File name: Pandora206s1_BuffaloNY_20240210_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T072931.8Z 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_20240210_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: 20240210 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 20240210T144432.8Z 8806.614269 118 1 3.24 2 68.68 136.77 75.49 128.22 0.00 1 0.00 1 0 17 5.568e-02 7.013e-03 7.347e-02 5.677e-03 4.496473e-01 2.799043e-03 5.236944e-03 -6.000000e+00 3.080158e-02 224.49 -2.00 3.55 -2.00 319.30 0.00e+00 1.017835e-03 7.079168e-04 2.144339e-04 -6.000000e+00 1.319572e-03 272.39 -2.00 20.00 -2.00 318.78 0.00e+00 2.725 0.000 302.00 328.00 3 3.5546e+00 7.7211e-03 3.5181e-02 -6.0000e+00 7.6260e-02 1.9998e-02 9.0001e-03 2.3053e-02 -6.0000e+00 8.3243e-02 -2.8969e-02 7.2633e-03 1.1673e-02 -6.0000e+00 4.9410e-02 4.1276e-03 3.8771e-03 3.8532e-03 -6.0000e+00 2.0991e-02 6.0394e-04 1.1487e-03 1.5521e-04 3.6451e-05 -6.0000e+00 1.4172e-03 -1.2708e-02 3.7710e-04 12 9 1 12 1 1 99.31 17.75 0.24 -0.01271 -0.00408 5 26 2 8 0 539.610 15.00 17.75 16.95 21.27 21.17 20.8 1025.42 -16928 -13121 14795 -15845 -7586 -27082 -9953 -13198 -6325 -18814 -5759 -8715 2419 -12923 4200 -1846 -552 -33354 1718 11821 3635 -1046 -6568 -2993 -2145 -4300 -4945 1962 -3595 978 2801 456 2770 -227 3656 -3956 530 -1901 3427 60 485 -1965 400 -1323 -72 1452 2378 -85 -1027 -127 73 125 -93 2453 -65 2157 535 -129 -85 770 1064 1364 1701 2229 1560 -1245 687 -844 -612 -372 973 439 350 314 183 1071 -808 -883 -574 -493 -2062 -1015 -2785 -1030 -1008 -555 89 761 714 198 1111 162 1274 617 40 -782 -59 898 78 -178 323 -442 -95 477 -787 -1546 -1265 72 -780 412 131 248 -401 -106 -501 775 -197 883 324 431 104 -111 -217 -254 524 81 274 769 689 210 410 -287 -164 376 -249 104 -117 126 -380 -74 -228 -198 -77 -375 -319 290 -404 -157 -664 -222 -344 -175 -640 -173 -288 86 -652 215 -113 -36 -3254 126 848 290 -86 -575 -275 -208 -451 -531 193 -353 95 302 57 370 -33 496 -566 80 -334 699 15 131 -574 119 -408 -22 442 717 -26 -325 -41 26 48 -37 1040 -30 987 256 -62 -40 349 496 692 928 1335 960 -737 396 -494 -375 -255 722 341 270 230 127 656 -478 -512 -361 -349 -1649 -878 -2569 -976 -998 -586 97 832 782 215 1128 153 1149 559 39 -843 -70 1157 105 -236 410 -526 -106 548 -975 -1969 -1687 98 -1117 622 210 409 -648 -165 -743 1100 -284 1288 509 694 168 -175 -340 -381 760 117 375 1078 1043 332 695 -499 -293 685 -478 203 -233 256 -762 -145 -434 -367 -140 SS 20240210T145037.2Z 8806.618486 122 1 26.99 2 67.93 138.13 74.63 129.40 0.00 1 0.00 1 0 17 5.768e-02 5.755e-03 6.970e-02 4.482e-03 4.305560e-01 2.224364e-03 5.052928e-03 -6.000000e+00 3.187869e-02 224.49 -2.00 3.55 -2.00 319.75 0.00e+00 2.014589e-03 6.329349e-04 7.335105e-04 -6.000000e+00 1.367153e-03 272.39 -2.00 20.00 -2.00 319.23 0.00e+00 2.639 0.000 302.00 328.00 3 4.7533e+00 6.2659e-03 3.4278e-02 -6.0000e+00 7.8924e-02 3.8651e-03 7.4225e-03 2.3213e-02 -6.0000e+00 8.6175e-02 4.2422e-03 6.3550e-03 1.1280e-02 -6.0000e+00 5.1147e-02 -8.9042e-03 3.3600e-03 4.1423e-03 -6.0000e+00 2.1714e-02 2.0122e-04 2.1917e-04 1.2617e-04 3.7322e-05 -6.0000e+00 1.4686e-03 -1.1181e-02 2.1573e-04 10 0 0 10 0 0 99.99 17.76 0.21 -0.01118 -0.00953 66 66 4 8 0 408.860 15.00 17.76 17.62 21.27 21.17 21.0 1030.13 -2978 -10410 -9627 -25376 -17993 -2633 -22166 -714 -31944 1651 -4729 22971 1590 18641 333 14688 -2298 7945 -2317 14285 6360 8644 1696 241 -1512 -5310 1550 -3554 2040 -8530 4265 -4712 1941 1152 -3002 301 -3158 261 -1639 2806 -3326 -611 499 -1939 -3038 1642 -1547 -3096 1337 -4413 626 988 69 -450 1602 1260 1577 -77 290 -1590 1446 1388 1814 1354 -140 540 -465 -148 -470 100 250 2052 286 1191 830 1011 -824 -1572 -234 -1170 -852 -1453 -1886 -1838 -380 -780 -1 620 1191 391 651 223 848 3 1 -142 598 869 -126 302 -383 842 -828 629 -683 -253 -699 -700 -423 32 379 -157 -190 -232 -52 -126 463 -348 47 -190 -263 -53 50 -210 463 76 264 858 549 272 39 337 -411 212 -151 37 59 371 -62 68 -386 -538 63 -50 -207 -203 -600 -363 -44 -488 -14 -951 39 -121 475 47 570 15 656 -127 442 -147 835 413 541 118 18 -120 -462 133 -305 157 -752 376 -494 216 137 -346 34 -396 37 -289 566 -790 -149 126 -511 -812 425 -414 -842 352 -1268 187 322 24 -171 623 504 646 -32 116 -642 586 614 890 710 -76 281 -234 -74 -255 60 165 1385 195 765 509 552 -420 -789 -126 -739 -613 -1141 -1602 -1632 -357 -788 -1 645 1277 404 618 196 716 2 1 -144 681 1078 -168 394 -471 959 -884 682 -820 -317 -894 -949 -610 50 619 -264 -311 -371 -77 -176 647 -513 74 -315 -437 -85 78 -316 680 108 355 1179 835 439 67 605 -739 397 -303 78 126 786 -132 144 -776 -1036 121 SS 20240210T152730.2Z 8806.644099 142 1 27.56 2 63.81 146.82 69.73 136.88 0.00 1 0.00 1 0 25 3.947e-02 7.271e-03 4.667e-02 5.372e-03 3.682807e-01 2.634467e-03 4.393433e-03 -6.000000e+00 2.180095e-02 224.49 -2.00 3.55 -2.00 318.94 0.00e+00 6.219579e-04 5.852848e-04 1.710992e-04 -6.000000e+00 9.355153e-04 272.39 -2.00 20.00 -2.00 318.40 0.00e+00 2.253 0.000 302.00 328.00 3 5.9218e+00 7.1682e-03 2.9020e-02 -6.0000e+00 5.3973e-02 1.9914e-02 8.2413e-03 1.8919e-02 -6.0000e+00 5.8942e-02 6.5305e-03 6.1026e-03 9.5006e-03 -6.0000e+00 3.4983e-02 -7.7664e-03 3.2553e-03 2.8560e-03 -6.0000e+00 1.4846e-02 9.7143e-05 9.5811e-06 1.4964e-04 2.8867e-05 -6.0000e+00 1.0051e-03 -1.0321e-02 1.0386e-04 11 8 0 10 0 0 99.91 17.74 0.53 -0.01032 -0.01025 16 16 2 8 0 1721.970 14.99 17.74 18.50 21.27 21.17 20.8 1034.58 -13347 4105 -22484 15040 2668 -4468 -9032 10215 -7080 8441 -3119 16283 -8257 12684 4785 -1320 2930 -974 3065 788 5796 -1404 6812 -810 3405 -1361 -874 2727 -2739 560 -3000 -795 -2658 946 -1915 -4261 1192 -90 327 183 48 -2088 -3749 -1955 914 -1440 -668 -3998 1346 -6350 1822 1040 -16 1611 3970 1913 -31 48 516 580 -992 1859 1008 2587 -88 25 -699 -136 33 -272 1315 443 890 -79 1223 -482 -979 -1234 -345 -761 -372 -662 -2395 -680 -759 292 6 29 424 1018 1045 172 -109 251 156 -160 1116 331 934 -51 168 -756 -1168 -1245 -284 -1502 -578 -599 -230 87 570 113 -305 -395 -499 450 64 -65 -82 -201 -475 396 415 131 892 516 596 690 648 399 364 -386 -257 -233 170 -475 122 705 48 -197 199 -573 -629 -501 145 -1087 473 86 -146 -333 362 -327 358 -148 688 -508 750 361 -121 273 -100 319 88 627 -161 745 -103 440 -194 -125 355 -351 71 -435 -124 -474 171 -328 -732 216 -19 85 55 16 -737 -1399 -725 329 -535 -244 -1494 492 -2475 708 442 -7 776 1941 976 -17 26 265 294 -527 1043 629 1677 -59 16 -426 -81 21 -196 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