File name: Pandora206s1_BuffaloNY_20240510_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T081424.7Z 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_20240510_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: 20240510 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 20240510T121831.7Z 8896.512867 103 1 24.01 2 65.84 87.68 82.75 59.17 0.00 1 0.00 1 0 17 3.938e-01 5.110e-02 3.470e-01 3.468e-02 4.455488e-01 1.807331e-02 5.319479e-03 -6.000000e+00 2.256928e-01 230.55 -2.00 3.55 -2.00 319.67 0.00e+00 1.576702e-03 5.137865e-03 7.861898e-04 -6.000000e+00 1.124328e-02 280.85 -2.00 20.00 -2.00 319.03 0.00e+00 2.426 0.000 302.00 328.00 3 7.9796e+00 5.1758e-02 3.4049e-02 -6.0000e+00 5.6899e-01 1.4732e-01 6.1252e-02 2.4035e-02 -6.0000e+00 6.1930e-01 -7.8566e-02 4.8367e-02 1.1927e-02 -6.0000e+00 3.6279e-01 4.0541e-02 2.5191e-02 3.3907e-03 -6.0000e+00 1.5430e-01 8.5223e-06 -1.4441e-03 1.0024e-03 3.8655e-05 -6.0000e+00 1.0476e-02 -2.0527e-02 8.1332e-05 12 8 8 10 0 0 -157.77 18.45 4.64 -0.02053 -0.03138 6 6 2 8 0 4000.000 15.00 18.45 18.18 21.88 21.88 21.6 1009.66 -35444 87767 900000 900000 187136 52097 900000 199106 900000 900000 900000 153932 24370 900000 98108 -15218 48843 112055 -43886 -2222 900000 72021 86394 -103477 25418 -3515 41772 72973 17131 45759 17613 17057 39946 62464 23495 21380 6691 24118 114578 5884 864 -8843 25500 4547 7231 24394 -7014 -36718 18216 513 13494 14917 759 8411 15480 8750 10780 875 5293 -3116 -10064 10248 3906 -8777 3929 8695 9579 -7572 15348 -8676 9263 2354 12605 4054 8395 -2797 10423 -5628 -4009 -2805 -13613 2024 -5563 -5098 -533 8867 2284 -3553 -7956 388 409 -850 7732 -20419 2493 -145 9941 -1500 -282 -47 5410 -3106 1923 -3687 4599 -3537 673 2593 -2123 1505 2940 2498 -6147 1998 -2223 3591 -2686 -1342 338 1128 1479 -3076 3323 -227 5390 -5900 5001 3005 3358 -2732 6532 -1643 -243 -1269 -1075 -636 -896 -176 2555 532 1013 -2714 -1334 -1197 2963 900000 900000 6319 1759 900000 6723 900000 900000 900000 5197 823 900000 3313 -1044 1968 3783 -4908 -177 900000 2837 3014 -23610 1799 -348 2684 3367 1250 2627 1458 1598 3350 4640 2329 2073 823 2890 6964 1230 205 -2435 5360 1199 1851 5314 -2086 -14180 4226 145 3630 4338 272 2996 5378 3326 4121 368 2064 -1296 -4593 4130 1859 -5066 2123 4195 4351 -4049 6954 -5755 5680 1615 7770 2592 4736 -1572 4822 -2857 -2140 -1714 -10602 1517 -4871 -4636 -495 8035 2319 -3816 -8965 400 388 -750 5819 -19994 2099 -142 9907 -1897 -380 -62 6358 -3616 1944 -3992 5004 -4388 836 3344 -3053 2270 4733 4176 -10618 3099 -3324 4752 -3774 -1937 512 1788 2350 -4962 4883 -330 7256 -8513 6136 3802 4653 -4249 9924 -2829 -423 -2324 -2098 -1298 -1865 -370 5248 1069 1923 -5082 -2453 SS 20240510T125412.6Z 8896.537646 125 1 20.23 2 59.31 93.81 77.19 64.41 0.00 1 0.00 1 0 25 4.015e-02 6.815e-03 2.311e-02 3.704e-03 3.597035e-01 1.851585e-03 4.294101e-03 -6.000000e+00 2.272411e-02 230.55 -2.00 3.55 -2.00 318.28 0.00e+00 -1.853817e-04 3.466199e-04 1.319994e-04 -6.000000e+00 9.855955e-04 280.85 -2.00 20.00 -2.00 317.57 0.00e+00 1.952 0.000 302.00 328.00 3 5.4443e+00 5.0104e-03 2.7200e-02 -6.0000e+00 5.6903e-02 5.6049e-03 5.6900e-03 1.8929e-02 -6.0000e+00 6.1750e-02 -7.0074e-03 3.7905e-03 9.2814e-03 -6.0000e+00 3.6655e-02 -1.2617e-03 1.9758e-03 2.5722e-03 -6.0000e+00 1.5489e-02 2.0824e-04 -1.1124e-04 1.0145e-04 2.5959e-05 -6.0000e+00 1.0238e-03 -1.7933e-02 1.5200e-04 12 9 1 12 1 1 98.45 18.45 0.40 -0.01793 -0.01877 7 11 2 8 0 2527.580 15.00 18.45 19.08 21.88 21.88 21.8 1016.17 -9229 36167 -1319 1537 -3571 6035 -9025 6038 -9413 5632 -14410 119 -6629 -1508 -4628 -35 1490 -742 -511 125 3781 -3572 5459 -927 264 -3418 1099 -1310 -5448 -268 3593 793 408 -296 -4445 -50 -5371 585 -1622 1045 -593 995 -1233 -342 -1088 496 -873 -1312 -1011 -444 1619 341 1521 529 1082 117 1619 267 39 442 526 1410 1259 2522 404 188 -427 -88 277 1107 791 706 506 847 61 -883 -418 -957 -404 -1144 -1194 -1182 -1546 -2183 -207 -1215 -325 -640 280 48 1328 -298 700 391 777 123 901 744 -196 136 75 -821 -1120 349 -122 -1033 -795 -147 -361 -62 304 160 326 -137 480 286 91 -46 -218 62 -590 -464 343 479 1039 672 -18 964 980 -51 88 -113 -281 -5 123 -19 -339 7 415 -382 12 -382 -375 -472 1365 -74 79 -170 260 -487 317 -632 364 -1095 8 -559 -142 -527 -4 192 -104 -75 19 570 -572 824 -161 48 -681 213 -244 -980 -46 649 162 93 -72 -1045 -11 -1365 158 -545 396 -245 423 -557 -155 -495 224 -395 -587 -463 -205 765 177 808 303 643 72 1006 167 24 266 325 906 891 1865 309 137 -295 -60 200 886 681 618 455 726 50 -672 -296 -653 -283 -901 -1039 -1118 -1538 -2280 -222 -1379 -384 -765 333 57 1448 -311 685 375 799 136 1076 954 -264 184 97 -1004 -1305 413 -156 -1358 -1066 -207 -525 -95 476 256 517 -208 683 392 125 -67 -321 97 -919 -721 516 704 1471 936 -24 1285 1392 -77 138 -181 -460 -8 214 -34 -623 12 763 -696 21 -665 -635 SS 20240510T141246.5Z 8896.592205 169 1 4.83 2 45.26 109.52 64.14 75.53 0.00 1 0.00 1 0 17 1.454e-02 7.776e-03 1.934e-02 7.240e-03 2.671906e-01 3.625010e-03 3.236472e-03 -6.000000e+00 8.227686e-03 230.55 -2.00 3.55 -2.00 316.87 0.00e+00 2.023295e-04 4.619737e-04 5.764839e-05 -6.000000e+00 3.568166e-04 280.86 -2.00 20.00 -2.00 316.17 0.00e+00 1.419 0.000 302.00 328.00 3 5.5542e+00 9.5574e-03 1.9970e-02 -6.0000e+00 2.0603e-02 1.2167e-02 1.0713e-02 1.3983e-02 -6.0000e+00 2.2357e-02 -1.0510e-02 6.3198e-03 6.8407e-03 -6.0000e+00 1.3271e-02 -2.4370e-04 3.0473e-03 1.8942e-03 -6.0000e+00 5.6087e-03 3.5879e-04 1.9476e-04 1.9735e-04 2.0623e-05 -6.0000e+00 3.7063e-04 -1.9520e-02 1.2895e-04 12 9 1 12 1 1 999.00 18.44 0.54 -0.01952 -0.01806 1 11 4 8 0 2413.980 15.00 18.44 22.05 21.88 21.88 21.9 1034.63 -3194 -215 -4459 -936 -8153 3766 -1134 1514 1180 1324 -2844 491 -2801 -2928 670 -515 -27 2924 2343 1427 1102 -2161 3088 -288 823 472 356 -1190 -2185 1481 2954 2345 1461 276 -2138 483 -2371 -404 -2194 -1288 -540 -398 -1026 -998 547 -2365 402 -1546 107 414 190 -1178 396 389 982 821 810 1061 325 615 745 1905 624 1535 217 935 -1251 -491 1051 1059 -455 536 1007 1117 107 -299 1696 -1318 1453 -354 -1606 -969 -2428 -1641 -505 -845 -266 -185 358 251 951 24 655 381 -100 -346 455 -182 439 -920 -99 -508 -269 -455 25 -1024 -1583 -691 175 345 945 173 -367 30 -258 -277 377 781 256 446 -837 -291 -35 35 870 1093 166 1047 277 634 730 261 445 -317 -56 -278 127 862 -169 -616 -330 -712 -637 -434 -31 -671 -133 -1080 421 -142 206 181 216 -472 80 -530 -611 154 -134 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