File name: Pandora206s1_BuffaloNY_20241211_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20241212T051156.1Z 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_20241211_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: 20241211 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 20241211T143715.1Z 9111.609202 189 1 26.75 2 74.69 144.17 122.93 17.25 0.00 1 0.00 1 0 25 1.228e-01 8.906e-03 2.314e-01 6.955e-03 5.126134e-01 3.536331e-03 6.087408e-03 -6.000000e+00 6.810403e-02 222.37 -2.00 3.55 -2.00 320.13 0.00e+00 7.193714e-04 1.178473e-03 7.189628e-04 -6.000000e+00 3.199622e-03 274.71 -2.00 20.00 -2.00 319.61 0.00e+00 3.718 0.001 302.00 328.00 3 4.3931e+00 1.0238e-02 4.4939e-02 -6.0000e+00 1.6766e-01 3.2614e-02 1.2661e-02 2.7174e-02 -6.0000e+00 1.8313e-01 -3.3952e-03 1.2211e-02 1.3841e-02 -6.0000e+00 1.0857e-01 -1.1831e-02 6.3545e-03 4.2792e-03 -6.0000e+00 4.6890e-02 9.5463e-05 -7.7168e-04 1.9374e-04 4.5522e-05 -6.0000e+00 3.2324e-03 -9.3937e-03 0.0000e+00 11 8 0 10 0 0 99.96 18.12 0.44 -0.00939 -0.01519 8 8 4 8 0 3343.660 15.00 18.12 12.07 21.69 21.48 23.7 947.83 -18253 26726 900000 22510 900000 13059 900000 -29394 65328 -28049 900000 70352 -18359 -9503 -20425 17922 12000 38387 19657 -1838 5359 10733 3372 29768 -9194 10289 -4488 41466 -4946 14337 6979 6716 16144 -3071 8020 -3015 -6310 -5108 6814 -3419 -1277 -1927 2473 -2665 -3643 -5655 -6200 -8671 944 1291 -1410 4041 -1368 4187 2286 2350 -507 3576 1269 -3501 1125 2237 376 -930 844 -1275 -1634 -3380 3108 -1130 4032 -122 516 1052 628 2755 -68 470 -2763 -52 -1104 -1404 -3112 -340 -845 1095 -62 -259 843 -126 -78 -550 670 -1717 204 -940 1978 821 1003 806 442 -943 469 -443 -186 -1367 -1617 185 -342 379 -110 1632 -786 79 179 661 -497 -375 22 -483 54 -1194 1000 -193 -502 520 127 691 1258 -48 899 143 -82 -765 -317 -435 -146 37 -328 419 -259 304 281 -148 181 900000 157 900000 89 900000 -360 443 -435 900000 477 -341 -202 -594 427 338 906 606 -74 210 397 138 1028 -509 499 -263 1487 -266 646 388 433 1087 -269 624 -249 -588 -530 768 -522 -218 -355 459 -536 -742 -1195 -1332 -1928 195 276 -338 1023 -396 1246 716 761 -175 1193 434 -1227 383 814 151 -426 403 -596 -734 -1550 1418 -622 2293 -76 322 623 356 1366 -32 217 -1368 -29 -707 -1028 -2478 -277 -737 1007 -59 -255 830 -122 -72 -469 546 -1412 174 -922 2087 974 1270 1026 546 -1106 490 -463 -211 -1620 -2010 240 -467 564 -177 2641 -1297 127 268 948 -716 -560 34 -793 88 -1929 1535 -297 -736 746 175 951 1858 -77 1566 259 -154 -1477 -636 -926 -310 80 -718 898 -529 602 535 SS 20241211T144813.3Z 9111.616821 191 1 27.22 2 73.55 146.51 122.27 20.17 0.00 1 0.00 1 0 17 9.991e-02 6.315e-03 1.572e-01 5.399e-03 4.824579e-01 2.690300e-03 5.724894e-03 -6.000000e+00 5.498636e-02 222.37 -2.00 3.55 -2.00 319.97 0.00e+00 7.558861e-04 8.500641e-04 4.819141e-04 -6.000000e+00 2.392451e-03 274.71 -2.00 20.00 -2.00 319.45 0.00e+00 3.475 0.001 302.00 328.00 3 4.1419e+00 7.7077e-03 4.1995e-02 -6.0000e+00 1.3542e-01 8.4679e-03 9.3806e-03 2.5246e-02 -6.0000e+00 1.4779e-01 -1.1405e-03 8.6547e-03 1.2870e-02 -6.0000e+00 8.7983e-02 -9.2676e-03 4.5371e-03 3.9757e-03 -6.0000e+00 3.7783e-02 1.6145e-04 -6.7408e-04 1.4938e-04 4.1184e-05 -6.0000e+00 2.5411e-03 -8.7963e-03 0.0000e+00 10 0 0 10 0 0 99.95 18.13 0.47 -0.00880 -0.01386 14 14 2 8 0 1943.560 14.99 18.13 12.30 21.69 21.48 23.8 949.63 -28249 -39120 43353 2332 6890 36248 -13259 -4653 -22871 55677 28385 14984 -32963 13586 -12153 19903 6355 17653 -4421 6080 15716 -975 -1624 -4811 -4777 -11457 7822 4027 -5842 2405 6864 -652 6286 -452 -4350 -4663 -9909 2419 2019 3443 -2734 -1887 -300 237 -890 -1059 -5937 -3506 -34 249 2278 1220 -686 2473 1697 -917 1640 1200 1013 -1817 1099 -436 834 1089 1261 -7 -1554 -1042 133 -68 1663 848 304 971 398 389 -435 -1081 -2064 -1460 -519 -114 -1545 -1796 -884 374 1007 -222 1139 417 -56 514 2361 -295 42 -85 198 814 667 -110 -159 210 -932 -421 -693 -1051 -1322 -467 -514 -202 425 771 -13 -506 289 -11 -332 -250 516 131 -81 -607 368 20 128 157 330 1036 706 -10 404 380 -250 202 -260 -131 -731 117 186 104 -473 30 156 -330 -600 332 27 68 252 -162 -59 -400 493 340 215 -875 293 -395 560 227 610 -205 269 655 -48 -82 -275 -295 -805 471 243 -366 147 455 -51 525 -45 -427 -437 -1066 267 274 561 -540 -395 -65 53 -200 -242 -1434 -831 -8 60 583 350 -217 821 578 -331 597 441 379 -684 409 -171 361 525 640 -3 -738 -492 66 -39 1047 545 197 623 238 208 -213 -539 -1059 -867 -353 -84 -1273 -1555 -810 350 987 -228 1164 417 -54 456 1926 -243 38 -86 218 975 877 -146 -198 247 -1008 -451 -812 -1310 -1664 -620 -730 -302 692 1269 -22 -826 436 -16 -486 -381 800 217 -135 -991 579 30 192 226 451 1417 1070 -16 709 681 -465 392 -522 -279 -1548 251 402 225 -974 60 303 SS 20241211T153538.1Z 9111.649746 217 1 27.99 2 69.46 157.16 118.42 32.16 0.00 1 0.00 1 0 17 5.531e-02 6.380e-03 5.187e-02 4.444e-03 3.965370e-01 2.180421e-03 4.802492e-03 -6.000000e+00 3.043811e-02 222.37 -2.00 3.55 -2.00 319.15 0.00e+00 1.305896e-03 5.299903e-04 3.145300e-04 -6.000000e+00 1.324370e-03 274.70 -2.00 20.00 -2.00 318.60 0.00e+00 2.822 0.000 302.00 328.00 3 4.5599e+00 5.9838e-03 3.4197e-02 -6.0000e+00 7.4961e-02 3.0484e-04 6.9481e-03 2.0597e-02 -6.0000e+00 8.1816e-02 5.3774e-03 5.4148e-03 1.0342e-02 -6.0000e+00 4.8706e-02 -9.7480e-03 2.9025e-03 3.2780e-03 -6.0000e+00 2.0913e-02 2.1760e-04 -8.0676e-04 1.2301e-04 3.3007e-05 -6.0000e+00 1.4068e-03 -7.9413e-03 0.0000e+00 12 1 1 12 1 1 99.98 18.12 0.35 -0.00794 -0.01400 12 6 1 8 0 2152.960 15.00 18.12 12.53 21.69 21.48 23.6 950.14 -23491 14557 -5636 23006 2947 20156 -10342 -1300 -21870 -31111 16795 73 2672 1159 -566 -4904 3086 -4019 4920 -3911 10037 -4217 264 5215 -6166 2697 -1480 6822 -5673 1552 -2250 6777 -426 -1488 -867 1719 -6082 -298 30 -1229 -57 -3552 1428 -1574 124 2364 -431 -6404 836 -2135 587 557 690 1834 625 1389 899 1816 -548 440 640 1122 990 1737 763 484 -414 -699 332 -528 1394 160 40 217 284 -241 390 -2017 1642 -1166 -299 -566 -1962 -1266 -683 159 -339 396 325 294 15 213 477 -310 686 156 327 713 341 -129 644 -690 -607 -386 -160 -615 -955 -543 -415 -125 261 528 -418 -328 72 166 424 134 -407 18 -712 -309 -120 848 513 620 344 723 687 240 795 59 95 -227 -278 -495 37 -107 388 -43 144 -304 -548 -684 336 -171 516 72 401 -285 -37 -860 -1474 499 3 110 58 -35 -367 232 -333 412 -375 867 -416 25 514 -726 306 -181 738 -649 164 -274 847 -64 -247 -136 248 -1030 -55 6 -323 -17 -1145 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