File name: Pandora206s1_BuffaloNY_20230225_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T052910.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: ---- 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_v2d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20230225_L1_smca1c4d20220512p1-8.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: 20230225 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]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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 20230225T141213.2Z 8456.591819 77 1 45.55 2 68.50 126.76 95.47 60.68 0.00 1 0.00 1 0 17 2.732e-02 4.897e-03 1.768e-02 1.978e-03 3.931514e-01 9.682989e-04 4.655539e-03 -6.000000e+00 1.508867e-02 225.10 -2.00 3.55 -2.00 318.94 0.00e+00 4.076354e-04 2.179650e-04 1.530373e-04 -6.000000e+00 6.489185e-04 273.17 -2.00 20.00 -2.00 318.38 0.00e+00 2.704 0.000 302.00 328.00 3 4.3435e+00 2.6394e-03 3.3203e-02 -6.0000e+00 3.7393e-02 1.8128e-02 3.0414e-03 2.0198e-02 -6.0000e+00 4.0856e-02 -1.3337e-02 2.2647e-03 1.0104e-02 -6.0000e+00 2.4251e-02 -1.1904e-04 1.2049e-03 2.9538e-03 -6.0000e+00 1.0250e-02 3.0375e-04 -8.2630e-05 5.4451e-05 2.9446e-05 -6.0000e+00 6.9684e-04 8.4171e-03 3.0443e-06 10 0 0 10 0 0 99.74 17.55 0.14 0.00842 0.00780 41 13 1 8 0 1110.810 15.01 17.55 0.49 21.17 20.96 14.0 919.49 -6617 -11042 11962 -12125 -662 -5854 -10440 -1665 -8807 -9884 -8209 -2619 -6318 -587 -3513 -1946 -1483 288 164 2083 157 629 -1011 -892 -2620 -1031 -704 -1733 -3984 -1760 -2722 7 1016 761 -580 -3204 -2348 -513 -210 145 -823 -537 -395 -408 -175 -748 -925 -1533 -459 1057 1315 757 330 681 1277 1270 1009 994 448 -713 830 1308 2020 1324 -25 108 -125 -546 527 375 797 454 284 544 267 80 -658 115 -271 -442 -607 -887 -1869 -1352 -916 -815 -159 288 459 259 780 -119 352 296 284 108 464 713 -6 -137 -326 -525 -399 -212 -639 -911 -690 -504 -227 -33 358 -161 187 -8 -101 253 -26 334 -146 103 -263 136 228 146 770 515 434 843 435 387 154 -5 -256 56 -33 -340 180 203 -175 -81 -73 -443 -337 -210 -406 379 -436 -20 -182 -371 -62 -395 -476 -387 -126 -376 -38 -275 -169 -137 28 17 217 17 67 -115 -110 -347 -141 -96 -224 -497 -232 -391 1 175 135 -96 -547 -447 -113 -56 44 -276 -188 -143 -149 -64 -277 -340 -564 -168 393 534 335 151 332 642 656 535 521 229 -367 438 752 1230 882 -17 69 -77 -340 344 282 625 369 228 428 192 54 -408 70 -181 -330 -497 -813 -1783 -1345 -947 -899 -182 327 518 287 815 -116 329 278 284 117 552 921 -9 -181 -415 -626 -447 -250 -799 -1192 -919 -709 -329 -50 584 -261 299 -12 -148 352 -37 482 -226 163 -416 214 351 215 1100 728 586 1182 653 611 251 -8 -434 100 -61 -641 343 397 -341 -156 -134 -801 -599 SS 20230225T150617.3Z 8456.629367 97 1 30.68 2 61.25 139.17 86.67 69.50 0.00 1 0.00 1 0 17 3.682e-02 7.534e-03 2.229e-02 4.421e-03 3.166693e-01 2.159692e-03 3.801330e-03 -6.000000e+00 2.032866e-02 225.10 -2.00 3.55 -2.00 318.10 0.00e+00 9.126639e-04 3.784255e-04 1.090937e-04 -6.000000e+00 8.744636e-04 273.18 -2.00 20.00 -2.00 317.52 0.00e+00 2.069 0.000 302.00 328.00 3 6.2028e+00 5.7553e-03 2.5928e-02 -6.0000e+00 5.0378e-02 2.7635e-02 6.5342e-03 1.6246e-02 -6.0000e+00 5.5050e-02 6.1234e-03 4.2923e-03 8.0777e-03 -6.0000e+00 3.2676e-02 -9.9373e-03 2.2302e-03 2.4223e-03 -6.0000e+00 1.3807e-02 9.4285e-05 -4.3685e-04 1.2200e-04 2.3802e-05 -6.0000e+00 9.3934e-04 8.8067e-03 -7.7629e-05 11 8 0 10 0 0 99.93 17.56 0.47 0.00881 0.00552 8 8 1 8 0 3834.910 14.99 17.56 3.40 21.17 20.96 14.1 938.85 -2135 24973 1065 10363 -13925 12047 -14855 6083 -10571 -4743 243 -2493 -6941 198 3547 -4143 7109 -2929 5843 -4074 3603 -3286 1324 -2804 -3149 501 2650 -96 1842 -487 -3152 1966 49 3042 -1163 -947 -3293 1239 -1251 -377 -873 -1220 807 -1016 807 -2385 -877 -3361 958 -1661 1771 858 192 995 1316 640 718 1242 470 180 161 3434 1467 2275 -831 975 -1788 -282 238 -796 1166 217 1319 255 110 128 20 -729 -231 -610 -446 -848 -2084 -835 -825 -1636 -82 -93 265 1571 -487 1185 223 49 -28 49 549 725 -351 -489 306 -552 -110 1 -341 -1099 -472 -534 -425 175 100 -96 -230 -216 133 628 -178 538 -154 864 -255 652 -10 -500 416 -270 487 880 822 368 598 -3 122 -187 -153 -925 500 96 355 -229 -104 -640 -314 -135 1361 73 620 -933 615 -1074 402 -923 -410 20 -219 -744 22 451 -632 1014 -486 930 -745 618 -595 238 -562 -664 106 549 -19 345 -96 -676 436 12 754 -274 -230 -889 375 -457 -160 -390 -570 382 -492 384 -1175 -419 -1667 451 -818 883 464 111 605 797 398 455 774 296 113 103 2302 1069 1764 -653 708 -1264 -194 178 -670 1015 197 1168 223 88 94 14 -495 -169 -500 -399 -821 -2106 -872 -905 -1932 -98 -113 321 1826 -543 1223 215 47 -29 55 673 942 -482 -647 384 -654 -126 1 -428 -1451 -635 -756 -620 266 158 -153 -358 -320 184 842 -244 751 -228 1334 -400 989 -15 -728 584 -365 637 1184 1174 552 921 -4 198 -311 -265 -1653 898 177 651 -415 -182 -1101 -530 SS 20230225T160406.0Z 8456.669513 119 1 29.53 2 55.44 154.51 76.70 78.46 0.00 1 0.00 1 0 17 1.775e-02 7.558e-03 1.339e-02 3.699e-03 2.817989e-01 1.806869e-03 3.385380e-03 -6.000000e+00 9.805315e-03 225.10 -2.00 3.55 -2.00 317.54 0.00e+00 6.922085e-04 2.708827e-04 7.994925e-05 -6.000000e+00 4.216448e-04 273.18 -2.00 20.00 -2.00 316.97 0.00e+00 1.758 0.000 302.00 328.00 3 6.1233e+00 4.7651e-03 2.2416e-02 -6.0000e+00 2.4300e-02 4.6498e-02 5.3846e-03 1.4360e-02 -6.0000e+00 2.6548e-02 3.9597e-03 3.3406e-03 7.1291e-03 -6.0000e+00 1.5758e-02 -7.1456e-03 1.6865e-03 2.1261e-03 -6.0000e+00 6.6627e-03 1.4337e-04 4.2027e-04 1.0196e-04 2.1623e-05 -6.0000e+00 4.5266e-04 7.4613e-03 4.6206e-05 11 8 0 10 0 0 99.92 17.53 0.20 0.00746 0.01062 12 12 1 8 0 2460.520 14.99 17.53 4.99 21.17 20.96 14.0 947.79 -5098 8929 -3625 3152 -6458 -2664 -956 722 -3176 -4455 1638 -2147 3324 -2408 5871 -288 3121 748 2615 -2750 1915 -397 1060 -1032 -2101 -660 -585 1010 -1978 2038 -419 2205 590 -559 -2482 -1771 -3089 -3707 295 -464 10 -1432 502 -732 1679 -1587 -982 -3405 218 -624 780 919 -338 937 1011 1668 613 1232 -535 1068 811 2087 1309 2283 6 132 -1289 -961 73 11 1127 293 736 867 647 -729 -254 -960 -311 -1047 -918 -540 -2103 -1197 -867 -232 38 426 192 1177 26 138 -574 80 -1177 183 555 933 217 -302 707 -1099 -387 -645 -172 -953 -543 -902 -73 588 624 600 -401 -327 -822 -37 -916 463 -213 -357 96 749 676 295 537 -283 526 413 861 19 480 323 -191 227 318 -610 249 470 712 -141 -603 -841 -816 -497 822 -386 288 -568 -222 -84 70 -359 -533 185 -255 432 -382 988 -57 616 158 564 -650 437 -91 248 -263 -564 -182 -160 252 -472 473 -108 597 178 -173 -714 -505 -998 -1364 126 -226 5 -787 280 -413 923 -902 -542 -1884 115 -334 443 557 -213 616 681 1134 429 846 -365 714 566 1557 1043 1921 5 104 -967 -707 58 10 1032 279 690 796 546 -572 -186 -682 -236 -888 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