File name: Pandora206s1_BuffaloNY_20230707_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20230709T202208.5Z 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_20230707_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: 20230707 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 20230707T140520.6Z 8588.587044 234 1 28.01 2 44.97 101.02 85.61 250.44 0.00 1 0.00 1 0 17 2.755e-02 1.492e-02 2.421e-02 8.682e-03 2.147132e-01 4.380106e-03 2.507116e-03 -6.000000e+00 1.575321e-02 232.95 -2.00 3.55 -2.00 317.02 0.00e+00 2.687749e-04 5.812962e-04 6.876557e-05 -6.000000e+00 6.927565e-04 286.55 -2.00 20.00 -2.00 316.20 0.00e+00 1.411 0.000 302.00 328.00 3 7.4236e+00 1.1647e-02 1.7962e-02 -6.0000e+00 3.9607e-02 4.1197e-02 1.3059e-02 1.1204e-02 -6.0000e+00 4.2839e-02 3.0469e-02 7.7005e-03 5.4124e-03 -6.0000e+00 2.5467e-02 -2.1052e-02 3.7035e-03 1.4864e-03 -6.0000e+00 1.0780e-02 6.0069e-05 4.2050e-04 2.4065e-04 1.5103e-05 -6.0000e+00 7.0284e-04 1.3878e-03 3.7234e-05 12 8 8 10 0 0 29.07 18.81 1.85 0.00139 0.00455 7 7 2 8 0 4000.000 14.99 18.81 29.97 22.19 22.19 18.2 1045.89 -10615 10067 2432 2099 4278 7833 5799 2730 -6512 -800 -2491 -804 -1816 847 -8799 -2048 6872 4679 856 2212 6810 -947 -628 2452 -1168 -746 -2130 -397 201 271 -286 -4346 1603 921 -364 -7770 -3027 -373 2080 205 736 -1375 -69 -1743 -1603 7408 -3258 -7184 -685 -2584 1284 -187 -258 3056 4101 2264 40 890 1554 -1527 -636 1888 1719 2327 230 37 -1732 -1939 -196 -188 945 83 2268 430 1365 527 883 -2359 -2239 -3490 -2625 590 -2339 -921 -237 -83 965 891 693 2373 -359 -667 -797 -1387 -739 -1326 79 935 2359 449 1250 -2278 -1678 -2259 -485 -1672 336 690 303 127 864 1440 -1464 -549 226 -1871 -2597 -749 -739 1519 94 899 1241 1191 1575 -784 -1730 -1122 1842 292 1367 -1208 403 48 -271 158 323 1360 817 435 163 -1653 -1872 -1551 1314 353 289 499 830 662 358 -1051 -130 -402 -127 -321 165 -2139 -515 1629 1166 230 607 1827 -270 -181 725 -374 -247 -723 -128 59 77 -86 -1436 539 326 -120 -2634 -1072 -148 936 111 435 -859 -44 -1138 -1036 4375 -2091 -4629 -402 -1524 765 -121 -175 2115 2894 1646 30 667 1131 -1136 -482 1494 1428 2050 206 31 -1361 -1466 -152 -166 884 82 2193 409 1239 432 667 -1718 -1676 -2881 -2402 577 -2432 -979 -268 -98 1189 1135 891 2890 -425 -722 -807 -1341 -745 -1478 93 1213 3106 588 1571 -2739 -1935 -2625 -609 -2236 459 953 438 194 1344 2243 -2314 -796 305 -2399 -3338 -986 -1047 2194 141 1323 1838 1685 2091 -1049 -2201 -1412 2404 398 1933 -1795 596 74 -431 263 549 2346 1431 743 269 -2695 -3072 SS 20230707T141811.0Z 8588.595960 239 1 28.92 2 42.67 103.73 87.72 252.65 0.00 1 0.00 1 0 17 1.165e-02 7.105e-03 6.468e-03 3.335e-03 1.954002e-01 1.692042e-03 2.348651e-03 -6.000000e+00 6.659053e-03 232.95 -2.00 3.55 -2.00 316.04 0.00e+00 2.555698e-04 1.794444e-04 5.679850e-05 -6.000000e+00 2.928311e-04 286.55 -2.00 20.00 -2.00 315.29 0.00e+00 1.358 0.000 302.00 328.00 3 6.1231e+00 4.4383e-03 1.6955e-02 -6.0000e+00 1.6742e-02 3.0482e-02 4.9427e-03 1.0299e-02 -6.0000e+00 1.8108e-02 5.7969e-03 2.8388e-03 4.9809e-03 -6.0000e+00 1.0765e-02 -6.7989e-03 1.3041e-03 1.3615e-03 -6.0000e+00 4.5569e-03 2.4464e-04 1.6279e-04 9.0656e-05 1.4968e-05 -6.0000e+00 2.9709e-04 9.3873e-04 2.8649e-05 12 9 1 12 1 1 99.99 18.81 0.64 0.00094 0.00216 7 8 1 8 0 3613.630 15.00 18.81 31.02 22.09 22.19 18.3 1053.38 6398 258 -469 -3234 -1002 -4437 -1059 135 1253 31 -1192 -2095 -1909 -1328 -2507 763 1155 1327 -386 1558 2461 105 721 1808 2 272 381 -59 684 -1137 791 -163 2398 903 -1108 -2441 -1491 -2094 180 -244 -621 -945 -416 -689 -369 144 -668 -1394 -740 -851 393 1023 -615 -1573 588 1301 1105 718 703 -159 664 1218 1086 1764 986 -244 -30 -1097 -126 94 926 922 724 1042 277 -61 -597 -1109 -126 -767 -1516 -355 -2213 -1079 -702 -554 -21 440 585 185 722 141 136 -465 12 -565 689 788 462 133 120 -1214 -1097 -517 -627 -1147 -717 -80 -449 463 679 589 -287 -125 -275 -362 -731 -84 22 656 -95 799 241 222 596 25 201 286 667 226 572 -85 -273 -253 200 148 61 694 201 128 -273 -833 -1014 1234 58 -109 -725 -197 -844 -205 29 293 7 -296 -516 -497 -387 -830 269 416 488 -143 587 939 40 277 726 1 120 169 -25 267 -434 309 -68 1045 401 -478 -1016 -672 -1049 102 -158 -441 -674 -304 -508 -269 105 -492 -994 -507 -574 274 756 -467 -1270 478 1060 920 599 573 -130 550 1075 1003 1669 935 -219 -25 -898 -106 88 911 949 749 1041 269 -55 -501 -870 -100 -666 -1434 -354 -2399 -1163 -809 -666 -26 556 744 234 862 159 142 -465 12 -628 810 997 606 171 150 -1457 -1269 -596 -773 -1499 -945 -110 -624 674 1009 883 -415 -177 -363 -458 -924 -107 29 934 -136 1124 344 302 785 32 246 358 858 301 793 -118 -383 -365 299 227 96 1110 326 202 -420 -1282 -1523 SS 20230707T143114.7Z 8588.605031 241 1 4.01 2 40.37 106.67 89.90 254.87 0.00 1 0.00 1 0 17 8.255e-03 5.889e-03 2.397e-03 1.400e-03 1.789919e-01 7.126028e-04 2.168400e-03 -6.000000e+00 4.717929e-03 232.95 -2.00 3.55 -2.00 315.64 0.00e+00 3.224112e-04 6.943505e-05 2.436957e-05 -6.000000e+00 2.075433e-04 286.55 -2.00 20.00 -2.00 314.91 0.00e+00 1.311 0.000 302.00 328.00 3 2.7100e+00 1.8616e-03 1.6052e-02 -6.0000e+00 1.1862e-02 -1.0323e-02 2.0689e-03 9.4768e-03 -6.0000e+00 1.2831e-02 3.9842e-03 1.1816e-03 4.5809e-03 -6.0000e+00 7.6276e-03 -3.2520e-03 5.3105e-04 1.2634e-03 -6.0000e+00 3.2276e-03 8.1786e-03 3.1373e-05 3.7915e-05 1.4774e-05 -6.0000e+00 2.1060e-04 1.6792e-03 -4.3416e-05 12 1 1 12 1 1 -23.80 18.81 0.37 0.00168 0.00192 23 87 1 8 0 160.170 14.99 18.81 32.66 22.09 22.19 18.4 1064.96 -907 -937 -171 -1906 -3509 -1921 -606 -474 1533 241 -1145 -1218 -1169 -414 186 898 -210 507 164 1820 641 787 890 867 -189 576 276 484 -438 857 1567 797 1768 302 -1738 -1864 -1887 -1234 -131 -361 -775 -932 -703 -741 -400 -398 -616 -272 -830 -276 655 669 654 915 780 1033 696 577 604 493 1252 1071 1304 1497 226 -353 -481 -795 352 353 439 130 418 501 -12 59 -194 -679 -392 -417 -995 -924 -1913 -1528 -1101 -947 -360 -126 450 250 273 184 185 -21 473 229 558 692 180 -199 -91 -667 -589 21 -571 -712 -610 -783 -257 -22 354 181 169 363 -181 246 98 314 257 221 -237 176 311 169 771 422 629 804 718 325 287 -37 -139 -11 63 -26 -149 188 -99 -469 -242 -410 -591 -229 -257 -48 -506 -814 -452 -148 -116 412 69 -324 -339 -357 -141 70 370 -89 218 67 754 274 330 376 386 -88 277 134 218 -198 367 694 373 806 145 -851 -872 -886 -661 -83 -250 -586 -730 -525 -558 -297 -318 -481 -203 -602 -196 480 522 534 727 638 850 586 485 497 403 1044 957 1256 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