File name: Pandora180s1_BronxNY_20211020_L2Fit_fout2c2d20210302p1-8.txt File generation date: 20260323T072919.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 180 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora180_OF_v2d20201002.txt Instrument calibration file used: Pandora180s1_CF_v2d20210302.txt Level 1 file used: Pandora180s1_BronxNY_20211020_L1_smca1c2d20210302p1-8.txt Full location name: New York Botanical Garden NYSDEC (USEPA AQS ID 36-005-0133) Short location name: BronxNY Country of location: USA Location latitude [deg]: 40.8679 Location longitude [deg]: -73.8781 Location altitude [m]: 31 Local noon date: 20211020 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0771 305.2181 305.3590 305.5000 305.6409 305.7819 305.9228 306.0637 306.2046 306.3455 306.4864 306.6273 306.7681 306.9090 307.0498 307.1906 307.3315 307.4723 307.6131 307.7539 307.8946 308.0354 308.1762 308.3169 308.4577 308.5984 308.7391 308.8798 309.0205 309.1612 309.3019 309.4425 309.5832 309.7238 309.8644 310.0051 310.1457 310.2863 310.4269 310.5674 310.7080 310.8486 310.9891 311.1297 311.2702 311.4107 311.5512 311.6917 311.8322 311.9726 312.1131 312.2536 312.3940 312.5344 312.6749 312.8153 312.9557 313.0961 313.2364 313.3768 313.5172 313.6575 313.7978 313.9382 314.0785 314.2188 314.3591 314.4994 314.6396 314.7799 314.9201 315.0604 315.2006 315.3408 315.4810 315.6212 315.7614 315.9016 316.0418 316.1819 316.3221 316.4622 316.6023 316.7424 316.8825 317.0226 317.1627 317.3028 317.4428 317.5829 317.7229 317.8629 318.0029 318.1430 318.2829 318.4229 318.5629 318.7029 318.8428 318.9828 319.1227 319.2626 319.4025 319.5424 319.6823 319.8222 319.9620 320.1019 320.2417 320.3816 320.5214 320.6612 320.8010 320.9408 321.0806 321.2203 321.3601 321.4998 321.6396 321.7793 321.9190 322.0587 322.1984 322.3381 322.4778 322.6174 322.7571 322.8967 323.0363 323.1760 323.3156 323.4552 323.5947 323.7343 323.8739 324.0134 324.1530 324.2925 324.4320 324.5715 324.7110 324.8505 324.9900 --------------------------------------------------------------------------------------- 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 20211020T121810.1Z 7963.512617 286 1 29.66 2 79.14 114.33 104.14 292.01 0.00 1 0.00 1 0 17 3.943e-01 1.326e-02 2.301e-01 7.686e-03 6.085239e-01 4.164634e-03 7.143139e-03 -6.000000e+00 2.285821e-01 225.51 -2.00 3.51 -2.00 321.10 0.00e+00 2.414901e-03 1.919387e-03 2.883506e-03 -6.000000e+00 1.014646e-02 283.60 -2.00 20.00 -2.00 320.54 0.00e+00 5.111 0.002 302.00 328.00 3 3.0654e+00 1.3806e-02 6.1106e-02 -6.0000e+00 5.6476e-01 1.6177e-01 1.8365e-02 3.6080e-02 -6.0000e+00 6.1185e-01 -2.5619e-01 1.7433e-02 1.8930e-02 -6.0000e+00 3.6520e-01 1.0721e-01 8.4358e-03 5.6870e-03 -6.0000e+00 1.5793e-01 8.1867e-05 -7.1462e-04 2.3024e-04 8.2769e-05 -6.0000e+00 1.1088e-02 2.1205e-02 -2.7230e-05 12 8 8 10 0 0 99.13 23.94 0.36 0.02121 0.01584 28 28 1 5 0 1059.160 27.88 20.00 23.94 21.96 21.5 969.41 -176144 -100710 -148300 -172917 -112405 -53864 -119659 -102826 -32830 -100875 -119304 -117888 -45331 -78335 -76282 -1047 -23985 67204 -18304 27581 -49346 37583 -51518 -3126 3291 -21504 -13281 -43224 -26296 3947 10806 56032 -5744 13092 -22819 15769 -26888 162 -20393 -8513 9187 9620 492 5472 12429 -2265 8749 1207 3706 -1576 8448 10340 12618 11126 3570 4199 1971 13628 -1228 3546 6142 8111 9950 5333 1638 119 6100 369 6803 4586 3573 2945 1858 3473 -368 893 -5329 -1682 -3492 847 -3783 -2769 -580 -1742 65 -469 -328 -54 857 600 -1517 389 -4361 -145 -1767 -1532 -1245 179 -425 -404 -311 -411 -1028 -1889 -590 -1336 -1099 1022 -241 118 655 860 -531 90 -1319 -511 346 665 479 378 706 20 1139 1341 812 -448 823 465 -128 283 -43 396 -283 -334 10 106 461 600 -78 -767 -14 -1275 900000 -4080 -1235 -3031 -4241 -1378 -404 -1712 -1401 -246 -1581 -2357 -2650 -618 -1868 -2183 -16 -523 641 -436 432 -1681 538 -1895 -77 81 -703 -398 -1679 -860 105 317 1222 -262 559 -1334 638 -1874 10 -1941 -842 840 930 54 582 1248 -268 944 145 453 -218 1178 1565 2033 1959 712 862 421 2553 -260 712 1266 1824 2483 1531 497 36 1710 115 2228 1746 1486 1265 786 1351 -135 293 -1773 -562 -1358 372 -2013 -1641 -363 -1174 46 -355 -259 -43 673 449 -1080 256 -2942 -100 -1393 -1393 -1299 207 -521 -483 -343 -411 -981 -1891 -626 -1506 -1315 1290 -340 168 1006 1361 -839 135 -1894 -780 536 984 751 609 1114 30 1838 2077 1215 -654 1178 718 -203 497 -82 791 -599 -754 23 264 1165 1527 -197 -1853 -33 -2781 900000 SS 20211020T122753.0Z 7963.519363 292 1 29.99 2 77.48 116.08 105.75 293.75 0.00 1 0.00 1 0 25 2.712e-01 7.583e-03 1.023e-01 3.753e-03 5.451438e-01 2.007167e-03 6.436003e-03 -6.000000e+00 1.572002e-01 225.51 -2.00 3.51 -2.00 320.65 0.00e+00 1.619000e-03 8.099376e-04 1.835656e-03 -6.000000e+00 6.980144e-03 283.60 -2.00 20.00 -2.00 320.05 0.00e+00 4.483 0.002 302.00 328.00 3 2.7099e+00 6.3294e-03 5.3412e-02 -6.0000e+00 3.8839e-01 4.6641e-02 8.1153e-03 3.0632e-02 -6.0000e+00 4.2080e-01 -6.7046e-02 7.5632e-03 1.5573e-02 -6.0000e+00 2.5117e-01 2.0658e-02 3.7563e-03 4.5204e-03 -6.0000e+00 1.0860e-01 2.2773e-04 -9.3757e-04 1.1277e-04 6.7637e-05 -6.0000e+00 7.6284e-03 2.1386e-02 -7.5037e-05 11 8 0 10 0 0 86.45 23.95 0.34 0.02139 0.01434 48 48 1 5 0 624.590 27.88 20.00 23.95 22.34 21.4 971.74 -99397 -92407 -100466 -76291 -124490 -82915 -52308 -79398 -34736 -90017 -95951 -63258 -53405 -44952 -55448 -7007 -21930 -13192 -3838 -1665 -7398 -17643 -10483 -17012 -9790 -11407 -4994 -13419 -14060 -18960 499 -6985 -6668 945 -11309 -11120 -7247 -132 -1844 -3041 210 3601 3156 -1715 2381 2137 3304 -1440 -879 -1982 1616 4445 3533 3269 2354 1037 2470 205 155 886 1664 2918 4934 3130 3575 1206 514 1111 412 1283 564 2316 1068 512 276 452 -2499 -2559 -1167 -1639 -812 -1513 -1875 -1013 -208 -112 209 948 676 621 384 -302 -1125 -349 -569 -1054 211 48 14 -414 -521 -1368 -1024 -1263 -1580 -1352 -969 121 711 693 684 560 183 -192 -282 -185 159 240 146 67 391 276 592 534 341 -388 586 188 255 35 -315 -291 -265 58 166 -151 342 149 172 -121 -423 -546 900000 -1190 -1168 -1437 -812 -1988 -883 -452 -1030 -324 -1557 -1851 -1010 -959 -927 -1550 -140 -562 -338 -105 -47 -225 -600 -353 -666 -383 -476 -196 -550 -576 -888 22 -394 -422 57 -741 -745 -528 -11 -187 -366 27 477 438 -254 343 314 487 -228 -144 -351 306 903 787 786 599 278 665 56 41 234 460 884 1647 1160 1336 445 188 421 176 618 296 1229 561 254 125 185 -998 -1054 -536 -885 -500 -1052 -1409 -802 -159 -91 177 813 575 502 318 -236 -858 -277 -507 -985 223 57 17 -502 -585 -1406 -1001 -1289 -1737 -1563 -1184 157 1001 1077 1145 961 308 -308 -427 -271 237 377 244 115 662 452 937 813 498 -550 811 279 422 64 -568 -550 -526 122 370 -351 808 356 407 -274 -909 -1124 900000 SS 20211020T123317.7Z 7963.523122 295 1 30.47 2 76.56 117.07 106.64 294.74 0.00 1 0.00 1 0 25 2.462e-01 9.548e-03 1.792e-01 5.901e-03 5.117011e-01 3.153640e-03 6.265904e-03 -6.000000e+00 1.427342e-01 225.51 -2.00 3.51 -2.00 320.48 0.00e+00 2.596548e-03 1.200818e-03 2.501743e-03 -6.000000e+00 6.335213e-03 283.60 -2.00 20.00 -2.00 319.85 0.00e+00 4.199 0.001 302.00 328.00 3 3.7552e+00 9.7413e-03 5.0596e-02 -6.0000e+00 3.5266e-01 3.9505e-02 1.2209e-02 3.0211e-02 -6.0000e+00 3.8205e-01 -5.0655e-02 1.0953e-02 1.5468e-02 -6.0000e+00 2.2804e-01 1.8164e-02 5.5088e-03 4.5114e-03 -6.0000e+00 9.8628e-02 1.0775e-04 -5.9979e-04 1.7899e-04 7.0152e-05 -6.0000e+00 6.9230e-03 2.0362e-02 -3.5246e-05 12 8 8 10 0 0 99.14 23.96 0.20 0.02036 0.01586 22 22 1 5 0 1384.590 27.88 20.00 23.96 22.55 21.4 973.13 -70458 -118555 -24028 -110047 -137180 -2445 -88335 27982 -97492 -9867 -54564 -2528 -26565 -37903 -38121 -6256 -850 -37670 39453 7155 -4789 -8659 -19996 9091 -11904 -12244 -27196 -5207 -22506 -575 -26309 5341 5636 -261 -12427 2563 -4846 -4172 15 -2037 6367 2395 -434 3573 4622 39 1205 -1429 -3276 -1485 5049 3527 2281 4680 5436 20 828 1339 5678 -1544 3204 1510 4098 3326 3417 1792 -60 2591 -801 2794 3095 461 1133 -1217 1427 -929 -1718 -733 -1765 -1467 -1610 -1574 -1575 -1665 -952 -328 -1047 55 1446 616 579 -671 -1362 -707 -1312 -204 10 597 431 -273 -1431 -1265 -788 -746 -1964 -1065 -1215 -167 830 633 1228 528 20 -96 -70 -278 -25 973 201 163 265 388 854 600 391 -422 364 384 375 -388 328 -446 -581 -46 -83 -1 499 4 211 -201 -272 -411 900000 -848 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