File name: Pandora179s1_CornwallCT_20231025_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20240124T080454.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c40p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 179 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20231025_L1_smca1c40d20221201p1-8.txt Full location name: Cornwall - Mohawk Mt CTDEEP (USEPA AQS Site ID 09-005-0005) Short location name: CornwallCT Country of location: United States Location latitude [deg]: 41.8213 Location longitude [deg]: -73.2973 Location altitude [m]: 505 Local noon date: 20231025 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: 205 347 Nominal wavelengths inside fitting window [nm]: 305.0173 305.1585 305.2997 305.4409 305.5821 305.7232 305.8644 306.0055 306.1467 306.2878 306.4289 306.5700 306.7111 306.8521 306.9932 307.1343 307.2753 307.4163 307.5573 307.6983 307.8393 307.9803 308.1213 308.2623 308.4032 308.5442 308.6851 308.8260 308.9669 309.1078 309.2487 309.3896 309.5304 309.6713 309.8121 309.9529 310.0938 310.2346 310.3754 310.5161 310.6569 310.7977 310.9384 311.0792 311.2199 311.3606 311.5013 311.6420 311.7827 311.9234 312.0640 312.2047 312.3453 312.4859 312.6265 312.7672 312.9077 313.0483 313.1889 313.3295 313.4700 313.6105 313.7511 313.8916 314.0321 314.1726 314.3131 314.4535 314.5940 314.7344 314.8749 315.0153 315.1557 315.2961 315.4365 315.5769 315.7173 315.8576 315.9980 316.1383 316.2786 316.4189 316.5592 316.6995 316.8398 316.9801 317.1203 317.2606 317.4008 317.5410 317.6812 317.8214 317.9616 318.1018 318.2420 318.3821 318.5223 318.6624 318.8025 318.9426 319.0827 319.2228 319.3629 319.5029 319.6430 319.7830 319.9231 320.0631 320.2031 320.3431 320.4831 320.6230 320.7630 320.9029 321.0429 321.1828 321.3227 321.4626 321.6025 321.7424 321.8823 322.0221 322.1620 322.3018 322.4416 322.5814 322.7212 322.8610 323.0008 323.1406 323.2803 323.4201 323.5598 323.6995 323.8392 323.9789 324.1186 324.2583 324.3980 324.5376 324.6773 324.8169 324.9565 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20231025T115750.5Z 8698.498501 149 1 11.37 2 83.63 112.52 138.45 314.18 0.00 1 0.00 1 0 25 6.217e-01 3.576e-02 4.706e-01 2.475e-02 8.428689e-01 1.489427e-02 9.233361e-03 -6.000000e+00 3.718137e-01 224.67 -2.00 3.52 -2.00 322.11 0.00e+00 1.667295e-02 8.656878e-03 1.173642e-02 -6.000000e+00 1.929866e-02 279.53 -2.00 20.00 -2.00 321.66 0.00e+00 8.149 0.010 302.00 328.00 3 1.4619e+00 5.7482e-02 1.2457e-01 -6.0000e+00 9.2031e-01 1.0003e+00 7.9807e-02 1.3556e-01 -6.0000e+00 1.0139e+00 -1.3368e+00 7.2789e-02 3.7979e-02 -6.0000e+00 5.9239e-01 5.4408e-01 3.3346e-02 1.9302e-02 -6.0000e+00 2.5475e-01 2.4030e-05 -2.2637e-03 7.3479e-04 1.4160e-04 -6.0000e+00 1.9462e-02 7.1220e-03 0.0000e+00 12 9 9 12 1 1 99.18 22.70 0.50 0.00712 -0.00989 5 6 1 5 0 1893.900 25.90 20.00 22.70 16.95 27.0 939.04 900000 900000 -65421 900000 900000 900000 900000 -184520 87016 900000 -140153 -163492 -70580 -56123 900000 5888 900000 18435 -29386 118712 81266 900000 900000 18244 900000 11655 53703 35806 -75960 -38770 900000 43597 900000 900000 900000 44508 163617 900000 900000 900000 91714 900000 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517 -3364 -4702 4422 4070 1485 1126 5830 -1195 2159 1451 44 1418 -2378 -1105 5146 -1402 -5108 -5247 -5541 -4176 -2812 588 923 1964 -2443 -402 3614 6352 -5320 -4899 -2581 1046 -4400 -10362 -1458 1422 2174 258 2546 395 1032 5746 -2874 2057 1705 -2150 7810 -917 3845 2217 4238 2290 2388 -958 -300 -2763 4694 337 2889 -2745 358 -2227 -3130 -3945 SS 20231025T120727.9Z 8698.505184 152 1 48.51 2 81.99 114.22 139.60 317.16 0.00 1 0.00 1 0 17 5.058e-01 1.235e-02 2.827e-01 4.956e-03 7.298540e-01 2.717061e-03 8.204639e-03 -6.000000e+00 2.886889e-01 224.67 -2.00 3.52 -2.00 321.57 0.00e+00 5.667330e-03 1.426580e-03 1.718612e-03 -6.000000e+00 1.310708e-02 279.53 -2.00 20.00 -2.00 321.07 0.00e+00 6.714 0.006 302.00 328.00 3 1.5283e+00 9.6109e-03 7.4067e-02 -6.0000e+00 7.1569e-01 2.4208e-01 1.4065e-02 4.0400e-02 -6.0000e+00 7.8194e-01 -2.8530e-01 1.5038e-02 2.3718e-02 -6.0000e+00 4.6320e-01 1.0680e-01 6.9908e-03 1.0109e-02 -6.0000e+00 1.9598e-01 1.0367e-04 -1.2609e-03 1.3866e-04 1.2692e-04 -6.0000e+00 1.3851e-02 7.5569e-03 0.0000e+00 12 8 8 10 0 0 99.23 22.71 0.54 0.00756 -0.00192 79 19 1 5 0 613.940 25.90 20.00 22.71 17.72 27.2 944.37 -65560 900000 -182323 -166843 -41681 -175046 -130391 -197557 -55100 900000 -254436 -129941 -179834 -140363 83789 -4113 18253 -58684 14495 45541 63934 -61905 900000 -71515 7103 51079 -49870 -30498 -47986 -26175 21740 -43385 -17412 900000 -10509 20540 -49761 -18173 5321 45375 2055 7974 20700 3349 3200 -1218 -21761 12572 15134 -94 10558 27725 -1364 19462 11892 22087 8966 -2464 3640 3737 -813 -6131 9119 8307 10847 -1455 6565 1864 1245 3042 5760 2990 3802 3828 -1449 1106 1389 124 -699 -952 -4852 -1105 -506 -5039 484 658 1337 292 2388 -1055 -753 -3243 -2701 -570 -971 -456 -900 836 -44 -403 -856 -506 -1272 -1296 -1303 -402 464 -1306 -452 253 1191 -39 -32 121 -549 28 81 512 596 -28 168 280 700 929 -437 1290 -276 703 469 -151 370 -94 -374 -544 -206 -60 93 540 83 66 -65 -275 -635 -317 900000 -1761 -1392 -201 -1384 -687 -2255 -266 900000 -6592 -1084 -3159 -2219 405 -27 112 -876 115 308 371 -1142 900000 -1601 86 419 -1156 -574 -1066 -506 315 -1488 -547 900000 -335 466 -2452 -764 216 1490 119 474 1150 230 224 -92 -2081 893 1111 -9 979 2451 -162 2265 1597 2795 1213 -373 554 556 -130 -1034 1517 1598 2196 -332 1375 425 314 871 1785 1001 1252 1188 -432 288 337 31 -199 -327 -2051 -520 -262 -2912 283 409 867 198 1581 -699 -465 -1927 -1547 -332 -643 -352 -817 863 -47 -428 -937 -495 -1139 -1155 -1245 -404 489 -1511 -526 331 1731 -62 -50 188 -814 40 116 765 942 -46 272 434 1041 1334 -613 1720 -364 970 741 -274 736 -187 -787 -1224 -494 -151 238 1403 216 163 -152 -600 -1353 SS 20231025T121703.3Z 8698.511844 155 1 48.43 2 80.37 115.94 140.69 320.26 0.00 1 0.00 1 0 17 3.159e-01 6.084e-03 5.995e-02 1.418e-03 6.201249e-01 7.377142e-04 6.998967e-03 -6.000000e+00 1.787473e-01 224.67 -2.00 3.52 -2.00 320.86 0.00e+00 2.361941e-03 3.205892e-04 4.699539e-04 -6.000000e+00 7.889270e-03 279.53 -2.00 20.00 -2.00 320.30 0.00e+00 5.705 0.003 302.00 328.00 3 5.0979e-01 2.3377e-03 6.2444e-02 -6.0000e+00 4.4137e-01 5.7134e-02 3.1102e-03 3.3022e-02 -6.0000e+00 4.8090e-01 -6.3243e-02 3.1525e-03 1.7127e-02 -6.0000e+00 2.8670e-01 1.6433e-02 1.5438e-03 6.0198e-03 -6.0000e+00 1.2134e-01 8.1911e-04 -8.1345e-04 3.9858e-05 6.7094e-05 -6.0000e+00 8.6096e-03 6.2334e-03 0.0000e+00 10 0 0 10 0 0 96.11 22.73 0.28 0.00623 0.00012 262 63 1 5 0 184.820 25.90 20.00 22.73 18.55 27.2 948.48 -91930 -59059 -73713 -90915 -96597 -126759 -103013 -128303 -93671 -81941 -129466 -81143 -89934 -42492 -32475 -22984 -35224 -29852 -21842 -19228 -17667 -26829 -4850 -24724 -7412 -17609 -18616 -19408 -17180 -21541 -12583 -13714 -6633 8549 -6631 -1771 -11600 -2844 -3631 2334 -2074 452 -221 -1613 -302 -309 -1133 1973 1706 -119 3412 3432 915 3593 1243 3510 1271 1421 896 1664 339 1632 3295 3574 2071 585 1235 148 1290 1966 1554 839 1035 385 -332 -416 -812 -1188 -1100 -633 -1317 -725 -1928 -1819 -933 -468 -154 -74 744 572 716 243 66 503 237 -38 365 641 33 -262 -355 -665 -535 72 -824 -1133 -953 -997 -573 237 357 -51 159 119 18 329 468 275 227 -214 -406 145 321 317 227 607 227 1035 337 175 148 -177 -201 -38 -243 -137 -5 208 -237 -111 165 -123 -189 -508 -286 -459 -679 -708 -1209 -826 -1508 -894 -770 -2076 -886 -1330 -505 -445 -350 -696 -623 -462 -423 -398 -668 -101 -684 -189 -531 -587 -606 -513 -709 -444 -588 -310 378 -336 -84 -654 -173 -275 202 -215 50 -26 -199 -37 -39 -148 258 234 -18 543 615 185 703 266 769 295 331 205 371 79 409 923 1128 706 199 410 51 480 837 740 423 520 185 -148 -166 -302 -445 -456 -309 -759 -476 -1293 -1296 -705 -377 -130 -64 644 479 559 178 47 360 189 -35 389 721 41 -325 -414 -703 -561 76 -937 -1265 -1122 -1258 -787 335 558 -84 262 190 28 473 675 417 365 -360 -680 234 498 475 353 905 330 1555 532 312 269 -342 -409 -81 -527 -311 -13 492 -559 -252 351 -266 -397 SS 20231025T122534.0Z 8698.517755 160 1 48.63 2 78.96 117.49 141.59 323.12 0.00 1 0.00 1 0 17 2.018e-01 5.456e-03 2.886e-02 9.906e-04 5.548339e-01 5.059944e-04 6.354661e-03 -6.000000e+00 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