File name: Pandora206s1_BuffaloNY_20241210_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20241211T051430.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 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_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20241210_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20241210 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]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- 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 20241210T151528.1Z 9110.635742 177 1 24.00 2 70.91 152.60 121.01 42.86 0.00 1 0.00 1 0 17 3.493e-01 4.511e-02 3.100e-01 3.601e-02 3.698325e-01 1.845470e-02 5.204894e-03 -6.000000e+00 1.974756e-01 222.38 -2.00 3.55 -2.00 319.46 0.00e+00 7.377466e-03 4.893182e-03 3.415502e-03 -6.000000e+00 1.092454e-02 274.82 -2.00 20.00 -2.00 318.93 0.00e+00 3.022 0.000 302.00 328.00 3 7.0353e+00 5.1399e-02 3.9909e-02 -6.0000e+00 4.9291e-01 7.9577e-02 6.0091e-02 3.3882e-02 -6.0000e+00 5.4118e-01 3.2805e-02 5.0111e-02 9.7133e-03 -6.0000e+00 3.1423e-01 -4.0797e-03 2.6892e-02 8.5247e-03 -6.0000e+00 1.3763e-01 1.4275e-05 -2.7646e-03 1.0575e-03 5.3125e-05 -6.0000e+00 9.3259e-03 -1.1329e-02 0.0000e+00 12 8 8 10 0 0 -581.50 18.07 3.08 -0.01133 -0.03210 6 6 2 8 0 4000.000 15.00 18.07 14.98 21.69 21.48 24.0 966.44 -94192 900000 900000 900000 36778 900000 167836 900000 900000 900000 900000 900000 900000 25862 181262 19714 900000 -10861 153088 6292 89307 -41649 78668 115326 1226 13007 28559 79441 10231 30909 57235 52545 -549 29453 -315 30062 -10616 40179 42443 -4282 -10037 -16314 33842 3775 1919 1447 -11309 -30470 47640 -885 3221 2140 -713 3923 12428 736 -11555 2805 5522 -9747 -1242 6344 12474 -1801 -8935 102 -14338 -3606 -1178 1282 15369 -3875 10761 4943 4596 -1266 17968 4447 -12829 -7505 7011 -661 -6445 5243 -2512 5628 2359 1013 -3409 5432 -4641 7020 -4600 -6996 -2319 -8610 2073 -708 3813 -1341 6726 -561 5257 -2185 7703 -1733 1537 631 271 -4557 1099 5259 -4199 -2747 270 4081 168 -699 -1777 -723 301 -1377 303 -1943 -8680 5438 2858 5228 3849 -3350 5500 3067 -226 -3398 588 -1766 -1252 -1263 2302 1966 1108 -2521 531 -5101 900000 900000 900000 1289 900000 5882 900000 900000 900000 900000 900000 900000 906 6352 1036 900000 -916 5365 503 3332 -5352 3202 4042 113 1132 2195 3712 879 2166 3429 3742 -72 3263 -44 2957 -1616 4315 5278 -985 -2759 -4903 6671 1046 548 425 -3814 -12037 9209 -271 1002 736 -270 1508 4600 310 -5606 1183 2213 -4494 -539 2751 5642 -1039 -5832 58 -8730 -1919 -629 759 8887 -2869 6953 3264 2849 -749 8146 2182 -7474 -4742 4400 -503 -5682 4289 -2355 5239 2398 1084 -3871 5521 -4849 5973 -4046 -6193 -2055 -8817 2150 -854 4827 -1801 7866 -649 5373 -2367 8221 -2097 1876 821 374 -7092 1748 8363 -7228 -4404 388 5398 226 -983 -2604 -1121 474 -2163 471 -2974 -13434 6990 3576 6277 5056 -5162 8300 4969 -387 -5994 1058 -3442 -2490 -2558 4570 3809 2130 -4810 944 SS 20241210T153107.7Z 9110.646617 183 1 45.77 2 69.68 156.19 119.01 46.50 0.00 1 0.00 1 0 17 3.171e-02 4.636e-03 3.228e-02 2.788e-03 3.761954e-01 1.382801e-03 4.536713e-03 -6.000000e+00 1.745158e-02 222.38 -2.00 3.55 -2.00 319.46 0.00e+00 1.053372e-03 3.606116e-04 2.942488e-04 -6.000000e+00 7.596379e-04 274.82 -2.00 20.00 -2.00 318.89 0.00e+00 2.850 0.000 302.00 328.00 3 3.6481e+00 3.8515e-03 3.3779e-02 -6.0000e+00 4.2978e-02 -1.8096e-02 4.4999e-03 1.9534e-02 -6.0000e+00 4.6908e-02 9.9933e-03 3.5782e-03 9.8614e-03 -6.0000e+00 2.7926e-02 -8.7139e-03 1.8999e-03 3.1282e-03 -6.0000e+00 1.1991e-02 5.4989e-04 -5.2808e-04 7.9483e-05 3.1609e-05 -6.0000e+00 8.0656e-04 -7.5357e-03 0.0000e+00 10 0 0 10 0 0 99.99 18.07 0.38 -0.00754 -0.01150 158 49 2 8 0 289.630 14.99 18.07 15.36 21.58 21.48 24.0 968.84 -21349 -4380 -9064 -20529 6545 -7291 -5610 4755 -2183 1472 -2068 3268 2153 -23 2057 216 708 -3391 821 -282 3066 -2463 -470 2144 -3253 1957 -5085 2473 -3705 1376 -3518 1062 -3766 1529 -3944 -4001 -1692 -1856 1904 -274 -984 -942 626 -1347 -417 -1484 -745 -1203 312 849 876 705 339 1789 907 941 638 660 16 -626 455 674 1039 1335 91 110 -460 -463 676 1034 1104 462 1103 258 545 -408 282 -1203 -389 -800 -417 -710 -1524 -968 -1336 -178 -169 -428 -218 588 231 380 30 509 502 -180 414 702 355 -35 141 -243 -466 98 -673 -707 -479 -666 -310 73 357 214 200 282 -297 437 -163 34 -223 -245 -664 -173 -130 258 199 590 436 728 996 335 424 -131 -142 -304 -117 -103 -91 192 -20 -107 -46 -213 -119 -580 -116 -269 -670 158 -173 -153 131 -66 47 -70 107 82 -1 112 14 49 -262 65 -23 255 -215 -41 196 -335 201 -578 250 -371 130 -384 124 -514 215 -555 -533 -240 -304 364 -65 -263 -266 182 -409 -126 -456 -227 -365 94 256 283 250 129 719 387 411 288 298 7 -275 202 322 546 771 55 63 -247 -245 370 648 772 343 817 186 364 -247 153 -631 -212 -503 -299 -573 -1351 -891 -1320 -187 -172 -452 -232 659 240 363 27 434 456 -184 475 832 460 -45 171 -297 -522 110 -833 -850 -601 -886 -436 111 583 363 331 442 -432 590 -219 48 -333 -391 -1086 -275 -203 386 282 872 612 1018 1513 512 693 -225 -250 -556 -229 -213 -193 415 -44 -226 -93 -415 -223 SS 20241210T160744.4Z 9110.672041 202 1 5.76 2 67.45 164.92 113.92 54.41 0.00 1 0.00 1 0 17 4.933e-02 8.575e-03 5.174e-02 7.750e-03 3.564014e-01 3.784548e-03 4.362158e-03 -6.000000e+00 2.714335e-02 222.38 -2.00 3.55 -2.00 318.47 0.00e+00 2.553434e-05 7.494104e-04 2.979099e-04 -6.000000e+00 1.181496e-03 274.81 -2.00 20.00 -2.00 317.89 0.00e+00 2.586 0.000 302.00 328.00 3 4.2122e+00 1.0145e-02 3.1066e-02 -6.0000e+00 6.6846e-02 1.3938e-02 1.1591e-02 1.8303e-02 -6.0000e+00 7.2960e-02 -6.1489e-03 8.0774e-03 9.2059e-03 -6.0000e+00 4.3436e-02 -2.9340e-03 4.2960e-03 2.6861e-03 -6.0000e+00 1.8649e-02 4.0649e-04 -7.1500e-04 2.1364e-04 2.8140e-05 -6.0000e+00 1.2545e-03 -7.3477e-03 0.0000e+00 12 9 1 12 1 1 999.00 18.07 0.31 -0.00735 -0.01272 2 14 4 8 0 1896.010 15.00 18.07 17.15 21.69 21.48 24.3 980.71 -24906 -815 8243 7327 -2307 -25132 -3783 -17808 20120 -8361 22956 -10096 1710 -10347 -4787 -5084 2967 -93 -2369 2629 559 3892 -1806 3321 -6369 1735 -2555 1374 -9461 2757 -3244 1790 1405 -1761 -1011 -515 -2151 -2258 794 -1479 1251 -1717 -650 -1326 -1051 898 -1833 863 1507 1063 35 2158 395 2180 -811 2476 -737 1360 -426 1917 -210 997 1978 1432 273 1189 254 -1134 -36 -394 2140 792 1138 1243 1453 -305 -1049 907 -774 -532 -1785 -899 -2846 -1122 -1293 -558 -862 -435 618 694 -118 353 -313 609 1366 -890 -90 374 1276 -1224 -234 -1259 -1063 -578 -1096 -526 -270 -704 -1558 1167 495 131 523 866 -223 257 -397 112 767 300 -61 -354 650 -243 663 221 698 494 1041 629 1051 -369 -23 -203 -159 -211 -551 521 116 -399 -331 -85 -670 -1289 -38 384 336 -102 -1312 -169 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