File name: Pandora206s1_BuffaloNY_20250211_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20250212T053422.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20250211_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20250211 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]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- 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 20250211T134343.5Z 9173.572031 240 1 24.01 2 76.71 123.78 104.29 316.57 0.00 1 0.00 1 0 37 6.427e-01 1.867e-01 4.811e-01 1.526e-01 5.470295e-01 9.679105e-02 1.363496e-02 -6.000000e+00 3.992595e-01 224.53 -2.00 3.55 -2.00 320.59 0.00e+00 8.257854e-02 3.185369e-02 2.807289e-02 -6.000000e+00 2.910685e-02 272.39 -2.00 20.00 -2.00 320.28 0.00e+00 4.243 0.001 302.00 328.00 3 7.0209e+00 2.8359e-01 1.7466e-01 -6.0000e+00 1.0119e+00 1.0102e+00 3.1346e-01 2.1809e-01 -6.0000e+00 1.1439e+00 -1.3861e+00 1.7463e-01 1.8806e-02 -6.0000e+00 6.5010e-01 7.2561e-01 8.8656e-02 6.7344e-02 -6.0000e+00 2.7039e-01 2.1339e-06 -1.8762e-02 4.7325e-03 5.6591e-04 -6.0000e+00 2.0344e-02 3.6877e-02 0.0000e+00 12 8 8 10 0 0 -151.99 17.83 12.61 0.03688 -0.10411 6 6 2 8 0 4000.000 15.00 17.83 1.03 21.48 21.27 23.1 927.69 900000 -17802 900000 12024 900000 900000 900000 900000 -68113 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 -72665 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 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900000 6024 20344 8569 900000 2558 16722 -2931 900000 -5374 34759 10608 -13192 900000 -36096 5526 -16540 10335 -13661 -10820 10976 -4522 5650 23178 42 8288 900000 24358 -9073 -22523 9778 11961 -10463 16492 -838 16687 18932 6152 4500 4820 15734 13451 12977 -3536 -21522 15773 2957 -35701 -9463 18242 27444 14662 25402 -22083 16103 -3009 12736 14879 9631 -3671 15007 -9697 -57732 -21601 18185 22917 10556 -459 3363 10668 -10708 -4060 24307 11571 -52584 31042 9315 25483 1612 11691 20055 16766 2593 -7928 -4555 7985 2503 5909 1750 1254 3649 -42920 22009 SS 20250211T151019.8Z 9173.632174 279 1 27.63 2 65.12 142.39 113.12 334.88 0.00 1 0.00 1 0 17 4.468e-02 6.499e-03 3.936e-02 4.845e-03 3.612834e-01 2.382142e-03 4.383454e-03 -6.000000e+00 2.476524e-02 224.53 -2.00 3.55 -2.00 318.70 0.00e+00 9.590422e-04 4.973037e-04 3.384081e-04 -6.000000e+00 1.059203e-03 272.39 -2.00 20.00 -2.00 318.16 0.00e+00 2.361 0.000 302.00 328.00 3 5.3686e+00 6.4345e-03 2.9676e-02 -6.0000e+00 6.1326e-02 -2.5676e-02 7.3537e-03 1.8836e-02 -6.0000e+00 6.6883e-02 1.0681e-02 5.3139e-03 9.3519e-03 -6.0000e+00 3.9701e-02 -8.5262e-03 2.8344e-03 2.8521e-03 -6.0000e+00 1.6915e-02 1.5805e-04 -4.1756e-04 1.3428e-04 2.8921e-05 -6.0000e+00 1.1369e-03 -1.3852e-03 0.0000e+00 11 8 0 10 0 0 99.62 17.82 0.79 -0.00139 -0.00452 7 7 4 8 0 3947.000 15.01 17.82 3.70 21.48 21.27 23.3 945.66 -21226 19267 24148 -13900 3669 13697 -5457 -4614 -6866 -14134 12086 284 -1644 3993 -5912 -2319 12803 -1955 4965 -651 3877 -650 4353 273 3502 977 -1091 534 -6226 -54 -2222 1746 1329 -2010 -518 -5287 -1877 -757 1924 -3558 -105 -2728 864 -1293 -141 -1342 -1123 -347 1592 -295 1706 996 -1208 1150 933 1254 475 318 -568 -743 289 2616 861 1575 -495 -1166 -1010 268 -302 -124 1581 545 -281 732 1099 23 1496 682 -1090 186 -1163 -370 -2281 -743 -1666 135 -110 411 154 923 338 477 505 -157 589 -45 929 -110 415 -225 -161 -790 -229 -156 118 -933 -901 -445 -545 295 66 235 -144 419 79 282 -323 628 -492 -93 -669 -332 238 82 -389 527 719 1071 526 160 572 -144 -90 532 -131 -233 202 52 132 173 -723 -103 -355 -921 637 809 -663 129 412 -211 -198 -342 -826 545 15 -101 276 -533 -233 1188 -223 559 -81 476 -83 537 38 498 150 -175 80 -933 -8 -349 292 249 -420 -100 -1020 -382 -176 528 -1137 -36 -1020 325 -507 -55 -531 -442 -134 602 -115 697 447 -592 588 502 687 270 181 -318 -410 162 1542 569 1047 -346 -766 -672 173 -206 -89 1249 457 -238 591 822 17 978 429 -730 141 -942 -334 -2271 -760 -1709 146 -126 485 184 1059 360 502 491 -149 590 -47 1083 -136 554 -299 -216 -975 -259 -178 147 -1245 -1172 -608 -790 457 103 380 -227 663 116 384 -440 883 -748 -151 -1108 -536 373 125 -559 720 995 1479 741 245 934 -232 -148 902 -239 -450 374 98 253 321 -1373 -187 -625 SS 20250211T151829.7Z 9173.637844 283 1 35.57 2 64.22 144.34 113.73 336.77 0.00 1 0.00 1 0 17 1.984e-02 5.187e-03 1.488e-02 2.221e-03 3.503743e-01 1.093989e-03 4.247314e-03 -6.000000e+00 1.099756e-02 224.53 -2.00 3.55 -2.00 318.59 0.00e+00 6.506964e-04 2.185934e-04 1.272576e-04 -6.000000e+00 4.703758e-04 272.39 -2.00 20.00 -2.00 318.04 0.00e+00 2.286 0.000 302.00 328.00 3 4.1624e+00 2.9428e-03 2.8699e-02 -6.0000e+00 2.7233e-02 -1.3787e-02 3.3514e-03 1.8066e-02 -6.0000e+00 2.9702e-02 -1.1283e-02 2.3642e-03 9.0795e-03 -6.0000e+00 1.7630e-02 -1.3082e-03 1.2562e-03 2.7028e-03 -6.0000e+00 7.5110e-03 5.7801e-04 -5.6279e-04 6.1944e-05 2.7906e-05 -6.0000e+00 5.0489e-04 -8.4318e-04 0.0000e+00 10 0 0 10 0 0 98.66 17.83 0.40 -0.00084 -0.00507 35 18 2 8 0 1016.270 15.00 17.83 3.87 21.48 21.27 23.4 946.64 -11047 -1735 -2366 -4222 -5781 -3612 1154 -9602 -3004 -6680 -701 -7415 -3913 -3382 -3 -2150 -428 799 -70 -1267 1550 168 1595 2993 -2209 -461 -744 1809 -2328 780 -952 1553 1193 -415 -2824 -3692 154 -2210 430 -683 -1788 -1001 -81 -996 711 -862 -379 -555 6 39 1061 1037 377 722 1065 1335 587 748 -223 501 698 931 1238 1853 329 -43 -76 -637 605 101 617 393 234 725 814 538 -248 -1173 -555 -317 -1021 -666 -1983 -1281 -1253 -538 -605 -74 294 515 413 688 392 356 476 296 486 484 396 -154 -318 -725 -238 -206 -561 -918 -759 -635 -274 58 129 197 206 -48 -234 482 125 367 91 250 -302 -349 214 61 274 478 495 894 817 223 424 1 -198 -28 -186 -45 -72 180 44 -229 -390 -139 -325 -479 -78 -113 -220 -268 -154 50 -516 -171 -430 -43 -490 -287 -292 0 -225 -47 92 -9 -163 200 24 228 453 -340 -73 -121 301 -374 120 -163 286 244 -85 -608 -761 33 -514 118 -227 -672 -393 -33 -414 290 -360 -157 -226 3 16 456 486 190 386 594 759 345 440 -129 283 403 577 771 1256 233 -28 -51 -424 417 73 498 334 200 592 619 368 -168 -763 -375 -224 -828 -603 -1971 -1320 -1274 -585 -693 -87 349 592 439 724 382 335 475 305 562 630 519 -201 -420 -884 -265 -233 -697 -1210 -1045 -855 -389 89 211 311 340 -75 -336 641 178 505 135 394 -488 -553 329 91 383 690 676 1217 1209 335 677 1 -338 -47 -330 -85 -138 351 87 -440 -718 -246 -556 SS 20250211T152448.8Z 9173.642232 286 1 11.46 2 63.56 145.89 114.18 338.24 0.00 1 0.00 1 0 17 2.475e-02 5.777e-03 1.428e-02 2.635e-03 3.387594e-01 1.293225e-03 4.131033e-03 -6.000000e+00 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