File name: Pandora55s1_QueensNY_20220412_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T115327.5Z 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_20220412_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: 20220412 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 20220412T145211.0Z 8137.619572 324 1 50.01 2 42.09 130.65 122.07 17.67 0.00 1 0.00 1 0 17 1.030e-02 6.916e-03 1.574e-03 9.994e-04 2.001169e-01 5.261765e-04 2.429779e-03 -6.000000e+00 6.110936e-03 228.37 -2.00 3.51 -2.00 315.27 0.00e+00 7.548669e-05 4.750389e-05 4.258818e-05 -6.000000e+00 2.673392e-04 280.05 -2.00 20.00 -2.00 314.68 0.00e+00 1.346 0.000 302.00 328.00 3 4.2525e+00 1.3535e-03 1.6974e-02 -6.0000e+00 1.5203e-02 2.0725e-02 1.5047e-03 1.0237e-02 -6.0000e+00 1.6484e-02 -2.9476e-03 8.5940e-04 5.0328e-03 -6.0000e+00 9.8081e-03 -9.8072e-04 3.7602e-04 1.4076e-03 -6.0000e+00 4.0969e-03 1.5654e-03 -7.6398e-05 3.0598e-05 2.0217e-05 -6.0000e+00 3.0758e-04 -2.3726e-03 1.4233e-04 11 9 0 11 8 0 99.85 22.35 0.36 -0.00237 -0.00295 32 6 1 5 0 1562.620 25.58 20.00 22.35 16.50 31.5 1090.12 -838 -1025 -3812 -4153 -1257 1934 -760 4049 475 -815 -1015 863 -318 331 1565 -660 -1782 -1140 1637 1344 1124 1244 1441 325 217 -300 887 -708 17 888 1244 1920 1231 -1816 -970 1981 6 464 815 -588 -1417 -933 -1530 -1284 -942 -552 -1351 -548 -468 448 475 385 771 882 1000 546 1304 584 836 808 1461 1252 1099 -41 -590 -550 61 301 1408 794 -119 -375 -549 -569 -279 -392 146 921 939 5 -329 -558 -1486 -957 -1403 -1007 -980 -503 -521 -564 -130 106 469 1285 1131 1241 863 572 -376 -628 -379 -340 131 799 163 -567 -292 -674 -83 195 -136 -480 -122 -285 -170 428 762 978 550 -72 -684 -221 137 -65 287 177 726 1297 628 347 437 57 346 136 194 -381 -132 106 -415 -326 -211 -331 -312 -167 -237 -311 -1200 -1266 -350 497 -203 1115 146 -264 -331 278 -109 122 623 -284 -800 -519 746 627 532 592 687 160 111 -157 462 -363 8 417 586 933 630 -965 -506 990 3 259 506 -406 -1054 -720 -1210 -1023 -748 -437 -1064 -421 -354 333 357 299 619 729 844 467 1127 508 724 694 1259 1108 1016 -40 -581 -531 56 265 1230 732 -117 -384 -572 -590 -282 -379 133 791 793 5 -308 -554 -1556 -1033 -1567 -1165 -1177 -619 -649 -700 -158 122 513 1338 1167 1319 969 679 -469 -802 -478 -414 153 917 192 -697 -370 -876 -109 266 -191 -687 -174 -398 -228 548 945 1208 698 -95 -936 -307 188 -89 382 229 912 1586 771 439 570 76 467 187 271 -549 -195 159 -631 -496 -319 -493 -456 -242 SS 20220412T150139.4Z 8137.626150 330 1 16.50 2 40.76 133.56 121.54 20.16 0.00 1 0.00 1 0 25 9.747e-03 6.929e-03 2.424e-03 1.585e-03 1.982536e-01 8.356352e-04 2.417728e-03 -6.000000e+00 5.781012e-03 228.37 -2.00 3.51 -2.00 315.14 0.00e+00 1.148023e-04 7.359429e-05 4.352894e-05 -6.000000e+00 2.529582e-04 280.05 -2.00 20.00 -2.00 314.57 0.00e+00 1.319 0.000 302.00 328.00 3 4.0192e+00 2.1467e-03 1.6714e-02 -6.0000e+00 1.4382e-02 2.7033e-02 2.3851e-03 1.0159e-02 -6.0000e+00 1.5596e-02 -5.3706e-03 1.3623e-03 4.9976e-03 -6.0000e+00 9.2792e-03 -9.8653e-04 5.9354e-04 1.3992e-03 -6.0000e+00 3.8749e-03 2.0340e-03 -4.6824e-04 4.8444e-05 2.0357e-05 -6.0000e+00 2.9107e-04 -1.7345e-03 9.0974e-05 12 9 1 12 1 1 86.53 22.33 0.25 -0.00173 -0.00525 12 8 1 5 0 1255.430 25.58 20.00 22.33 17.33 31.5 1094.44 -1125 -757 -1152 -4965 -2273 1245 -119 3452 -491 -1211 -446 1004 1005 259 1503 -710 -1210 -128 795 879 907 899 1160 687 286 -12 453 -725 -445 1055 1075 1588 1723 -1302 -1158 1552 73 389 1134 -1034 -1449 -969 -1329 -1227 -949 -441 -1508 -521 -826 949 763 579 53 923 601 421 1273 408 895 891 1621 1534 1005 38 -730 -504 -68 527 1336 825 153 -356 -907 -596 -629 -223 325 1028 1043 234 -167 -789 -1618 -1184 -1054 -830 -736 -520 -399 -488 -110 -67 558 1129 1433 1049 549 524 -297 -533 -184 -454 251 851 56 -698 -257 -865 -46 11 -19 -634 -254 -149 -265 620 701 983 464 -166 -675 -248 57 240 342 162 434 1265 793 559 439 -44 269 72 316 -398 -62 97 -331 -544 -126 -90 -451 -230 -336 -241 -372 -1602 -671 339 -33 1004 -159 -410 -151 338 354 99 621 -316 -559 -60 376 424 443 442 570 346 149 -6 243 -382 -224 509 519 792 898 -708 -620 796 38 222 715 -729 -1094 -758 -1062 -990 -764 -353 -1203 -406 -632 713 579 454 43 769 512 364 1108 358 780 772 1407 1367 935 36 -722 -488 -62 466 1175 764 151 -366 -950 -619 -638 -216 296 886 884 206 -157 -787 -1697 -1280 -1176 -958 -881 -639 -496 -604 -132 -77 610 1178 1476 1117 616 620 -369 -678 -231 -552 292 973 66 -856 -325 -1121 -61 15 -26 -903 -362 -208 -354 790 866 1210 586 -218 -918 -342 78 324 452 209 543 1540 968 701 570 -59 362 98 437 -568 -91 145 -498 -825 -189 -134 -655 -331 SS 20220412T150612.9Z 8137.629316 333 1 46.29 2 40.14 135.01 121.26 21.35 0.00 1 0.00 1 0 25 8.833e-03 6.818e-03 4.072e-04 2.751e-04 1.947737e-01 1.451164e-04 2.386787e-03 -6.000000e+00 5.240188e-03 228.37 -2.00 3.51 -2.00 315.00 0.00e+00 7.741924e-05 1.240941e-05 3.809467e-05 -6.000000e+00 2.292626e-04 280.05 -2.00 20.00 -2.00 314.43 0.00e+00 1.307 0.000 302.00 328.00 3 1.6957e+00 3.7235e-04 1.6518e-02 -6.0000e+00 1.3037e-02 1.7390e-02 4.1347e-04 1.0004e-02 -6.0000e+00 1.4136e-02 -4.9609e-03 2.3609e-04 4.9262e-03 -6.0000e+00 8.4107e-03 -5.7767e-04 1.0238e-04 1.3792e-03 -6.0000e+00 3.5129e-03 2.1247e-02 -2.0340e-04 8.4010e-06 2.0115e-05 -6.0000e+00 2.6378e-04 -2.3162e-03 1.2001e-04 11 8 0 10 0 0 99.65 22.33 0.21 -0.00232 -0.00384 486 92 1 5 0 95.240 25.58 20.00 22.33 17.68 31.5 1097.01 -1003 -1715 -3062 -3200 -1582 129 1070 1672 827 -614 -158 1108 1001 869 544 -324 -315 53 433 649 158 1133 1390 973 586 85 -778 -716 475 1490 1324 1858 1364 -1018 -682 296 559 794 533 -818 -1356 -1111 -1293 -1208 -948 -889 -1175 -910 -663 494 706 623 864 625 569 493 737 308 637 907 1442 1229 1095 207 -802 -214 -93 627 1358 848 96 -347 -624 -497 -759 -190 253 733 1359 323 92 -835 -1460 -1170 -1041 -1030 -800 -570 -521 -648 -115 208 456 1366 1429 1240 859 665 -439 -520 -363 -442 191 895 -11 -669 -345 -699 -158 -106 -170 -405 -298 -148 -22 631 783 843 637 -134 -584 -353 -211 -206 329 325 732 1421 931 398 394 -92 231 179 171 -318 -211 66 -478 -399 -197 -244 -213 -69 -312 -584 -1077 -1074 -475 38 316 539 278 -220 -57 394 379 344 241 -148 -151 26 218 316 79 562 689 499 317 48 -443 -390 239 749 667 925 726 -573 -373 154 299 452 341 -590 -1045 -869 -1046 -989 -774 -722 -941 -705 -519 375 542 482 704 535 482 428 648 273 558 784 1251 1117 1024 199 -801 -204 -85 554 1189 776 94 -353 -653 -514 -781 -187 233 640 1144 290 88 -824 -1514 -1282 -1159 -1182 -944 -705 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