File name: Pandora206s1_BuffaloNY_20241102_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20241103T050327.4Z 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 v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20241102_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: 20241102 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 20241102T140038.7Z 9072.583781 112 1 26.41 2 70.92 134.23 83.24 129.85 0.00 1 0.00 1 0 17 2.279e-02 5.827e-03 2.957e-02 3.251e-03 3.751971e-01 1.602511e-03 4.516229e-03 -6.000000e+00 1.261919e-02 223.80 -2.00 3.55 -2.00 318.97 0.00e+00 5.134369e-04 3.709263e-04 1.586934e-04 -6.000000e+00 5.563302e-04 279.27 -2.00 20.00 -2.00 318.32 0.00e+00 3.023 0.000 302.00 328.00 3 4.1420e+00 4.3877e-03 3.5191e-02 -6.0000e+00 3.1128e-02 2.1766e-02 5.0758e-03 1.9415e-02 -6.0000e+00 3.3908e-02 -1.2184e-02 3.7313e-03 9.7021e-03 -6.0000e+00 2.0218e-02 -1.3035e-03 1.9842e-03 2.8772e-03 -6.0000e+00 8.6939e-03 2.8176e-04 -1.8626e-04 9.0834e-05 2.9641e-05 -6.0000e+00 5.7987e-04 -1.7479e-02 1.6329e-05 10 0 0 10 0 0 99.63 18.20 0.29 -0.01748 -0.01888 20 20 2 8 0 1320.290 15.00 18.20 14.04 21.79 21.58 23.6 928.44 -7173 5271 544 -4170 -2046 -495 -10076 1851 -11060 -194 -5143 -2560 -8699 -3606 -4203 -3847 -1394 3254 1609 3701 -2270 -7791 934 892 -1467 -3435 -802 -2703 -1473 -815 687 2129 2994 -1229 -1625 -4551 -790 -2737 -157 -401 -597 -217 -311 -380 82 -594 -1289 -1836 290 250 266 1684 758 1734 908 1602 440 841 -325 1367 86 1408 1046 1321 823 148 -339 -1190 875 340 657 378 466 660 259 189 -600 -1199 -637 -369 -407 -447 -2592 -1464 -1183 -791 -431 20 292 598 453 541 781 756 708 134 1129 984 282 -106 -53 -911 -626 -323 -193 -1383 -864 -713 -300 -94 57 300 -360 195 38 315 200 39 -68 -86 -34 -245 438 299 518 348 234 698 827 295 628 64 -74 -120 -413 -542 126 200 202 -260 4 -124 -520 -226 169 20 -154 -65 -15 -345 63 -487 -8 -237 -117 -488 -229 -318 -336 -128 303 162 381 -257 -922 103 106 -191 -480 -112 -370 -185 -100 91 310 481 -224 -282 -767 -139 -568 -39 -113 -190 -73 -109 -136 29 -215 -467 -662 102 89 101 694 337 818 454 816 233 446 -170 691 45 779 611 846 550 94 -202 -735 529 237 510 296 367 523 192 126 -382 -730 -402 -254 -320 -377 -2438 -1422 -1224 -842 -482 23 340 673 473 542 722 675 672 144 1287 1216 382 -143 -68 -1123 -704 -363 -237 -1754 -1138 -993 -424 -143 89 491 -580 307 55 445 280 56 -101 -137 -55 -392 681 448 765 494 316 974 1202 452 1025 110 -126 -210 -749 -1042 247 400 409 -514 7 -233 -947 SS 20241102T141918.5Z 9072.596742 120 1 26.17 2 68.56 138.32 80.80 133.30 0.00 1 0.00 1 0 17 1.839e-02 5.646e-03 1.980e-02 3.102e-03 3.379859e-01 1.524228e-03 4.095066e-03 -6.000000e+00 1.018368e-02 223.80 -2.00 3.55 -2.00 318.49 0.00e+00 3.764084e-04 3.054602e-04 1.083797e-04 -6.000000e+00 4.489747e-04 279.27 -2.00 20.00 -2.00 317.83 0.00e+00 2.711 0.000 302.00 328.00 3 4.4654e+00 4.1062e-03 3.1588e-02 -6.0000e+00 2.5120e-02 9.6232e-03 4.6946e-03 1.7419e-02 -6.0000e+00 2.7365e-02 -4.0416e-03 3.2240e-03 8.6982e-03 -6.0000e+00 1.6317e-02 -3.6236e-03 1.7042e-03 2.5399e-03 -6.0000e+00 7.0150e-03 2.8888e-04 -2.8403e-04 8.6221e-05 2.5868e-05 -6.0000e+00 4.6805e-04 -1.6657e-02 2.0280e-06 10 0 0 10 0 0 99.75 18.19 0.36 -0.01666 -0.01879 16 16 2 8 0 1635.560 15.00 18.19 14.52 21.69 21.58 23.5 930.58 -4143 3533 -5319 -3583 -7629 -2723 -7792 -4770 492 -685 -371 -2699 -7956 -5684 720 -371 1998 461 342 247 2883 -3069 2405 -462 -1694 -2592 -1540 -236 -1230 500 1137 1809 1706 410 -727 -3917 -4382 -1055 -453 -1153 -501 -293 262 -396 183 -704 -95 -1927 273 -166 153 1414 -45 551 1040 705 -433 996 432 421 1260 2076 1497 1941 1053 262 -494 -1043 526 5 466 419 -740 859 338 -191 600 -918 -513 -822 -527 -641 -2315 -1189 -684 -367 38 -179 368 789 235 574 405 388 567 -358 859 554 271 -441 17 -570 -980 -141 -340 -1001 -1284 -387 -541 -97 9 290 -166 173 -101 255 273 436 -13 135 -354 -80 254 154 611 419 487 954 669 87 560 78 -150 51 17 10 142 -34 3 -470 -55 -327 -471 -186 168 -293 -189 -380 -121 -383 -255 28 -44 -24 -178 -630 -502 70 -42 236 58 45 34 403 -451 339 -72 -284 -461 -279 -40 -202 79 194 337 340 89 -152 -821 -970 -260 -134 -401 -195 -120 108 -167 79 -308 -41 -834 115 -71 69 665 -23 297 585 406 -252 574 252 241 730 1243 991 1361 768 185 -328 -679 351 3 376 357 -642 708 269 -141 407 -599 -346 -615 -435 -578 -2246 -1189 -709 -409 44 -213 440 911 260 594 397 365 562 -389 1008 698 362 -592 22 -697 -1132 -163 -420 -1290 -1734 -534 -770 -148 15 467 -264 262 -148 356 378 610 -18 211 -559 -127 392 229 877 591 668 1294 961 132 889 127 -249 86 30 18 264 -65 5 -886 -101 -591 -827 SS 20241102T142437.6Z 9072.600436 123 1 6.10 2 67.93 139.52 80.13 134.31 0.00 1 0.00 1 0 17 2.073e-02 6.379e-03 3.234e-02 5.909e-03 3.272717e-01 2.897247e-03 3.969628e-03 -6.000000e+00 1.147835e-02 223.80 -2.00 3.55 -2.00 318.20 0.00e+00 -7.706162e-05 5.368788e-04 1.761465e-04 -6.000000e+00 5.059358e-04 279.27 -2.00 20.00 -2.00 317.53 0.00e+00 2.638 0.000 302.00 328.00 3 4.1944e+00 7.7403e-03 3.0675e-02 -6.0000e+00 2.8314e-02 7.1420e-03 8.8162e-03 1.6840e-02 -6.0000e+00 3.0839e-02 -4.4978e-03 5.8652e-03 8.4014e-03 -6.0000e+00 1.8388e-02 -1.5670e-03 3.0793e-03 2.4219e-03 -6.0000e+00 7.9113e-03 4.1322e-04 3.1464e-04 1.6332e-04 2.4897e-05 -6.0000e+00 5.2730e-04 -2.3391e-02 -1.2025e-04 12 1 1 12 1 1 93.89 18.18 0.23 -0.02339 -0.02103 3 18 2 8 0 1524.110 14.99 18.18 14.58 21.69 21.58 23.5 930.98 -8286 -6803 6640 -2057 3605 -2176 -5203 7060 -3917 5599 -3685 2452 -6236 551 -1658 1334 -3597 2543 -600 1804 5750 2931 5297 -1054 1378 -4417 1036 -1965 -1331 -1077 241 -1177 3593 -2344 -1456 -2693 -2106 841 -847 391 -136 -1134 -842 -529 -2425 -892 479 -785 41 -1382 549 1550 361 2222 605 -91 1412 263 1293 566 363 309 -167 1845 1052 -429 103 -1603 -79 -221 658 338 445 1502 430 471 -557 -144 149 -276 -234 -701 -1766 -1676 -17 -1414 -930 -342 532 -264 187 -85 256 350 928 200 740 1371 60 324 -488 -834 -773 284 -714 -483 -1045 -612 333 49 443 449 821 -91 445 -253 -38 137 -204 365 -215 -317 163 -287 742 367 -8 1063 242 70 -92 -396 -330 -356 -447 115 -205 296 692 -449 -93 -223 93 -470 -431 389 -128 193 -115 -301 405 -285 405 -293 185 -583 56 -194 173 -522 364 -93 286 903 468 839 -191 260 -927 211 -393 -244 -200 46 -249 798 -596 -345 -610 -515 231 -274 150 -57 -504 -387 -247 -1148 -418 220 -358 18 -631 261 794 199 1237 358 -56 872 165 783 339 223 203 -117 1383 817 -315 73 -1120 -57 -176 559 304 401 1294 350 356 -396 -96 103 -210 -197 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