File name: Pandora179s1_CornwallCT_20241110_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20241111T044538.4Z 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 v1.8.60 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20241110_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: 20241110 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 20241110T124247.3Z 9080.529714 75 1 49.57 2 80.12 124.22 149.58 18.66 0.00 1 0.00 1 0 17 4.393e-01 2.447e-02 2.291e-01 6.418e-03 6.216960e-01 3.461352e-03 6.999696e-03 -6.000000e+00 2.494718e-01 223.17 -2.00 3.52 -2.00 320.82 0.00e+00 3.939077e-03 1.464817e-03 1.613286e-03 -6.000000e+00 1.240736e-02 277.34 -2.00 20.00 -2.00 320.29 0.00e+00 5.576 0.003 302.00 328.00 3 3.4739e+00 1.0754e-02 6.2186e-02 -6.0000e+00 6.1666e-01 2.4074e-01 1.4521e-02 3.6351e-02 -6.0000e+00 6.7557e-01 -2.1765e-01 1.4728e-02 1.7150e-02 -6.0000e+00 4.0266e-01 7.9821e-02 7.1814e-03 7.3619e-03 -6.0000e+00 1.7366e-01 4.3643e-05 -9.7152e-04 1.8606e-04 6.5828e-05 -6.0000e+00 1.2462e-02 1.4861e-02 0.0000e+00 12 9 8 11 32 0 99.72 22.67 0.10 0.01486 0.00756 14 3 1 5 0 3540.510 25.90 19.99 22.67 8.48 32.9 901.55 900000 900000 -116310 900000 900000 -96734 72586 -171767 -15348 900000 -217855 82046 -157382 9579 900000 6992 900000 88168 155946 900000 900000 900000 900000 -49435 130010 119679 -9470 9245 -22039 -7756 19020 2709 89946 48828 59572 59751 -37855 15963 52705 85896 13336 15690 28122 19259 -5517 13207 8826 23541 22770 6163 14390 47923 4917 15074 274 28728 6319 -9789 12637 9448 -882 -4511 8727 9438 3276 -19098 9902 540 -2293 2617 5793 730 1144 175 -2074 3990 -41 -3390 188 -4071 -10206 1497 -1520 -4439 1925 -2325 1916 0 2423 -2475 2869 -3551 1209 2320 -447 587 -2665 1790 -539 482 -1460 -902 -144 -883 -867 1163 1876 -2928 -1751 -108 1215 -599 -456 528 174 633 -1716 1135 93 -248 223 -331 266 1824 -1190 4878 -709 1240 956 649 -200 -1623 1429 -93 -405 772 171 -110 -27 550 -1642 -221 -676 900000 900000 -1920 900000 900000 -1122 453 -4904 -111 900000 -12441 512 -6670 106 900000 112 900000 847 974 900000 900000 900000 900000 -2228 1124 1208 -330 280 -826 -266 631 117 2031 1806 1918 1866 -3141 904 2710 3797 1279 1582 2635 2028 -753 1526 1087 2573 2611 885 2099 5580 963 2892 64 5280 1491 -2703 2706 2048 -218 -1266 2433 2939 1146 -7626 3101 190 -908 1057 2504 347 536 78 -927 1504 -15 -1286 77 -1907 -5941 884 -1013 -3229 1402 -1883 1563 0 2017 -2082 2130 -2621 815 1589 -351 528 -2679 1966 -658 580 -1676 -927 -135 -839 -885 1230 2080 -3649 -2359 -150 1842 -974 -737 811 253 878 -2456 1653 145 -403 357 -514 395 2577 -1663 6558 -978 1760 1441 1102 -353 -3075 2753 -192 -853 1682 382 -250 -62 1181 -3391 -449 -1345 SS 20241110T131841.5Z 9080.554647 94 1 48.39 2 74.83 131.12 146.62 33.52 0.00 1 0.00 1 0 17 4.881e-02 5.099e-03 2.228e-02 1.496e-03 4.293865e-01 7.519961e-04 5.032469e-03 -6.000000e+00 2.743512e-02 223.17 -2.00 3.52 -2.00 319.62 0.00e+00 1.058868e-03 2.140382e-04 2.159165e-04 -6.000000e+00 1.207390e-03 277.34 -2.00 20.00 -2.00 319.02 0.00e+00 3.751 0.001 302.00 328.00 3 2.4123e+00 2.1134e-03 4.1331e-02 -6.0000e+00 6.7566e-02 4.1295e-02 2.4992e-03 2.2062e-02 -6.0000e+00 7.3746e-02 -4.2524e-03 2.0399e-03 1.1098e-02 -6.0000e+00 4.3958e-02 -8.2814e-03 1.0718e-03 3.4567e-03 -6.0000e+00 1.8604e-02 8.5012e-04 -4.4605e-04 4.3776e-05 3.8777e-05 -6.0000e+00 1.3298e-03 1.3254e-02 0.0000e+00 10 0 0 10 0 0 99.98 22.67 0.20 0.01325 0.00990 308 74 1 5 0 157.100 25.90 20.00 22.67 8.88 32.9 903.86 10253 -3141 -4351 -17037 -15175 -21468 -20098 -11862 -16337 562 -24916 2112 -18887 182 -2230 244 -5566 -3514 1771 497 2422 -2904 6517 -5963 2770 -1458 -2897 -4105 -4397 -3269 -637 1584 26 5535 -3260 -1048 -4603 -57 -898 528 -1604 -1490 -141 -902 -45 -531 -352 -349 -299 -748 744 1629 84 2206 19 1977 646 559 103 656 378 897 1755 1712 848 -1119 788 -642 1146 745 563 369 258 210 -251 238 -368 -393 -567 -149 -1483 -899 -2097 -1752 -756 -559 -185 60 812 89 543 202 329 567 475 343 669 909 45 65 -223 -654 -273 239 -651 -994 -578 -720 -307 63 330 -126 87 61 40 301 313 310 50 -154 -561 220 -15 349 322 582 265 1027 280 238 -43 -481 -135 -94 -193 -138 152 280 -86 -103 12 -260 -123 147 -60 -90 -390 -310 -445 -434 -267 -436 14 -811 55 -716 7 -105 13 -345 -229 117 35 172 -218 458 -511 234 -136 -279 -386 -394 -294 -62 171 3 689 -426 -130 -643 -9 -172 108 -377 -373 -36 -240 -12 -143 -95 -94 -82 -212 224 533 30 830 8 808 275 238 43 269 160 409 882 943 485 -621 408 -337 636 473 396 272 190 148 -164 139 -198 -206 -321 -97 -1119 -757 -1773 -1557 -711 -562 -196 65 874 93 524 181 300 513 428 349 769 1170 58 82 -289 -772 -299 267 -793 -1286 -782 -953 -435 96 544 -215 145 97 59 416 434 450 78 -252 -927 353 -23 520 457 856 376 1487 413 384 -75 -873 -251 -172 -375 -281 316 593 -182 -212 24 -487 -225 SS 20241110T133541.7Z 9080.566455 107 1 17.56 2 72.51 134.59 144.76 39.73 0.00 1 0.00 1 0 17 3.614e-02 6.829e-03 1.945e-02 2.920e-03 3.751542e-01 1.448603e-03 4.455835e-03 -6.000000e+00 2.031781e-02 223.16 -2.00 3.52 -2.00 318.43 0.00e+00 1.165716e-03 2.886258e-04 1.279574e-04 -6.000000e+00 8.941320e-04 277.34 -2.00 20.00 -2.00 317.80 0.00e+00 3.282 0.001 302.00 328.00 3 3.5987e+00 3.8817e-03 3.6055e-02 -6.0000e+00 5.0038e-02 5.9396e-02 4.4339e-03 1.9021e-02 -6.0000e+00 5.4614e-02 -1.6811e-02 3.0290e-03 9.4876e-03 -6.0000e+00 3.2554e-02 3.7503e-04 1.5932e-03 2.9173e-03 -6.0000e+00 1.3779e-02 4.2082e-04 -4.2098e-04 8.3486e-05 3.0496e-05 -6.0000e+00 9.8480e-04 1.2855e-02 0.0000e+00 12 9 1 12 1 1 98.77 22.67 0.30 0.01285 0.00969 11 8 1 5 0 1462.870 25.90 20.00 22.67 9.54 33.1 907.62 -2426 7934 -10618 -7123 -6511 -12760 -5234 -15258 -11325 11765 -18196 -8045 -2189 -8330 4623 -2847 2221 -1369 -67 352 2972 2002 8140 -2651 3336 90 -4109 -2563 -2158 -3480 -249 -1504 2711 5447 -3936 -909 -5073 -1776 1147 1086 -1713 -1626 1054 -116 -2094 -1907 -1210 890 -483 -262 1185 2551 272 1068 486 2659 1984 -445 975 336 1054 1792 1899 1430 706 -1956 360 225 199 576 480 339 512 -109 -229 36 -1374 -567 524 -834 -1238 -1325 -2011 -2062 -758 -311 48 -139 814 -315 963 401 462 877 551 11 298 722 225 -332 -352 -538 -506 -185 -740 -986 -316 -1125 -385 417 349 -184 61 293 1 332 84 125 589 -52 -55 -11 204 501 449 437 495 1087 446 89 -107 -406 61 -185 -42 -7 134 -4 -235 -53 -15 -387 -312 -99 334 -570 -359 -294 -579 -230 -832 -670 595 -1264 -525 -155 -748 432 -329 264 -179 -9 50 423 287 1120 -433 547 16 -773 -455 -361 -589 -44 -304 584 1209 -918 -199 -1249 -458 347 390 -659 -663 435 -49 -911 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