e-03 -6.0000e+00 1.8228e-02 1.1296e-02 1.1334e-03 4.3597e-03 -6.0000e+00 1.0869e-02 -4.3201e-03 5.0663e-04 1.2241e-03 -6.0000e+00 4.6357e-03 1.1269e-03 2.9275e-04 3.9550e-05 1.7040e-05 -6.0000e+00 3.3436e-04 -6.4047e-02 -6.5418e-04 11 8 0 10 0 0 99.50 23.06 0.24 -0.06405 -0.06185 29 5 1 5 0 1744.860 25.90 20.02 23.06 30.13 26.2 1042.26 883 2583 -4841 -983 -1890 -2155 2196 2443 99 -389 -1026 -2795 -475 1851 618 -2267 2475 930 735 187 112 997 -53 -1162 504 2600 112 533 -125 475 -169 878 -562 142 400 -2582 -3377 -686 4 -1321 -190 -1944 -1483 -736 351 -1010 -234 -906 44 -184 483 961 2043 2138 886 1246 1008 1056 541 950 957 825 450 1063 827 180 -1326 -427 -351 501 319 276 -197 382 378 201 105 -513 -1647 -296 -1320 -1021 -1140 -2505 -1427 -868 127 -22 122 350 488 434 -292 -619 400 187 789 414 716 950 -262 -1120 -869 -441 -134 176 -705 -153 -194 454 404 615 522 -119 -481 -676 -108 -110 -243 -54 595 354 111 -86 464 235 118 -520 -65 1193 800 281 -649 -10 -109 346 339 -91 177 362 -296 -591 -940 248 743 -1462 -271 -487 -546 566 688 30 -122 -322 -911 -163 680 247 -966 1041 403 327 85 52 457 -25 -568 252 1304 56 256 -58 213 -78 420 -281 71 193 -1267 -1770 -393 2 -930 -141 -1497 -1156 -573 271 -782 -177 -676 32 -134 357 736 1606 1727 736 1047 856 898 458 803 822 738 422 1018 792 166 -1172 -366 -309 468 314 281 -203 386 370 186 91 -430 -1396 -263 -1261 -1030 -1199 -2743 -1612 -1019 154 -27 152 429 578 487 -312 -640 416 203 906 502 900 1198 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