File name: Pandora206s1_BuffaloNY_20240922_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240923T051332.4Z 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 v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240922_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: 20240922 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 20240922T134305.8Z 9031.571595 267 1 24.01 2 62.71 118.80 59.98 276.34 0.00 1 0.00 1 0 25 2.924e-01 3.164e-02 2.540e-01 2.357e-02 2.883010e-01 1.178117e-02 3.479542e-03 -6.000000e+00 1.648133e-01 228.13 -2.00 3.55 -2.00 318.42 0.00e+00 -2.868633e-03 2.312307e-03 1.155323e-03 -6.000000e+00 7.298887e-03 284.42 -2.00 20.00 -2.00 317.65 0.00e+00 2.169 0.000 302.00 328.00 3 7.7312e+00 3.1990e-02 2.6018e-02 -6.0000e+00 4.0988e-01 1.9746e-02 3.6649e-02 1.5199e-02 -6.0000e+00 4.4451e-01 8.2154e-02 2.5184e-02 8.1046e-03 -6.0000e+00 2.6498e-01 -3.7953e-02 1.3208e-02 2.7976e-03 -6.0000e+00 1.1355e-01 1.8950e-05 9.3327e-04 6.6830e-04 2.2683e-05 -6.0000e+00 7.4459e-03 -1.6674e-02 3.6459e-04 12 8 8 10 0 0 -4.84 18.03 2.13 -0.01667 -0.00966 6 6 2 8 0 4000.000 15.00 18.03 27.29 21.06 21.06 24.4 985.88 -42969 86335 22447 102836 159561 69930 97134 80436 28501 89642 98559 68722 -12423 94475 2027 -12636 98288 10486 7264 2950 39056 -9259 11836 16029 -3883 -25099 -7703 9427 3371 43660 -8191 5943 11778 18558 7281 -5145 1186 13573 15053 -1218 -4784 395 219 -1704 5023 5162 -7687 -17113 -7329 1494 6473 -1012 -9001 -4930 -3269 1891 -861 4633 2313 -3824 -5394 6977 10154 24 -35 -742 335 -3581 291 -2121 1716 30 4253 3385 6715 65 5662 -7265 -1009 -3601 -4041 3857 -2133 -7212 -2081 6163 1397 793 -392 1478 726 755 1449 -4798 -161 -3735 3256 927 2613 2134 3673 443 50 -2566 2723 -3427 6528 2264 -1415 -1674 -1457 -194 -5583 -1684 -64 689 -20 -1395 -2252 -30 2309 -1911 1245 806 4781 -3744 -359 -1559 1826 -2308 1710 -137 2354 -1397 1635 2036 -1367 1166 1300 1764 744 -4441 -692 -3179 2116 1065 2363 3667 1714 2232 2157 1437 2815 2869 2685 -1170 3619 216 -1715 4969 1283 964 413 4082 -1516 1650 2329 -719 -6093 -1621 1642 567 4850 -1561 1062 2165 3440 1430 -1076 252 2948 3906 -437 -2003 165 95 -766 2156 2212 -3693 -8517 -3358 624 2706 -495 -5065 -2836 -1941 1092 -526 2703 1349 -2328 -3379 4112 6316 18 -27 -530 218 -2347 190 -1618 1409 26 3629 2821 5078 47 3596 -4903 -651 -2603 -3320 3263 -2074 -7683 -2250 6620 1661 952 -483 1788 818 777 1354 -4521 -156 -4018 3627 1181 3538 2879 4591 528 55 -2928 3233 -4588 8236 3131 -2127 -2689 -2413 -325 -9600 -2689 -93 912 -26 -1924 -3347 -46 3620 -3077 1900 1186 6593 -5369 -470 -2037 2472 -3501 2637 -215 3795 -2333 2819 3696 -2633 2238 2527 3317 1356 -8219 -1194 SS 20240922T144249.9Z 9031.613078 302 1 2.80 2 53.87 132.99 70.26 285.34 0.00 1 0.00 1 0 17 9.322e-03 5.603e-03 2.857e-03 1.249e-03 2.203286e-01 6.218876e-04 2.712124e-03 -6.000000e+00 5.245891e-03 228.13 -2.00 3.55 -2.00 316.58 0.00e+00 3.884286e-04 7.445579e-05 3.811583e-05 -6.000000e+00 2.324908e-04 284.42 -2.00 20.00 -2.00 315.83 0.00e+00 1.691 0.000 302.00 328.00 3 1.7376e+00 1.6258e-03 2.0180e-02 -6.0000e+00 1.3046e-02 -3.4176e-02 1.8219e-03 1.1526e-02 -6.0000e+00 1.4156e-02 2.0140e-03 1.0632e-03 5.6567e-03 -6.0000e+00 8.4383e-03 -1.2775e-03 5.0589e-04 1.6113e-03 -6.0000e+00 3.6113e-03 1.4134e-02 -6.8083e-05 3.4202e-05 1.7651e-05 -6.0000e+00 2.3748e-04 -1.6573e-02 -3.6857e-05 12 1 1 12 1 1 97.70 18.05 0.28 -0.01657 -0.01709 40 208 2 8 0 68.180 15.00 18.05 30.67 21.06 21.06 24.6 1006.63 -1235 -1168 -1031 -2184 -3401 -4189 -2491 -1333 368 -517 -898 -1991 -389 -238 908 -769 228 528 1833 862 764 -3 1314 427 273 622 46 329 -887 297 1825 1061 1825 366 -1497 -2246 -1948 -1479 -268 -334 -825 -931 -487 -668 -271 -242 -387 -417 -475 -243 684 461 844 1192 399 1082 1064 658 539 564 730 1187 945 1592 492 -85 -80 -576 448 222 157 203 89 452 272 -209 -115 -726 -193 -524 -1055 -789 -1959 -1585 -1148 -711 -473 -158 116 199 359 402 80 439 655 56 312 715 262 -266 -300 -516 -577 276 -522 -817 -595 -609 -266 88 254 126 194 88 -25 237 246 219 176 131 -406 -235 168 279 659 512 477 1140 732 464 466 73 -7 169 96 -176 -163 151 -304 -360 -207 -414 -531 -207 -198 -181 -408 -558 -640 -390 -228 70 -106 -183 -402 -85 -54 230 -221 67 160 568 279 254 -1 431 149 100 237 18 121 -301 95 605 377 693 150 -581 -824 -772 -668 -131 -195 -536 -631 -313 -437 -175 -157 -267 -279 -309 -155 451 328 579 861 301 822 827 514 413 427 564 976 845 1411 447 -76 -66 -457 363 190 150 204 91 444 252 -188 -93 -547 -147 -449 -949 -784 -2121 -1656 -1278 -852 -561 -194 144 240 425 434 84 434 673 64 366 872 346 -348 -371 -631 -655 317 -665 -1040 -788 -847 -385 127 387 196 290 123 -34 316 325 281 243 184 -593 -340 238 402 892 663 622 1456 1001 637 673 109 -10 247 150 -292 -261 247 -509 -589 -346 -671 -838 SS 20240922T144747.8Z 9031.616525 305 1 17.35 2 53.21 134.30 71.10 286.07 0.00 1 0.00 1 0 17 8.434e-03 5.621e-03 7.844e-04 3.444e-04 2.170077e-01 1.723896e-04 2.674686e-03 -6.000000e+00 4.746437e-03 228.13 -2.00 3.55 -2.00 316.58 0.00e+00 3.130200e-04 2.064768e-05 3.762610e-05 -6.000000e+00 2.103539e-04 284.42 -2.00 20.00 -2.00 315.84 0.00e+00 1.666 0.000 302.00 328.00 3 9.8373e-01 4.5096e-04 1.9877e-02 -6.0000e+00 1.1804e-02 -3.7574e-02 5.0402e-04 1.1362e-02 -6.0000e+00 1.2808e-02 2.1818e-03 2.9424e-04 5.5709e-03 -6.0000e+00 7.6347e-03 -1.7277e-03 1.4032e-04 1.5732e-03 -6.0000e+00 3.2677e-03 3.1031e-02 8.0319e-05 9.4726e-06 1.7475e-05 -6.0000e+00 2.1485e-04 -1.6737e-02 -1.8843e-05 12 1 1 12 1 1 99.69 18.05 0.33 -0.01674 -0.01613 591 502 2 8 0 28.200 15.00 18.05 31.05 21.06 21.06 24.7 1009.58 -1264 -1371 -726 -2221 -3258 -2888 -1673 -376 348 -187 -1416 -1776 -974 -772 315 270 -206 176 532 1153 776 129 697 736 273 736 382 109 -649 453 1467 869 1816 298 -1751 -1826 -1649 -1273 -384 -130 -680 -751 -594 -737 -132 -357 -410 -362 -659 -198 766 749 740 1129 721 1060 873 631 504 469 929 1072 1244 1613 406 -206 -173 -627 381 437 207 210 29 337 154 -37 -119 -665 -198 -461 -948 -827 -1986 -1625 -1171 -840 -429 -323 266 169 318 333 187 486 607 234 361 775 230 -245 -148 -496 -535 48 -504 -842 -710 -674 -367 154 266 232 140 136 11 188 222 267 187 186 -305 -155 211 174 743 558 468 1155 817 450 396 25 -68 54 -27 -23 -248 128 -180 -348 -260 -465 -478 -212 -255 -139 -414 -532 -434 -259 -64 66 -38 -289 -357 -213 -192 80 76 -60 53 165 368 255 42 227 254 99 277 147 40 -217 143 481 305 679 120 -670 -656 -641 -564 -202 -74 -434 -499 -407 -513 -91 -246 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