File name: Pandora206s1_BuffaloNY_20231031_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20231103T095347.0Z 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 v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231031_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: 20231031 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 20231031T132657.1Z 8704.560383 250 1 27.59 2 74.89 126.70 74.79 290.96 0.00 1 0.00 1 0 17 2.469e-01 7.452e-03 1.631e-01 4.338e-03 4.854730e-01 2.167435e-03 5.666049e-03 -6.000000e+00 1.363812e-01 224.08 -2.00 3.55 -2.00 320.06 0.00e+00 1.424261e-03 7.204486e-04 2.900379e-04 -6.000000e+00 6.030158e-03 279.65 -2.00 20.00 -2.00 319.45 0.00e+00 3.763 0.001 302.00 328.00 3 3.6992e+00 6.3285e-03 4.4397e-02 -6.0000e+00 3.3653e-01 2.9946e-02 7.7221e-03 2.5279e-02 -6.0000e+00 3.6704e-01 -2.5337e-02 6.9012e-03 1.2913e-02 -6.0000e+00 2.1883e-01 3.3843e-03 3.5824e-03 4.2797e-03 -6.0000e+00 9.3625e-02 1.9083e-04 1.4891e-04 1.2042e-04 4.3017e-05 -6.0000e+00 6.2870e-03 1.0807e-02 -1.5746e-05 12 9 1 12 1 1 99.98 17.89 0.37 0.01081 0.01193 23 24 2 8 0 1149.320 15.00 17.89 9.84 21.38 21.27 18.6 905.24 -108022 53477 -26741 33001 -41934 37061 -33533 -15599 -21199 204910 123095 -36128 32657 -14354 -1568 -14050 15315 6 5104 -6595 5351 -8125 -569 11102 -2837 -1084 66 4423 -14875 17139 -2783 890 -16972 382 999 -4965 -2650 -1106 6128 -1544 5611 -1356 3696 -9199 2685 -1026 -1058 -4265 1868 -945 830 2133 902 2642 -3625 2214 -244 1563 -894 139 482 2728 1024 2236 1172 894 2570 -158 566 -674 1521 -460 1768 583 881 -1747 -1053 2376 -1603 -1146 -978 64 -2755 -951 -1344 563 -217 516 880 1041 582 727 -441 -533 -12 -433 -96 897 626 -662 165 -1108 -654 -822 -385 -1548 -911 -338 -31 37 576 496 -231 293 -595 397 -309 439 -122 129 -630 69 45 318 965 144 579 560 601 17 495 -187 6 -189 79 -189 121 -55 200 53 -7 -399 -518 -2861 339 -406 267 -637 261 -497 -219 -359 867 570 -848 493 -409 -48 -573 509 0 219 -335 248 -427 -29 549 -172 -69 4 259 -1001 873 -200 70 -1754 37 90 -467 -271 -131 827 -259 980 -269 733 -2117 551 -222 -231 -970 409 -221 210 588 271 845 -1300 772 -90 563 -321 49 174 1052 450 1079 564 425 1161 -74 285 -381 929 -299 1114 353 489 -926 -511 1098 -843 -674 -661 48 -2231 -793 -1209 532 -217 528 900 1020 528 636 -367 -445 -11 -436 -105 1110 804 -879 203 -1253 -703 -907 -445 -1900 -1168 -459 -44 58 927 827 -381 456 -901 564 -444 657 -196 211 -1033 113 72 484 1391 209 800 798 918 28 865 -345 12 -367 165 -399 259 -121 439 111 -15 -788 -996 SS 20231031T133257.7Z 8704.564556 252 1 26.55 2 74.02 127.91 75.77 291.85 0.00 1 0.00 1 0 25 2.264e-01 9.620e-03 2.543e-01 8.618e-03 4.652179e-01 4.319648e-03 5.398063e-03 -6.000000e+00 1.251100e-01 224.08 -2.00 3.55 -2.00 320.11 0.00e+00 -3.455730e-04 1.440150e-03 3.680711e-04 -6.000000e+00 5.528114e-03 279.65 -2.00 20.00 -2.00 319.49 0.00e+00 3.570 0.001 302.00 328.00 3 4.7252e+00 1.2662e-02 4.2250e-02 -6.0000e+00 3.0872e-01 3.0566e-02 1.5555e-02 2.4242e-02 -6.0000e+00 3.3665e-01 3.6483e-02 1.4064e-02 1.2281e-02 -6.0000e+00 2.0073e-01 -2.8921e-02 7.2746e-03 3.6439e-03 -6.0000e+00 8.5920e-02 8.2354e-05 5.1474e-04 2.4431e-04 3.8699e-05 -6.0000e+00 5.7627e-03 9.5359e-03 8.5731e-05 12 8 8 10 0 0 99.97 17.89 0.23 0.00954 0.01340 23 23 2 8 0 1154.200 15.00 17.89 10.24 21.38 21.27 18.8 908.90 -55740 139411 -71 -5622 -28838 119567 64668 47197 28934 5741 128090 -25919 -2945 2712 29367 -3166 65006 10426 24608 10383 13656 -3840 862 5182 -6439 3121 -12858 4107 -15353 16701 -10662 -1564 3576 10484 -868 1075 6804 241 7590 -1323 5433 -796 3756 -4657 5934 -3560 -52 -7439 411 -2486 -2324 960 -1267 571 -714 1075 -457 413 -231 893 594 2351 -5824 3350 129 2545 2339 -238 -36 -125 -972 -657 3257 -11 -3074 -5786 355 2010 -1357 640 -51 543 -4999 -773 -1425 1727 57 621 1325 2624 -419 2269 -187 685 1149 75 1480 340 560 130 429 -924 -728 -516 -428 -2297 -380 -201 -335 33 717 479 -345 127 -418 597 -670 -48 -815 243 -294 -566 431 715 936 -9 -245 128 840 -351 24 -682 -563 211 89 -311 86 623 449 64 -270 -344 -91 -888 1172 -1 -68 -390 1005 543 397 324 86 1076 -583 -64 68 679 -115 1346 390 856 439 578 -193 43 275 -414 194 -933 248 -1059 862 -825 -126 311 914 -79 94 629 27 976 -225 968 -160 757 -1039 1192 -798 -11 -1746 91 -586 -600 265 -386 185 -246 377 -168 150 -82 309 212 899 -2699 1569 62 1162 1030 -108 -18 -69 -595 -418 1980 -7 -1800 -3106 164 897 -681 367 -34 391 -4123 -640 -1276 1606 57 631 1340 2512 -381 1857 -152 551 1008 73 1612 411 726 166 527 -1046 -755 -548 -496 -2850 -485 -264 -471 50 1152 798 -568 202 -623 831 -950 -70 -1293 402 -489 -915 672 1065 1366 -13 -331 177 1282 -576 42 -1265 -1076 406 185 -679 190 1404 1015 138 -560 -681 -181 SS 20231031T134929.9Z 8704.576040 261 1 11.72 2 71.69 131.33 78.44 294.30 0.00 1 0.00 1 0 17 7.473e-02 6.251e-03 5.394e-02 3.956e-03 4.132352e-01 1.958407e-03 4.932806e-03 -6.000000e+00 4.125539e-02 224.08 -2.00 3.55 -2.00 319.45 0.00e+00 3.993147e-04 5.289640e-04 2.455559e-04 -6.000000e+00 1.825557e-03 279.65 -2.00 20.00 -2.00 318.81 0.00e+00 3.143 0.001 302.00 328.00 3 3.4224e+00 5.4993e-03 3.7337e-02 -6.0000e+00 1.0180e-01 3.1344e-03 6.4716e-03 2.1512e-02 -6.0000e+00 1.1105e-01 -5.7530e-03 5.1197e-03 1.0723e-02 -6.0000e+00 6.6207e-02 -3.2937e-03 2.7005e-03 3.1231e-03 -6.0000e+00 2.8313e-02 4.9579e-04 -4.9153e-04 1.1034e-04 3.3329e-05 -6.0000e+00 1.9036e-03 1.1712e-02 -1.3840e-04 12 1 1 12 1 1 99.99 17.90 0.40 0.01171 0.00802 20 48 2 8 0 557.930 15.00 17.90 11.88 21.48 21.27 18.8 918.00 62925 -17531 -8890 -18942 -15007 -20933 -12807 -27335 -18976 -16363 -3341 -11345 -4950 -13182 -3827 -7812 3477 -675 -3617 -1690 -2215 -1055 -1644 1388 2210 1257 -4303 193 -3208 -992 745 -3279 2586 -2560 -2493 4290 -1873 -6215 593 -1671 -49 -1565 652 -864 -599 -474 -1522 -553 -522 661 1603 2025 12 6407 1401 1690 1090 394 750 -428 184 1447 2261 1068 837 -319 -500 -1710 261 44 607 733 595 567 7 -190 -1473 -718 -1326 -510 -1572 -693 -2148 -1540 -1187 187 -176 -195 773 181 1275 861 -31 169 259 -237 395 860 901 -679 27 -514 -532 -41 -1335 -772 -299 -454 -611 626 403 347 -161 213 -190 67 250 -26 -42 -329 -300 -183 192 151 583 201 635 453 743 403 371 -132 -472 -17 34 -58 -37 335 -233 -30 -340 174 -527 680 -437 -237 -534 -359 -517 -316 -886 -644 -587 -106 -411 -201 -697 -220 -490 210 -45 -266 -128 -173 -89 -131 117 198 132 -442 20 -318 -98 82 -419 351 -354 -352 553 -286 -1053 115 -397 -13 -435 185 -253 -175 -140 -452 -162 -155 199 519 716 5 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