File name: Pandora206s1_BuffaloNY_20240108_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T071313.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240108_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240108 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240108T162806.6Z 8773.686188 210 1 26.08 2 66.40 166.46 74.27 205.55 0.00 1 0.00 1 0 17 3.454e-02 6.243e-03 3.762e-02 3.847e-03 4.116098e-01 1.879584e-03 4.915569e-03 -6.000000e+00 1.898425e-02 223.22 -2.00 3.55 -2.00 318.89 0.00e+00 1.171734e-03 4.231750e-04 1.639477e-04 -6.000000e+00 8.202801e-04 272.86 -2.00 20.00 -2.00 318.35 0.00e+00 2.480 0.000 302.00 328.00 3 5.3302e+00 5.1019e-03 3.2053e-02 -6.0000e+00 4.6860e-02 2.8845e-02 5.8826e-03 2.1058e-02 -6.0000e+00 5.1222e-02 -1.3675e-03 4.4398e-03 1.0615e-02 -6.0000e+00 3.0438e-02 -6.7185e-03 2.3800e-03 3.3403e-03 -6.0000e+00 1.2952e-02 1.3320e-04 1.2260e-05 1.0525e-04 3.2982e-05 -6.0000e+00 8.7961e-04 -7.4064e-03 1.2477e-04 10 0 0 10 0 0 98.06 17.78 0.26 -0.00741 -0.00731 9 9 2 8 0 2897.340 14.99 17.78 11.86 21.38 21.17 19.8 972.29 -6606 15681 -3809 -2487 -11127 -14419 -13285 -10030 -4797 -4808 6726 -5899 2470 -2049 4676 643 -895 186 -1352 -1246 4869 1332 -15367 2569 -5021 -488 90 3165 -9593 702 -1362 3205 1389 1214 -3178 -6172 -2352 -2517 1037 -1639 -596 -1222 1480 -951 748 -659 -276 -2540 751 536 292 643 787 2596 1384 1859 -1409 836 230 681 420 1800 1903 139 342 122 -285 -493 577 739 1652 -591 1093 469 737 -767 -598 -980 -664 -184 -473 -553 -2142 -1375 -946 -14 -176 -113 228 737 340 514 166 502 176 -415 652 66 391 -186 -177 -834 -543 -18 -369 -1172 -715 -760 -546 423 358 667 -605 242 176 273 -157 315 -169 38 -607 203 595 47 694 25 482 1073 689 187 346 85 112 -219 -224 -288 -26 302 -328 12 91 -350 -458 -187 402 -125 -77 -341 -446 -440 -363 -186 -201 251 -266 122 -124 315 52 -79 17 -136 -131 491 137 -1944 294 -657 -64 12 384 -1246 85 -189 476 237 218 -552 -1084 -443 -555 261 -504 -200 -420 516 -344 266 -241 -103 -940 280 206 118 284 370 1247 701 960 -771 444 119 359 222 1024 1164 95 235 78 -181 -313 379 543 1318 -487 900 369 548 -516 -379 -609 -447 -139 -394 -503 -2064 -1373 -984 -15 -198 -131 263 829 362 504 156 470 175 -457 781 88 534 -249 -227 -1002 -619 -21 -463 -1510 -961 -1055 -788 642 572 1086 -967 369 259 381 -222 463 -261 60 -968 320 910 70 986 36 658 1461 1012 292 563 145 190 -382 -409 -551 -50 585 -637 23 168 -621 -813 SS 20240108T165234.9Z 8773.703181 220 1 15.55 2 65.59 172.59 76.35 210.60 0.00 1 0.00 1 0 17 3.879e-02 5.981e-03 4.085e-02 4.348e-03 4.014084e-01 2.121452e-03 4.807145e-03 -6.000000e+00 2.131799e-02 223.22 -2.00 3.55 -2.00 318.77 0.00e+00 5.678149e-04 4.613969e-04 1.562252e-04 -6.000000e+00 9.212283e-04 272.86 -2.00 20.00 -2.00 318.24 0.00e+00 2.403 0.000 302.00 328.00 3 5.0441e+00 5.7384e-03 3.1136e-02 -6.0000e+00 5.2620e-02 5.3657e-03 6.5996e-03 2.0480e-02 -6.0000e+00 5.7522e-02 1.1800e-02 4.9021e-03 1.0319e-02 -6.0000e+00 3.4182e-02 -1.0081e-02 2.6303e-03 3.0661e-03 -6.0000e+00 1.4543e-02 1.9508e-04 -1.5330e-04 1.1885e-04 3.0894e-05 -6.0000e+00 9.8800e-04 -6.6623e-03 1.0137e-04 12 1 1 12 1 1 88.37 17.78 0.36 -0.00666 -0.00781 6 12 4 8 0 2220.730 15.00 17.78 12.93 21.38 21.17 19.8 979.17 -15152 -776 4877 2908 -14494 7745 -8516 2444 -20971 15730 1649 21435 852 -72 -2846 -2484 -604 -1735 3883 -451 8004 -3740 2216 -3890 885 -234 -1023 -548 -4427 797 -2326 -812 -3904 -91 -5494 -332 -2710 -134 -421 -294 -1772 -120 -721 -1071 1889 -1245 -1429 -2130 913 -1029 1811 3244 705 650 1814 1205 350 -106 -539 -373 1317 1681 1595 1737 240 6 -1277 -578 859 -162 136 278 534 405 644 -763 46 -747 390 -805 -77 -557 -1884 -1730 -824 -153 240 58 535 412 362 396 293 482 134 474 228 744 -42 -105 -367 -1130 -257 -87 -440 -1126 -846 -613 -762 25 431 500 306 479 -168 305 -133 -68 -10 179 -320 -344 127 379 414 465 219 1207 458 312 234 344 -256 -123 -398 -238 -187 171 203 56 27 -403 -420 -506 -25 158 91 -478 207 -290 85 -1009 583 70 797 45 -5 -222 -222 -57 -176 394 -50 834 -433 252 -510 117 -33 -148 -74 -585 103 -347 -133 -742 -18 -1032 -58 -543 -30 -114 -92 -623 -44 -275 -414 709 -488 -557 -833 348 -411 766 1432 341 328 944 647 195 -58 -292 -199 714 989 1013 1205 166 4 -818 -366 580 -124 111 235 445 322 482 -530 30 -476 266 -609 -64 -510 -1828 -1751 -868 -167 273 69 626 461 382 394 278 454 135 522 278 968 -58 -143 -477 -1377 -294 -103 -547 -1476 -1134 -848 -1101 38 689 816 485 727 -247 431 -186 -99 -16 282 -509 -532 195 564 599 643 296 1660 668 484 380 566 -436 -215 -729 -448 -358 327 387 105 48 -717 -729 SS 20240108T165922.2Z 8773.707896 224 1 26.86 2 65.45 174.31 76.99 211.97 0.00 1 0.00 1 0 17 3.249e-02 5.656e-03 2.611e-02 2.672e-03 4.000932e-01 1.303778e-03 4.765321e-03 -6.000000e+00 1.785063e-02 223.22 -2.00 3.55 -2.00 318.97 0.00e+00 6.153074e-04 2.978695e-04 1.710727e-04 -6.000000e+00 7.714169e-04 272.86 -2.00 20.00 -2.00 318.43 0.00e+00 2.390 0.000 302.00 328.00 3 4.6550e+00 3.5507e-03 3.0980e-02 -6.0000e+00 4.4061e-02 1.3492e-02 4.1019e-03 2.0393e-02 -6.0000e+00 4.8167e-02 -4.8683e-03 3.1009e-03 1.0291e-02 -6.0000e+00 2.8623e-02 -4.2752e-03 1.6595e-03 3.0854e-03 -6.0000e+00 1.2177e-02 2.9258e-04 -1.2227e-04 7.3748e-05 3.1067e-05 -6.0000e+00 8.2741e-04 -6.9239e-03 7.4051e-05 10 0 0 10 0 0 99.17 17.79 0.32 -0.00692 -0.00784 27 27 2 8 0 994.580 15.00 17.79 13.12 21.38 21.17 19.8 979.87 3735 -8653 3784 -7219 -12974 -11626 -10666 12572 -12641 3917 -11179 5820 -12631 343 -5508 -128 -3942 2071 -2389 -2027 -98 -1456 4053 -3536 -281 -1963 718 -1794 -449 -1738 813 25 851 -2069 -3761 -3591 -3787 376 -2031 562 -2007 337 -1448 -435 39 -231 -428 -1042 11 235 1317 1151 1284 1955 1768 247 1247 329 782 97 1434 -216 1872 1690 602 182 -781 -334 -1163 801 531 762 214 1065 -94 -263 201 -466 -152 -566 -791 -1054 -2202 -1581 -650 -783 132 -9 796 76 785 551 258 360 517 -29 340 712 320 -26 -179 -478 -982 48 -829 -886 -1121 -823 -54 195 484 66 -85 -95 -79 91 100 -70 125 -65 -249 327 254 79 831 581 54 1082 451 371 128 49 -279 -68 118 22 -74 220 69 -177 -265 -598 -162 98 -289 117 -237 -397 -343 -338 390 -524 148 -490 229 -710 20 -410 -10 -353 187 -238 -210 -10 -151 415 -424 -35 -259 93 -225 -52 -209 107 4 140 -369 -630 -590 -695 78 -524 168 -679 117 -532 -160 14 -86 -158 -385 4 88 534 509 606 906 855 125 638 168 387 48 720 -120 1130 1117 406 114 -473 -200 -762 593 431 595 179 841 -69 -172 120 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