File name: Pandora206s1_BuffaloNY_20240319_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240320T052816.3Z 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_20240319_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: 20240319 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 20240319T135125.7Z 8844.577381 223 1 24.01 2 63.94 117.50 111.80 6.16 0.00 1 0.00 1 0 25 4.244e-01 1.801e-02 2.391e-01 1.283e-02 4.306618e-01 6.454697e-03 5.203454e-03 -6.000000e+00 2.362670e-01 226.22 -2.00 3.55 -2.00 319.53 0.00e+00 4.027401e-03 1.752353e-03 1.098328e-03 -6.000000e+00 1.093143e-02 274.98 -2.00 20.00 -2.00 318.97 0.00e+00 2.263 0.000 302.00 328.00 3 6.8024e+00 1.8068e-02 3.2549e-02 -6.0000e+00 5.8637e-01 4.8921e-02 2.1283e-02 2.5143e-02 -6.0000e+00 6.3947e-01 1.6059e-02 1.7872e-02 1.1379e-02 -6.0000e+00 3.7952e-01 -1.6797e-02 9.4868e-03 5.5622e-03 -6.0000e+00 1.6176e-01 3.4662e-05 3.4789e-04 3.6028e-04 4.1396e-05 -6.0000e+00 1.1205e-02 1.9773e-02 -2.2948e-05 12 8 8 10 0 0 99.81 17.56 0.72 0.01977 0.02239 6 6 4 8 0 4000.000 15.00 17.56 6.55 21.17 20.96 20.2 955.86 -38741 149067 155379 900000 900000 49865 -50667 393224 33148 127707 37221 900000 -30278 43625 27916 29652 42574 12734 -4313 -10400 42747 -5715 41242 1710 113 1110 826 16600 -23820 16242 -2419 5097 -8691 6005 9242 7936 -7838 6203 6782 -4017 2597 -3002 807 1004 4838 -2847 -9461 -9597 8706 -3599 -542 -288 -2762 -650 2356 5552 -4287 -2378 -5070 -2089 -1874 5111 330 1148 -707 6709 -2045 568 619 -1599 -1492 -1021 1120 2352 -1064 -2170 29686 809 -2883 -1796 631 -495 -1468 -614 -838 2798 1889 -933 -568 1527 -846 -378 -671 -411 986 -677 1865 10 -1773 1029 450 -1587 -218 -828 252 -867 -650 632 -743 1183 241 1134 696 -353 -135 1330 -632 65 -1350 -3891 -298 -712 -121 294 851 176 201 432 2559 -4 809 595 -114 -196 291 -808 467 -54 821 375 118 -1385 -427 -984 1864 1943 900000 900000 623 -1553 4916 566 1597 651 900000 -1331 1164 1025 1244 1700 739 -307 -825 2103 -449 2096 138 10 99 75 1225 -2517 1205 -248 547 -1213 763 1051 899 -1157 928 1225 -929 619 -796 216 273 1278 -826 -2938 -2996 2363 -1104 -176 -102 -1070 -265 966 2249 -1960 -1055 -2248 -892 -830 2312 175 661 -420 3447 -1099 297 350 -1066 -1053 -744 813 1598 -685 -1259 11876 424 -1658 -1189 464 -401 -1285 -557 -817 2810 2004 -1016 -634 1592 -829 -350 -581 -355 918 -703 2138 13 -2455 1348 552 -1856 -232 -919 302 -1096 -836 848 -1080 1839 395 1887 1127 -559 -197 1808 -884 95 -2129 -6426 -488 -1134 -186 430 1211 241 263 581 3722 -7 1352 1036 -199 -359 567 -1619 940 -112 1677 757 228 -2584 -792 SS 20240319T141015.7Z 8844.590460 234 1 26.63 2 60.94 121.59 111.36 10.52 0.00 1 0.00 1 0 17 2.173e-02 6.191e-03 2.895e-02 3.558e-03 3.851726e-01 1.752406e-03 4.584363e-03 -6.000000e+00 1.207681e-02 226.22 -2.00 3.55 -2.00 318.68 0.00e+00 1.160729e-03 3.677913e-04 1.737292e-04 -6.000000e+00 5.205790e-04 274.99 -2.00 20.00 -2.00 318.09 0.00e+00 2.050 0.000 302.00 328.00 3 5.2767e+00 4.7559e-03 2.8406e-02 -6.0000e+00 2.9990e-02 1.2073e-02 5.4473e-03 1.9938e-02 -6.0000e+00 3.2704e-02 -4.4112e-03 3.8992e-03 9.9207e-03 -6.0000e+00 1.9414e-02 -3.8254e-03 2.0703e-03 3.0883e-03 -6.0000e+00 8.2200e-03 2.1677e-04 5.3390e-05 9.7509e-05 2.9660e-05 -6.0000e+00 5.5395e-04 2.0876e-02 -9.8585e-05 10 0 0 10 0 0 99.76 17.56 0.32 0.02088 0.02128 12 12 2 8 0 2219.010 14.99 17.56 7.17 21.17 20.96 20.1 958.69 -8549 6847 4143 4731 1452 7524 -4995 -268 -6769 -7388 -964 -3578 -4954 -4126 4969 469 -293 -5219 -2744 -289 1844 -1708 1096 -672 -227 -867 -1570 583 -7695 420 -414 1518 -174 -74 -3149 -2414 -2862 2991 -963 -2477 -72 -1177 -183 -851 973 -80 -1621 -2173 486 -2309 541 1383 480 1529 1113 985 534 961 184 833 1694 1968 973 2551 -452 1084 -1219 -97 829 379 899 643 318 695 146 363 -330 -822 -783 -656 -822 -1286 -2560 -1636 -1187 -217 -223 -166 377 949 49 8 434 169 210 428 549 485 473 -34 240 -876 -405 -86 -655 -742 -772 -530 -528 143 301 309 -56 -137 -415 357 123 411 -148 155 -304 -246 310 49 521 347 751 967 868 517 79 123 -377 -191 -118 -261 263 122 -90 85 100 -429 -686 -326 251 164 175 49 233 -189 -11 -332 -390 -47 -192 -319 -314 410 46 -30 -595 -322 -35 228 -216 140 -91 -33 -135 -248 85 -1142 59 -66 261 -33 -15 -613 -460 -610 679 -277 -829 -26 -448 -72 -339 381 -32 -652 -873 191 -954 236 650 235 791 600 544 304 539 101 450 941 1187 635 1784 -327 715 -783 -63 561 288 742 552 271 562 113 248 -215 -523 -538 -504 -697 -1188 -2489 -1646 -1279 -241 -260 -193 448 1070 52 8 408 158 213 475 666 627 649 -46 307 -1060 -466 -100 -813 -964 -1052 -742 -765 218 478 500 -90 -212 -608 490 170 597 -226 243 -478 -387 471 74 735 483 1016 1307 1254 791 126 204 -640 -330 -213 -494 492 235 -173 160 179 -759 -1189 SS 20240319T142943.3Z 8844.603973 244 1 45.79 2 57.98 126.08 110.64 14.96 0.00 1 0.00 1 0 17 1.425e-02 5.279e-03 1.437e-02 2.228e-03 3.562944e-01 1.093491e-03 4.247972e-03 -6.000000e+00 7.919547e-03 226.22 -2.00 3.55 -2.00 318.47 0.00e+00 4.476926e-04 2.151209e-04 1.208941e-04 -6.000000e+00 3.413692e-04 274.99 -2.00 20.00 -2.00 317.87 0.00e+00 1.879 0.000 302.00 328.00 3 5.0271e+00 2.9478e-03 2.6124e-02 -6.0000e+00 1.9666e-02 5.4793e-03 3.3656e-03 1.8311e-02 -6.0000e+00 2.1446e-02 -3.7919e-03 2.3251e-03 9.1337e-03 -6.0000e+00 1.2731e-02 -4.6920e-03 1.2248e-03 2.6563e-03 -6.0000e+00 5.3906e-03 3.4303e-04 -2.1242e-06 6.1670e-05 2.6882e-05 -6.0000e+00 3.6324e-04 2.0466e-02 -1.0130e-04 10 0 0 10 0 0 99.84 17.57 0.41 0.02047 0.02045 38 12 1 8 0 1204.990 15.00 17.57 7.47 21.17 20.96 20.0 960.31 -5865 -1573 1818 -2324 -3752 -972 -6795 -607 -1936 1152 1514 -3734 -5372 -1294 -1369 -1924 -205 -1324 10 862 -1925 -1147 -1172 -559 1587 248 2097 -3027 -3546 186 -921 3669 1031 1647 -1071 -1645 -2031 -1548 440 -612 -1073 -1207 -572 -883 -313 -776 -865 -1291 -457 -471 1232 739 755 839 979 1066 464 896 225 627 890 1265 1448 2000 156 -185 105 -665 648 229 487 584 267 664 158 -107 -84 -743 -574 -862 -660 -863 -2217 -1490 -769 -390 -83 -123 478 476 678 427 535 459 225 -46 356 715 159 -83 119 -889 -685 -70 -579 -958 -769 -459 -252 52 383 207 -71 -301 -239 169 139 310 245 0 -322 -124 196 87 779 347 607 796 530 288 301 124 -112 55 -194 -136 109 89 -144 -106 45 -381 -496 -261 -75 96 -120 -172 -42 -338 -32 -117 72 93 -255 -437 -119 -134 -215 -24 -164 1 115 -269 -157 -166 -85 249 41 380 -541 -594 30 -169 705 206 341 -231 -350 -483 -389 132 -220 -425 -500 -244 -382 -134 -336 -371 -549 -192 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