File name: Pandora55s1_QueensNY_20220223_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T112954.2Z 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_20220223_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: 20220223 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 20220223T160816.8Z 8089.672416 386 1 49.75 2 52.29 161.08 99.04 249.26 0.00 1 0.00 1 0 25 1.199e-02 6.854e-03 2.237e-03 1.233e-03 2.103361e-01 6.395456e-04 2.553187e-03 -6.000000e+00 7.035312e-03 225.28 -2.00 3.51 -2.00 315.80 0.00e+00 -1.017053e-04 6.406492e-05 3.593067e-05 -6.000000e+00 3.058710e-04 275.84 -2.00 20.00 -2.00 315.25 0.00e+00 1.631 0.000 302.00 328.00 3 4.3151e+00 1.6447e-03 1.9377e-02 -6.0000e+00 1.7403e-02 2.8101e-02 1.8361e-03 1.0629e-02 -6.0000e+00 1.8920e-02 -4.1634e-03 1.0545e-03 5.2628e-03 -6.0000e+00 1.1257e-02 -1.1662e-03 4.7400e-04 1.4923e-03 -6.0000e+00 4.7162e-03 1.1058e-03 2.6439e-05 3.7924e-05 2.0619e-05 -6.0000e+00 3.5759e-04 -6.2162e-03 1.6990e-04 11 8 0 10 0 0 99.95 22.70 0.34 -0.00622 -0.00602 48 9 1 5 0 1036.190 25.58 20.00 22.70 23.26 31.7 1100.00 -920 -1277 1376 -6760 -1521 1892 -1195 4739 1880 -1410 -1792 630 -1255 -806 3693 -407 -2214 -1451 1517 1757 1305 465 1186 -569 172 -264 1134 -732 -308 324 824 2220 1012 -2770 -722 2047 -6 -179 1391 -381 -1626 -756 -1786 -1148 -1004 -227 -1403 -267 -518 644 429 60 415 1181 1307 532 1557 528 1330 400 1477 1652 1184 18 -325 -735 -166 50 1030 991 -249 -424 -281 -321 -26 -178 309 1235 993 -178 -536 -384 -1335 -1227 -1282 -1030 -814 -493 -565 -273 -192 50 170 920 998 1185 547 496 -435 -485 -352 -382 106 951 193 -661 -364 -641 53 301 127 -599 -151 -281 -173 356 710 1042 451 -50 -676 -194 -111 306 161 128 391 1277 614 78 420 -57 318 160 331 -296 154 117 -248 -354 -239 -285 -361 -241 -208 -312 337 -1711 -341 389 -256 1046 464 -376 -483 167 -358 -251 1219 -150 -858 -573 599 710 538 194 493 -247 77 -123 523 -333 -133 134 341 949 460 -1332 -338 911 -3 -91 786 -243 -1131 -546 -1331 -860 -752 -169 -1041 -193 -368 450 304 44 317 928 1052 438 1293 442 1103 331 1225 1407 1057 17 -311 -693 -148 43 874 887 -239 -427 -289 -327 -26 -168 274 1026 813 -153 -493 -375 -1384 -1318 -1426 -1191 -979 -610 -709 -341 -233 58 186 957 1025 1256 615 593 -549 -628 -452 -472 126 1097 228 -819 -467 -846 72 417 182 -879 -222 -403 -238 466 898 1312 584 -68 -948 -276 -157 426 219 170 502 1590 768 101 561 -78 443 226 476 -440 236 182 -390 -561 -374 -440 -546 -362 SS 20220223T161234.4Z 8089.675398 389 1 1.56 2 52.04 162.38 99.78 249.88 0.00 1 0.00 1 0 25 1.259e-02 8.053e-03 6.523e-03 4.074e-03 2.115715e-01 2.124252e-03 2.625461e-03 -6.000000e+00 7.381343e-03 225.28 -2.00 3.51 -2.00 315.36 0.00e+00 -1.967472e-04 1.934927e-04 2.405518e-05 -6.000000e+00 3.212043e-04 275.84 -2.00 20.00 -2.00 314.83 0.00e+00 1.622 0.000 302.00 328.00 3 2.8609e+00 5.4353e-03 1.9394e-02 -6.0000e+00 1.8258e-02 2.7763e-02 6.0563e-03 1.0806e-02 -6.0000e+00 1.9859e-02 -8.7893e-03 3.4675e-03 5.3603e-03 -6.0000e+00 1.1814e-02 -2.9665e-04 1.5291e-03 1.5226e-03 -6.0000e+00 4.9443e-03 4.7778e-03 -1.1261e-03 1.2489e-04 2.2169e-05 -6.0000e+00 3.7576e-04 -3.6074e-03 -5.1376e-05 12 9 1 12 1 1 999.00 22.70 0.30 -0.00361 -0.01207 2 20 1 5 0 462.250 25.58 20.00 22.70 23.47 31.7 1100.00 335 -5446 49 -5630 793 -2035 2278 3085 -418 1032 -2943 1400 -2112 2070 -2627 672 -1415 233 1787 1002 868 -270 2698 337 971 -554 756 264 -54 1018 2430 1372 999 -1464 -76 1793 -1440 2605 919 -32 -2023 -1035 -1605 -1675 -984 -174 -1381 -797 -1003 -330 690 448 1218 1039 1024 225 1395 719 628 695 1567 1428 577 668 -480 108 -769 985 1230 487 434 -176 -30 -1351 -108 -387 -237 454 1324 -234 -873 -849 -1717 -1270 -894 -1259 -950 -56 -341 -802 -23 258 -81 686 1595 865 1430 650 -87 -291 -422 -979 -237 655 22 -591 -613 -429 -57 10 -294 -136 -358 225 -83 1025 601 825 445 -360 -795 -430 -349 -96 818 654 964 1717 1454 231 147 -137 176 121 42 106 -411 -23 -183 -445 -799 108 -289 -300 91 -1655 14 -1688 212 -528 579 838 -126 322 -952 441 -717 739 -1055 280 -620 103 798 460 404 -127 1250 162 483 -286 388 133 -26 472 1120 661 506 -770 -39 890 -744 1418 563 -21 -1484 -786 -1246 -1313 -768 -135 -1069 -605 -749 -244 512 343 963 846 854 191 1194 620 539 591 1336 1248 528 634 -465 103 -703 859 1073 447 422 -179 -31 -1397 -108 -373 -215 391 1115 -205 -817 -842 -1796 -1368 -992 -1452 -1132 -68 -422 -991 -27 298 -88 717 1643 924 1599 771 -108 -371 -534 -1198 -279 754 26 -725 -777 -557 -76 14 -413 -195 -514 315 -112 1318 752 1029 569 -480 -1095 -600 -485 -131 1092 851 1221 2113 1793 294 194 -185 241 167 60 154 -614 -35 -280 -686 -1223 163 -427 -440 SS 20220223T164207.2Z 8089.695917 401 1 48.87 2 50.77 171.56 104.94 254.12 0.00 1 0.00 1 0 25 8.744e-03 6.417e-03 1.014e-03 6.069e-04 2.029558e-01 3.158006e-04 2.485335e-03 -6.000000e+00 5.130367e-03 225.28 -2.00 3.51 -2.00 315.51 0.00e+00 2.780126e-05 2.975081e-05 3.658381e-05 -6.000000e+00 2.230938e-04 275.84 -2.00 20.00 -2.00 314.98 0.00e+00 1.578 0.000 302.00 328.00 3 3.0099e+00 8.0965e-04 1.8747e-02 -6.0000e+00 1.2690e-02 2.2930e-02 9.0285e-04 1.0294e-02 -6.0000e+00 1.3798e-02 -5.3461e-03 5.1717e-04 5.0998e-03 -6.0000e+00 8.2092e-03 -7.5223e-04 2.2939e-04 1.4467e-03 -6.0000e+00 3.4388e-03 4.3668e-03 -1.1450e-04 1.8638e-05 2.0518e-05 -6.0000e+00 2.6084e-04 -5.9674e-03 1.3141e-04 11 9 0 11 8 0 99.95 22.70 0.20 -0.00597 -0.00683 184 35 1 5 0 265.530 25.58 20.01 22.70 23.90 31.7 1100.00 -972 -1861 -2157 -4209 -1425 18 400 1809 910 -768 -492 499 729 676 918 -468 -798 -81 737 931 314 951 1296 782 594 114 -375 -817 275 1004 1326 1852 1397 -1299 -515 657 489 458 827 -496 -1404 -899 -1481 -1270 -941 -605 -1297 -684 -716 423 389 509 814 875 648 639 869 380 722 905 1547 1373 1219 113 -727 -366 -102 287 1271 905 74 -280 -484 -467 -572 -278 246 770 1315 258 -114 -882 -1397 -1117 -1122 -941 -814 -434 -503 -602 -173 117 427 1225 1176 1165 705 642 -370 -523 -341 -441 111 931 73 -618 -233 -682 -96 -68 -135 -430 -246 -167 -80 637 735 816 596 -92 -516 -242 -166 -147 370 202 695 1318 753 292 393 -67 200 133 179 -360 -118 139 -419 -391 -245 -173 -283 -44 -250 -517 -615 -1182 -362 4 96 464 256 -227 -146 149 227 230 340 -188 -332 -35 317 411 141 426 581 360 285 56 -187 -399 126 445 586 852 676 -657 -255 315 239 243 492 -330 -1014 -674 -1137 -980 -724 -465 -988 -511 -526 307 284 385 636 706 535 537 740 325 613 764 1309 1191 1105 107 -708 -348 -92 249 1091 822 72 -285 -501 -481 -575 -266 220 652 1090 223 -105 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