File name: Pandora206s1_BuffaloNY_20220718_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T035259.8Z 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_20220718_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: 20220718 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 20220718T142607.6Z 8234.601477 247 1 28.01 2 42.56 107.02 79.13 254.75 0.00 1 0.00 1 0 17 5.008e-02 1.958e-02 3.677e-02 1.223e-02 2.290014e-01 6.133740e-03 2.681852e-03 -6.000000e+00 2.853368e-02 232.88 -2.00 3.55 -2.00 317.25 0.00e+00 1.089470e-03 8.679885e-04 8.112229e-05 -6.000000e+00 1.263465e-03 287.38 -2.00 20.00 -2.00 316.42 0.00e+00 1.356 0.000 302.00 328.00 3 8.1314e+00 1.6384e-02 1.8126e-02 -6.0000e+00 7.1701e-02 6.7118e-02 1.8437e-02 1.2072e-02 -6.0000e+00 7.7635e-02 2.4265e-02 1.0910e-02 5.7925e-03 -6.0000e+00 4.6170e-02 -1.6161e-02 5.2857e-03 1.8057e-03 -6.0000e+00 1.9490e-02 2.9840e-05 1.1826e-04 3.3924e-04 1.7186e-05 -6.0000e+00 1.2789e-03 -3.7101e-03 1.2017e-04 12 8 8 10 0 0 98.22 18.68 1.44 -0.00371 -0.00282 7 7 2 8 0 4000.000 15.00 18.68 28.74 22.09 22.09 10.9 1004.31 -22251 24807 -12435 -4557 2727 -2220 216 5137 -7214 16749 -4712 8107 -4943 2716 2199 -2745 18666 -606 10874 -13604 9780 1131 2941 -8678 -1511 -1475 -6097 10912 2519 3821 3697 5553 7816 2777 -2366 -4967 1256 -2330 5031 -2288 3430 625 821 -3414 -391 269 -5627 1509 681 -1481 175 1832 -4859 -377 -2262 374 -1106 -454 1266 135 -1026 3120 -136 3313 1833 -486 -3677 -2120 1027 -1878 2723 632 10223 648 2849 -558 1138 -3307 -3209 -2184 671 -1127 -1741 -1910 -1483 606 51 754 557 -276 -410 350 -1257 -3821 -2204 -1717 2611 829 1756 -197 934 -807 -1519 -1794 1253 -347 -1235 1171 -285 -115 915 1177 917 -562 -3637 589 -4415 -653 -533 2449 620 1219 827 -36 -236 -1012 100 -1236 2884 -1188 1498 345 1592 -921 -337 744 378 1955 85 -141 -1154 -472 -1907 -3366 2551 -1900 -596 288 -237 25 622 -1067 2113 -712 1094 -832 483 447 -644 3755 -148 2459 -4070 2430 291 784 -2658 -448 -468 -2021 2833 654 968 1000 1568 2345 898 -733 -1545 407 -905 2185 -1211 1852 359 485 -2116 -234 159 -3453 862 382 -846 104 1144 -3297 -258 -1613 271 -829 -335 897 96 -766 2407 -113 2846 1567 -397 -2870 -1579 790 -1648 2485 611 9213 597 2456 -443 827 -2376 -2423 -1787 596 -1122 -1786 -2041 -1699 729 65 979 725 -346 -470 374 -1239 -3730 -2253 -1927 3109 1080 2378 -263 1151 -960 -1716 -2137 1585 -452 -1694 1640 -422 -181 1449 1859 1423 -817 -4960 747 -5911 -883 -752 3581 938 1801 1198 -52 -319 -1315 125 -1536 3687 -1677 2155 513 2362 -1455 -546 1249 650 3395 151 -242 -1934 -782 -3137 SS 20220718T145620.3Z 8234.622457 262 1 29.32 2 37.40 114.51 84.27 260.03 0.00 1 0.00 1 0 17 8.480e-03 5.959e-03 5.293e-03 2.655e-03 1.880864e-01 1.341759e-03 2.257174e-03 -6.000000e+00 4.829584e-03 232.88 -2.00 3.55 -2.00 316.20 0.00e+00 5.570338e-04 1.473774e-04 3.954965e-05 -6.000000e+00 2.138838e-04 287.38 -2.00 20.00 -2.00 315.41 0.00e+00 1.258 0.000 302.00 328.00 3 5.9641e+00 3.5259e-03 1.5956e-02 -6.0000e+00 1.2136e-02 3.9691e-02 3.9378e-03 9.9426e-03 -6.0000e+00 1.3142e-02 2.5276e-03 2.2588e-03 4.7919e-03 -6.0000e+00 7.8159e-03 -3.9839e-03 1.0368e-03 1.3663e-03 -6.0000e+00 3.2980e-03 3.1937e-04 2.1172e-04 7.2840e-05 1.4718e-05 -6.0000e+00 2.1660e-04 -2.5616e-03 5.3365e-05 10 0 0 10 0 0 99.98 18.68 0.47 -0.00256 -0.00097 27 27 4 8 0 1085.650 15.00 18.68 29.54 22.09 22.09 10.9 1009.46 -1830 -1529 -663 -2023 -2519 940 -407 -159 -793 453 -1665 -1748 -791 1229 727 888 544 722 884 1029 869 931 517 -56 133 928 -682 123 -911 1155 1206 970 1730 -177 -1918 -2382 -2011 -885 134 -482 -620 -679 114 -913 -497 -826 -936 -588 -1141 -314 737 464 65 1132 646 1373 761 478 562 298 534 1132 1033 1659 419 24 -975 -1173 552 311 508 395 905 553 488 -168 -505 -1188 -951 -421 -1226 -872 -2140 -1323 -670 -716 -226 361 340 561 427 157 49 -185 119 -250 734 637 499 15 42 -797 -770 -352 -439 -597 -531 -298 68 153 244 399 -151 -96 -671 -98 -491 370 10 375 -204 284 288 229 656 278 558 497 456 161 468 25 -319 104 472 -37 89 262 -156 47 -298 -546 -809 -385 -344 -150 -424 -475 165 -77 -33 -179 105 -392 -414 -200 341 227 300 188 255 321 385 330 345 197 -23 55 396 -294 48 -343 418 458 374 714 -76 -782 -958 -861 -434 76 -317 -424 -479 82 -664 -357 -593 -674 -406 -766 -207 508 340 48 874 511 1090 619 386 444 235 435 986 939 1582 393 21 -794 -956 456 294 504 407 923 545 460 -148 -398 -921 -744 -370 -1165 -877 -2298 -1467 -771 -885 -283 463 437 707 492 171 50 -181 123 -276 859 826 656 19 51 -941 -862 -416 -550 -783 -706 -412 97 225 374 608 -219 -132 -870 -122 -620 471 14 536 -300 408 406 316 850 354 670 603 591 214 647 35 -456 154 719 -58 141 427 -256 74 -474 -841 -1225 SS 20220718T150213.1Z 8234.626541 264 1 5.46 2 36.43 116.13 85.29 261.04 0.00 1 0.00 1 0 17 8.291e-03 6.055e-03 3.142e-03 1.947e-03 1.788841e-01 9.901222e-04 2.169056e-03 -6.000000e+00 4.722113e-03 232.88 -2.00 3.55 -2.00 315.40 0.00e+00 5.233054e-04 9.218601e-05 2.972544e-05 -6.000000e+00 2.091293e-04 287.38 -2.00 20.00 -2.00 314.68 0.00e+00 1.242 0.000 302.00 328.00 3 3.9736e+00 2.5783e-03 1.5526e-02 -6.0000e+00 1.1866e-02 1.8130e-02 2.8677e-03 9.4754e-03 -6.0000e+00 1.2850e-02 3.1640e-03 1.6359e-03 4.5709e-03 -6.0000e+00 7.6421e-03 -3.5922e-03 7.2740e-04 1.2969e-03 -6.0000e+00 3.2245e-03 2.4420e-03 2.9110e-04 5.2577e-05 1.4875e-05 -6.0000e+00 2.1180e-04 -2.2903e-03 4.9583e-05 12 1 1 12 1 1 98.49 18.68 0.34 -0.00229 -0.00010 10 64 2 8 0 471.180 15.00 18.68 29.85 22.09 22.09 11.0 1010.95 163 -522 -546 -2788 -2741 -1885 -634 595 1366 302 -1949 -236 -675 70 479 138 -331 506 796 1790 566 50 1283 492 1664 176 274 -418 -163 1081 1199 1026 1829 -470 -2009 -1677 -1389 -1534 -381 -242 -1055 -910 -542 -864 -756 -494 -597 -504 -1127 25 677 604 806 743 461 642 820 739 355 316 1150 853 1669 1442 226 -45 -304 -331 435 408 372 516 116 678 51 -251 -561 -540 -656 -566 -989 -1153 -2133 -1596 -958 -590 -208 249 311 383 547 78 282 202 298 135 483 762 228 -141 -363 -411 -792 56 -671 -705 -819 -390 -120 165 247 267 14 39 -140 198 119 54 284 -52 -91 -83 265 203 796 297 614 836 726 520 133 159 -235 127 -40 40 16 43 -132 -128 -225 -561 -656 46 -158 -166 -795 -705 -462 -163 168 407 94 -597 -71 -228 25 192 60 -141 218 353 811 263 23 591 240 830 92 142 -201 -75 477 555 498 911 -243 -992 -812 -714 -878 -249 -177 -806 -715 -436 -698 -605 -393 -460 -386 -840 18 517 473 658 615 390 548 711 635 300 267 998 771 1612 1426 220 -42 -262 -284 383 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