File name: Pandora206s1_BuffaloNY_20221013_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T042242.0Z 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_20221013_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: 20221013 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 20221013T173739.1Z 8321.734480 359 1 44.94 2 51.63 191.49 106.52 325.64 0.00 1 0.00 1 0 17 8.691e-03 5.339e-03 8.766e-04 3.561e-04 2.172923e-01 1.746595e-04 2.647402e-03 -6.000000e+00 4.818835e-03 225.76 -2.00 3.55 -2.00 316.82 0.00e+00 3.716347e-04 2.223440e-05 4.144682e-05 -6.000000e+00 2.141450e-04 281.91 -2.00 20.00 -2.00 316.10 0.00e+00 1.607 0.000 302.00 328.00 3 2.1333e+00 4.5673e-04 1.9266e-02 -6.0000e+00 1.1926e-02 -3.7984e-04 5.1504e-04 1.1152e-02 -6.0000e+00 1.2999e-02 4.3975e-03 3.0140e-04 5.5080e-03 -6.0000e+00 7.7510e-03 -4.4804e-03 1.4432e-04 1.5782e-03 -6.0000e+00 3.3011e-03 1.0268e-02 2.8614e-04 9.8097e-06 1.6994e-05 -6.0000e+00 2.2169e-04 9.2150e-04 3.1530e-05 10 0 0 10 0 0 99.99 18.10 0.30 0.00092 0.00307 1424 475 1 8 0 31.440 14.99 18.10 18.75 21.58 21.48 13.0 949.32 -1593 -884 -1349 -2742 -3792 -2108 -1665 -128 386 -945 -2204 -1474 -854 -747 628 -178 -57 256 844 830 535 402 935 333 233 704 68 -106 -689 830 1248 1443 1816 -371 -2184 -1589 -1701 -987 -163 -311 -944 -673 -599 -711 -137 -476 -441 -498 -670 -59 790 699 932 906 725 981 758 579 498 584 953 1187 1508 1460 28 -62 -520 -500 419 368 283 200 255 325 115 -49 -373 -718 -228 -740 -989 -1116 -1966 -1509 -1036 -658 -318 34 357 222 472 241 69 331 407 248 542 684 107 -211 -268 -700 -594 -22 -672 -723 -626 -477 -140 300 429 275 169 -6 -158 109 -16 251 102 38 -225 99 269 244 635 349 519 861 488 317 150 32 -201 19 96 -79 100 177 -91 -203 -218 -449 -568 -249 -148 -230 -434 -526 -279 -235 -20 67 -172 -392 -265 -172 -170 160 -50 -16 75 255 259 170 125 298 113 82 257 25 -36 -215 253 402 492 669 -142 -771 -552 -658 -441 -79 -176 -578 -425 -389 -464 -88 -307 -277 -303 -397 -35 490 462 645 660 542 741 585 443 373 436 736 986 1239 1273 24 -52 -412 -386 344 317 265 194 245 300 108 -41 -282 -517 -173 -640 -957 -1091 -2046 -1631 -1204 -816 -380 42 438 281 546 254 66 336 406 273 661 852 140 -267 -343 -830 -668 -26 -879 -913 -826 -658 -201 458 684 437 255 -8 -218 142 -21 346 141 56 -338 146 386 332 883 464 652 1097 670 426 212 47 -294 29 156 -135 161 292 -152 -351 -364 -728 -906 SS 20221013T174415.3Z 8321.739066 362 1 7.37 2 51.89 193.55 107.15 327.02 0.00 1 0.00 1 0 17 1.280e-02 7.817e-03 1.259e-02 5.446e-03 2.262536e-01 2.682315e-03 2.782148e-03 -6.000000e+00 7.099497e-03 225.76 -2.00 3.55 -2.00 316.58 0.00e+00 7.269558e-04 3.254004e-04 9.824012e-05 -6.000000e+00 3.154650e-04 281.91 -2.00 20.00 -2.00 315.88 0.00e+00 1.617 0.000 302.00 328.00 3 5.5766e+00 6.9870e-03 1.9650e-02 -6.0000e+00 1.7571e-02 3.4828e-02 7.8614e-03 1.1664e-02 -6.0000e+00 1.9150e-02 -1.9364e-03 4.5870e-03 5.7644e-03 -6.0000e+00 1.1418e-02 -1.0392e-03 2.1867e-03 1.6806e-03 -6.0000e+00 4.8645e-03 3.1447e-04 4.7007e-04 1.4929e-04 1.8320e-05 -6.0000e+00 3.2643e-04 1.3866e-04 9.3386e-05 12 9 1 12 9 1 99.91 18.10 0.24 0.00014 0.00367 3 17 1 8 0 1801.850 15.00 18.10 19.28 21.58 21.48 13.1 953.09 -4907 931 -3885 -1537 -4241 -3930 686 2333 3269 -600 -1738 -1818 1178 -267 727 -639 64 899 1451 -719 2311 235 3618 -1724 1080 1765 510 -362 -1864 -1198 -319 1020 360 844 -1840 -2416 -1131 -1362 231 -658 -658 -1736 -463 -703 -301 -845 -614 -893 -298 -533 928 446 971 1181 1487 1803 -45 696 -798 952 358 501 1323 3050 237 446 -593 -1306 363 1212 836 -202 2379 996 -112 -337 -884 -1064 -356 -1407 -625 -1331 -1663 -1300 -1258 -638 356 265 -195 -38 147 -441 -73 -534 500 375 1148 804 -1234 -569 295 -522 -1388 -924 -131 -1489 -421 -737 619 204 488 377 51 77 127 518 250 -273 60 20 -302 467 782 287 1172 286 440 1203 589 707 518 71 -662 119 -201 -225 -316 -20 40 102 -168 -730 -665 -842 163 -725 -257 -652 -583 104 387 597 -115 -336 -359 247 -64 197 -186 19 273 454 -237 749 76 1200 -617 391 658 191 -131 -628 -398 -112 375 140 333 -698 -910 -452 -633 123 -401 -419 -1157 -314 -478 -203 -572 -403 -587 -190 -340 620 310 704 875 1123 1376 -36 541 -615 739 282 425 1173 2747 214 383 -479 -1034 304 1118 819 -202 2357 960 -103 -286 -701 -827 -283 -1244 -595 -1369 -1765 -1433 -1459 -769 446 333 -246 -47 169 -477 -73 -539 521 421 1383 1027 -1640 -742 365 -613 -1600 -1093 -164 -1931 -565 -1014 880 303 740 571 76 108 169 664 324 -364 84 29 -449 679 1106 396 1554 374 557 1500 774 984 738 104 -964 180 -316 -362 -518 -32 66 166 -271 -1141 -1018 SS 20221013T183836.0Z 8321.776806 386 1 31.02 2 55.57 209.63 111.39 338.89 0.00 1 0.00 1 0 17 1.320e-02 7.047e-03 1.523e-02 4.582e-03 2.453821e-01 2.243508e-03 2.965843e-03 -6.000000e+00 7.319928e-03 225.76 -2.00 3.55 -2.00 317.55 0.00e+00 3.986127e-04 3.430200e-04 5.631052e-05 -6.000000e+00 3.253066e-04 281.91 -2.00 20.00 -2.00 316.81 0.00e+00 1.763 0.000 302.00 328.00 3 6.1924e+00 5.9348e-03 2.1360e-02 -6.0000e+00 1.8116e-02 4.6051e-02 6.7266e-03 1.2606e-02 -6.0000e+00 1.9748e-02 7.5031e-03 4.0910e-03 6.2269e-03 -6.0000e+00 1.1775e-02 -9.5987e-03 2.0382e-03 1.7849e-03 -6.0000e+00 5.0137e-03 1.4200e-04 2.7445e-05 1.2814e-04 1.8715e-05 -6.0000e+00 3.3689e-04 1.2555e-03 -2.6097e-05 11 8 0 10 0 0 99.98 18.10 0.25 0.00126 0.00146 29 29 2 8 0 1069.530 15.00 18.10 20.48 21.58 21.48 12.9 958.29 -4699 5277 1115 -2276 -1233 -2818 -1852 2575 -3599 697 340 -326 1374 -260 -666 219 1487 -1487 -1756 1203 3139 1653 1649 166 -1792 -1397 -1684 -785 -2202 1627 -100 2219 1764 -1847 -1492 -2630 -3554 -1090 916 785 -1661 -329 1170 -2239 1001 -1137 -638 -1377 -554 -341 1842 456 -210 665 797 1480 1533 443 444 -283 377 287 1548 1677 434 -373 -671 -864 61 -68 1582 441 1376 255 260 152 -460 -1165 -1037 -2004 -1078 -437 -1584 -1433 -884 -373 -111 452 591 1592 665 249 -204 -1737 -360 212 -14 897 209 -189 -360 -1664 -949 86 -293 -1154 -221 -70 -110 576 496 920 164 44 -990 -185 -186 -373 136 -293 -126 311 802 -617 517 -144 469 193 723 -240 580 280 225 189 405 -67 -14 259 163 -220 -333 -420 -738 -512 563 126 -245 -118 -268 -187 279 -464 90 43 -42 200 -44 -129 44 305 -327 -401 286 742 389 400 43 -499 -402 -484 -207 -542 385 -26 596 520 -574 -419 -742 -1127 -392 390 377 -882 -179 644 -1278 550 -638 -347 -759 -296 -183 1030 266 -130 430 527 988 1042 301 294 -188 259 213 1231 1416 363 -284 -479 -625 45 -58 1442 421 1290 231 218 117 -324 -788 -746 -1652 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