File name: Pandora206s1_BuffaloNY_20240721_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240722T052545.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240721_L1_smca1c1d20220512p1-8.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: 20240721 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20240721T111307.5Z 8968.467448 190 1 45.33 2 77.80 73.49 105.05 249.03 0.00 1 0.00 1 0 25 3.557e-01 1.545e-02 2.419e-01 8.168e-03 6.464454e-01 4.440964e-03 7.361897e-03 -6.000000e+00 2.053367e-01 232.74 -2.00 3.55 -2.00 321.17 0.00e+00 3.682282e-03 2.110907e-03 8.331682e-04 -6.000000e+00 9.794876e-03 287.46 -2.00 20.00 -2.00 320.53 0.00e+00 4.592 0.002 302.00 328.00 3 4.1557e+00 1.5315e-02 5.7257e-02 -6.0000e+00 5.1689e-01 1.8307e-01 2.0536e-02 3.5486e-02 -6.0000e+00 5.6097e-01 -2.6418e-01 1.9432e-02 1.8540e-02 -6.0000e+00 3.3251e-01 9.9807e-02 9.3064e-03 6.9310e-03 -6.0000e+00 1.4093e-01 4.4610e-05 -5.6589e-04 2.2777e-04 7.4507e-05 -6.0000e+00 9.3087e-03 1.6494e-02 -5.2956e-05 12 8 8 10 0 0 94.97 17.54 1.02 0.01649 0.01224 18 6 2 8 0 2517.860 14.99 17.54 26.77 20.46 20.67 23.3 993.86 -219311 900000 -86250 900000 -131630 900000 -101469 -109390 -94267 900000 29115 11027 -128933 -38145 900000 -67475 900000 -9580 28975 -41162 900000 -68204 24233 9471 -39338 -22699 -6125 -30190 -49056 80350 -34672 13687 -4617 81288 19868 34705 -27463 28926 40557 13168 11746 -8934 13709 -2690 19675 553 14973 -4478 11599 1319 12575 8482 -18093 7487 5073 5963 4280 6027 -824 6035 -9099 16586 -800 7166 -907 5024 2404 138 5739 -2061 5123 1656 3392 1851 4476 -730 9973 -5070 -1068 -3143 -1755 1839 -724 -1418 -5252 2684 -197 550 -2181 1099 -1070 2279 127 -922 -1988 -2821 498 514 614 -680 707 -1782 -213 -3376 1055 -2379 -1238 519 -306 868 508 106 -1907 2575 -1489 1139 -1009 82 -484 1067 -159 631 -418 -378 2428 -122 757 230 1214 137 1282 -342 375 -965 249 77 -78 161 -150 280 -184 -654 -545 -6019 900000 -831 900000 -1709 900000 -1020 -1328 -1105 900000 232 88 -3347 -511 900000 -1836 900000 -180 400 -1206 900000 -2627 386 190 -1367 -703 -164 -986 -1869 959 -1495 454 -203 1724 729 1074 -1667 1240 1900 926 939 -935 1205 -285 1774 59 1476 -523 1271 161 1623 1207 -3659 1279 939 1131 851 1168 -165 1171 -2012 3306 -205 1917 -275 1380 670 40 1752 -792 2023 704 1398 729 1561 -239 2887 -1725 -372 -1338 -860 996 -440 -913 -3773 1904 -151 430 -1753 820 -754 1451 79 -598 -1470 -2442 458 546 707 -784 751 -1748 -196 -3274 1066 -2483 -1350 598 -388 1220 758 167 -3054 3791 -2256 1608 -1475 125 -751 1698 -253 1004 -651 -565 3381 -168 996 319 1899 231 2341 -676 770 -2030 556 182 -188 394 -367 646 -402 -1418 -1143 SS 20240721T111826.8Z 8968.471143 192 1 46.31 2 76.87 74.34 105.91 249.83 0.00 1 0.00 1 0 25 2.861e-01 8.451e-03 2.592e-01 4.972e-03 6.218570e-01 2.620076e-03 7.013751e-03 -6.000000e+00 1.630760e-01 232.74 -2.00 3.55 -2.00 320.98 0.00e+00 6.380148e-04 1.162246e-03 4.843086e-04 -6.000000e+00 7.222813e-03 287.46 -2.00 20.00 -2.00 320.31 0.00e+00 4.288 0.001 302.00 328.00 3 3.5964e+00 8.6080e-03 5.4071e-02 -6.0000e+00 4.0964e-01 6.5573e-02 1.1536e-02 3.4193e-02 -6.0000e+00 4.4345e-01 -1.1269e-01 1.1132e-02 1.7116e-02 -6.0000e+00 2.6377e-01 3.5115e-02 5.4030e-03 5.3273e-03 -6.0000e+00 1.1150e-01 1.0935e-04 -3.5173e-04 1.3506e-04 5.2893e-05 -6.0000e+00 7.3045e-03 1.6605e-02 -6.7360e-05 11 8 0 10 0 0 26.58 17.54 0.73 0.01661 0.01396 37 11 2 8 0 1251.510 15.00 17.54 27.05 20.46 20.67 23.4 995.73 -207857 29679 -90094 35112 -9301 74821 15488 -109259 -48179 -38425 -4057 -75191 -88330 -64813 21443 -37191 45662 -5611 2451 -9010 68018 -30560 -24758 3498 63248 -30061 -26074 533 -27637 5465 -12056 18001 -462 22239 -10792 -11980 -6716 11466 -6 -1774 -5587 -14913 1475 -3415 -5058 308 -76 -2991 3454 2014 3862 4373 900 1072 3099 7138 1926 4608 -683 2470 -1963 4656 85 2626 1494 1757 -296 -700 2281 -150 2454 1683 1518 -291 1706 90 1371 -1351 -680 -1866 -210 -80 -2925 -2676 -1676 1250 159 1997 645 -1046 491 932 200 535 150 -826 879 587 199 -217 -147 -654 -786 -1236 -209 -1564 -1060 -482 -900 -48 562 -107 -182 -72 -675 601 -219 366 -119 129 -161 400 -95 223 1344 475 1166 156 625 505 198 134 -514 -558 114 248 -92 370 243 -28 -153 -598 -388 -4215 144 -715 170 -45 363 75 -1272 -350 -279 -22 -912 -1542 -1131 198 -739 443 -101 44 -192 693 -830 -672 80 859 -1108 -948 14 -938 143 -450 585 -21 873 -555 -616 -368 623 0 -166 -612 -1916 170 -421 -638 38 -9 -394 445 280 592 746 174 226 681 1568 462 1073 -162 558 -479 1172 25 865 519 583 -99 -242 844 -60 1062 766 683 -126 725 35 486 -496 -278 -919 -108 -47 -1925 -1851 -1235 958 129 1638 536 -848 362 639 132 362 114 -736 887 682 251 -272 -172 -692 -759 -1226 -224 -1781 -1267 -615 -1255 -69 874 -176 -297 -113 -997 838 -312 543 -189 213 -263 628 -146 327 2029 698 1636 232 961 867 371 268 -1080 -1241 251 572 -215 886 580 -64 -356 -1323 -832 SS 20240721T112412.9Z 8968.475149 195 1 45.60 2 75.85 75.26 106.85 250.69 0.00 1 0.00 1 0 25 2.817e-01 8.093e-03 1.136e-01 3.625e-03 5.791599e-01 1.896017e-03 6.608997e-03 -6.000000e+00 1.605590e-01 232.74 -2.00 3.55 -2.00 320.76 0.00e+00 1.621076e-03 7.857511e-04 6.923255e-04 -6.000000e+00 7.111385e-03 287.46 -2.00 20.00 -2.00 320.08 0.00e+00 4.000 0.001 302.00 328.00 3 3.3494e+00 6.0862e-03 5.0347e-02 -6.0000e+00 4.0331e-01 3.3474e-02 7.8476e-03 3.1489e-02 -6.0000e+00 4.3661e-01 -9.2542e-02 7.2300e-03 1.5947e-02 -6.0000e+00 2.5970e-01 2.8731e-02 3.5772e-03 4.9368e-03 -6.0000e+00 1.0977e-01 1.9391e-04 -2.3385e-04 9.9779e-05 5.4049e-05 -6.0000e+00 7.1919e-03 1.6995e-02 -5.6567e-05 11 8 0 10 0 0 58.25 17.54 0.59 0.01699 0.01524 57 18 2 8 0 799.960 15.00 17.54 27.46 20.46 20.67 23.4 998.98 -182980 -92594 -96071 -60047 -95778 -54773 -84528 -89096 -95271 -42325 2529 -66620 -43951 -46124 -14627 -39538 5648 -15252 2745 -11039 17782 -22905 -18790 -14296 -13110 -6986 -23068 -5971 -30744 -330 -14073 -12174 -12105 -9202 -7670 -7764 -4327 4112 8948 1606 1566 -4572 4067 -4756 2810 -964 2352 744 4335 964 4932 4047 1325 2190 1166 2738 1322 2602 -1078 2297 -3131 3930 1591 2743 304 1424 -95 312 5044 3594 3306 734 1156 -139 955 -1405 89 -2202 -174 -638 -1325 -599 -2119 -1465 -1093 415 -211 376 10 467 459 532 -4 282 59 -850 331 145 -25 -574 -38 -853 -334 -1131 -213 -1980 -977 -1134 -258 17 317 169 -79 429 -73 567 -253 166 -671 182 -42 690 469 353 815 460 789 840 848 99 456 -122 -89 -284 119 -140 0 163 -108 -311 -66 -398 -256 -4116 -1080 -1257 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