File name: Pandora206s1_BuffaloNY_20231111_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T065324.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 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_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231111_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: 20231111 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 20231111T141827.0Z 8715.596146 140 1 41.28 2 70.82 139.33 57.51 157.07 0.00 1 0.00 1 0 17 5.573e-02 7.248e-03 4.877e-02 4.129e-03 3.925485e-01 2.025657e-03 4.706451e-03 -6.000000e+00 3.064712e-02 223.08 -2.00 3.55 -2.00 319.22 0.00e+00 2.040695e-04 5.106991e-04 2.063249e-04 -6.000000e+00 1.353265e-03 278.25 -2.00 20.00 -2.00 318.59 0.00e+00 3.009 0.000 302.00 328.00 3 5.1796e+00 5.6032e-03 3.5538e-02 -6.0000e+00 7.5490e-02 2.4896e-02 6.5447e-03 2.0246e-02 -6.0000e+00 8.2427e-02 1.3829e-02 5.0670e-03 1.0164e-02 -6.0000e+00 4.9140e-02 -1.3777e-02 2.6963e-03 2.9750e-03 -6.0000e+00 2.1032e-02 9.7904e-05 -2.1586e-04 1.1521e-04 3.0994e-05 -6.0000e+00 1.4189e-03 -1.3166e-02 1.2783e-04 11 8 0 10 0 0 99.47 17.96 0.36 -0.01317 -0.01479 20 7 1 8 0 2063.750 14.99 17.96 11.54 21.48 21.38 18.9 926.16 -13270 31487 4068 21458 -11506 -1576 -14431 8437 -13128 -628 21426 -12229 846 -26712 8415 -3049 11354 -8100 2327 -4616 2614 -260 -2342 -595 -490 3634 -2085 1116 -5646 2746 -5648 4464 -3409 8227 -2813 -2924 -3038 -1392 1507 -1282 1187 -2516 2662 -1967 1805 -1567 -2461 -5444 434 751 4479 252 568 1562 1033 2218 663 -168 201 -702 -1215 1911 228 1760 266 490 -458 -538 -441 -885 1297 9 1405 338 715 -823 -654 -772 -611 -351 -80 54 -1794 -1076 -799 129 17 -165 443 919 566 474 -233 -412 1178 42 793 690 733 -689 515 -1325 -984 -294 -682 -1412 -1086 -435 43 -18 542 224 -156 338 -489 666 -268 -380 -541 42 -254 -472 -1 292 1891 301 551 520 1154 -126 798 -310 50 -96 -70 -309 44 -256 425 -171 -170 -58 -519 -360 617 111 469 -309 -37 -420 222 -488 -22 613 -515 37 -1780 485 -219 757 -700 192 -428 231 -23 -224 -61 -53 400 -247 125 -634 288 -720 573 -515 1211 -429 -436 -504 -257 330 -346 347 -802 841 -660 582 -528 -832 -1887 142 252 1569 98 234 685 476 1035 323 -82 96 -332 -595 986 132 1069 166 293 -263 -307 -271 -611 964 7 1081 251 488 -524 -380 -435 -369 -245 -61 46 -1644 -1024 -791 136 19 -188 504 998 585 451 -214 -374 1110 45 924 883 973 -934 645 -1584 -1084 -332 -847 -1802 -1449 -611 63 -27 886 368 -255 518 -716 935 -381 -551 -841 67 -409 -742 -1 437 2714 421 752 726 1710 -199 1304 -533 88 -172 -134 -606 88 -524 868 -337 -328 -107 -940 SS 20231111T152226.7Z 8715.640587 166 1 4.82 2 64.42 154.33 55.02 175.36 0.00 1 0.00 1 0 17 1.359e-02 5.475e-03 8.053e-03 1.905e-03 3.043301e-01 9.273178e-04 3.700326e-03 -6.000000e+00 7.474847e-03 223.07 -2.00 3.55 -2.00 317.83 0.00e+00 7.642045e-04 1.534717e-04 7.900647e-05 -6.000000e+00 3.300963e-04 278.25 -2.00 20.00 -2.00 317.17 0.00e+00 2.302 0.000 302.00 328.00 3 2.6311e+00 2.4549e-03 2.7240e-02 -6.0000e+00 1.8412e-02 -1.0016e-02 2.7849e-03 1.5519e-02 -6.0000e+00 2.0105e-02 -1.2808e-03 1.7658e-03 7.7489e-03 -6.0000e+00 1.1985e-02 -9.2120e-04 9.0934e-04 2.3185e-03 -6.0000e+00 5.1295e-03 2.8156e-03 -9.4006e-05 5.2366e-05 2.3868e-05 -6.0000e+00 3.4612e-04 -1.2944e-02 1.1187e-04 12 1 1 12 1 1 97.14 17.97 0.33 -0.01294 -0.01365 26 152 4 8 0 178.470 15.00 17.97 14.23 21.48 21.38 19.4 945.44 -3522 -275 -2609 -3670 -6307 -5145 -3917 -3728 -194 -2410 -4059 -3522 -3172 -2012 333 73 -1381 216 2188 -570 211 1346 -315 1247 -470 147 -54 153 -1382 -233 242 483 1366 -291 -2965 -2521 -1696 -1514 -598 -85 -696 -609 -391 -720 -69 -265 -296 118 -777 561 977 645 523 969 787 1004 913 498 927 664 874 1242 1526 1619 407 -102 371 -524 437 591 311 196 483 262 200 -331 -313 -582 -693 -678 -940 -384 -1696 -1639 -1144 -787 -442 12 208 454 593 292 389 184 360 404 212 665 124 -324 -316 -734 -843 -104 -695 -625 -922 -651 -434 146 328 201 166 -18 23 162 121 258 157 -25 -216 43 225 262 877 457 618 916 869 455 401 49 -145 -25 85 -214 -66 236 -226 -186 -372 -392 -522 -265 -22 -224 -301 -463 -359 -288 -307 -17 -235 -396 -351 -364 -266 50 12 -249 40 418 -116 44 271 -66 276 -111 36 -13 36 -303 -51 57 123 380 -78 -830 -683 -504 -474 -225 -38 -340 -311 -207 -386 -37 -142 -156 61 -400 287 532 349 300 590 497 644 601 327 591 421 571 875 1175 1243 317 -79 269 -376 332 475 275 181 443 231 163 -263 -226 -402 -508 -569 -824 -373 -1784 -1668 -1248 -919 -540 15 244 547 656 319 391 181 379 440 259 844 168 -431 -393 -900 -966 -123 -908 -799 -1238 -919 -644 217 518 323 256 -26 33 216 161 360 235 -38 -330 65 328 389 1226 613 842 1261 1214 686 600 76 -229 -41 141 -372 -117 428 -415 -330 -633 -683 -888 SS 20231111T152918.9Z 8715.645358 169 1 25.79 2 63.90 156.05 54.97 177.37 0.00 1 0.00 1 0 17 1.470e-02 5.763e-03 1.082e-02 2.634e-03 3.026268e-01 1.283108e-03 3.695486e-03 -6.000000e+00 8.082861e-03 223.07 -2.00 3.55 -2.00 317.75 0.00e+00 6.643990e-04 2.094135e-04 8.934332e-05 -6.000000e+00 3.569070e-04 278.25 -2.00 20.00 -2.00 317.10 0.00e+00 2.259 0.000 302.00 328.00 3 5.0216e+00 3.3885e-03 2.6880e-02 -6.0000e+00 1.9910e-02 1.2403e-02 3.8431e-03 1.5483e-02 -6.0000e+00 2.1739e-02 3.8527e-03 2.4306e-03 7.7182e-03 -6.0000e+00 1.2960e-02 -4.8528e-03 1.2512e-03 2.2896e-03 -6.0000e+00 5.5469e-03 2.6540e-04 -1.4165e-04 7.2337e-05 2.3933e-05 -6.0000e+00 3.7423e-04 -1.2999e-02 1.3258e-04 10 0 0 10 0 0 99.09 17.97 0.30 -0.01300 -0.01406 12 12 4 8 0 2149.000 15.00 17.97 14.87 21.48 21.38 19.3 948.06 -4023 1596 1145 -5599 -6903 -4561 -5098 -2895 -6145 -3357 -1312 -1588 -2576 -1063 247 1174 1076 252 1661 513 1089 -1140 -649 -225 -55 -755 -612 -485 -220 -304 1211 415 1827 -550 -1544 -2752 -2247 -1532 -498 -1345 336 -663 130 270 741 -222 -396 -1995 -436 -160 415 661 768 1280 1194 1103 1144 956 402 3 975 1341 1557 1553 174 -279 -24 -1024 255 117 482 22 333 270 307 -86 -804 -287 -373 -380 -712 -545 -2017 -1714 -861 -700 -334 -309 547 279 790 304 -170 33 392 36 384 733 492 -95 60 -369 -648 19 -465 -1237 -989 -430 -278 118 486 179 213 -380 -208 70 202 55 -94 253 -244 -324 441 396 697 505 377 1162 743 432 342 197 -293 56 -69 -127 -118 136 -31 -358 -85 -321 -624 -308 128 96 -490 -534 -331 -397 -247 -611 -347 -131 -163 -307 -140 37 198 191 47 321 104 225 -237 -138 -51 -13 -189 -154 -115 -48 -66 282 106 507 -164 -427 -748 -671 -510 -193 -622 162 -338 68 143 389 -118 -208 -1045 -222 -82 226 376 462 815 765 721 765 636 270 2 666 958 1182 1240 141 -214 -17 -748 196 98 429 20 308 246 259 -69 -587 -205 -274 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