File name: Pandora51s1_OldFieldNY_20231117_L2Fit_fout2c5d20211018p1-8.txt File generation date: 20231118T045456.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 51 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora51_OF_v5d20190801.txt Instrument calibration file used: Pandora51s1_CF_v5d20211018.txt Level 1 file used: Pandora51s1_OldFieldNY_20231117_L1_smca1c5d20211018p1-8.txt Full location name: Flax Pond NYSDEC (USEPA AQS ID 36-103-0044) Short location name: OldFieldNY Country of location: USA Location latitude [deg]: 40.9635 Location longitude [deg]: -73.1402 Location altitude [m]: 3 Local noon date: 20231117 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 3 - Full Lab Cal on 1.8 for HCHO First and last pixel inside fitting window: 257 399 Nominal wavelengths inside fitting window [nm]: 305.1342 305.2748 305.4155 305.5562 305.6968 305.8375 305.9781 306.1187 306.2593 306.3999 306.5405 306.6810 306.8216 306.9621 307.1027 307.2432 307.3837 307.5242 307.6647 307.8052 307.9457 308.0861 308.2266 308.3670 308.5074 308.6478 308.7882 308.9286 309.0690 309.2094 309.3497 309.4901 309.6304 309.7707 309.9110 310.0513 310.1916 310.3319 310.4722 310.6124 310.7527 310.8929 311.0331 311.1733 311.3135 311.4537 311.5939 311.7340 311.8742 312.0143 312.1545 312.2946 312.4347 312.5748 312.7149 312.8549 312.9950 313.1350 313.2751 313.4151 313.5551 313.6951 313.8351 313.9751 314.1151 314.2550 314.3950 314.5349 314.6748 314.8147 314.9546 315.0945 315.2344 315.3743 315.5141 315.6540 315.7938 315.9336 316.0734 316.2132 316.3530 316.4928 316.6326 316.7723 316.9120 317.0518 317.1915 317.3312 317.4709 317.6106 317.7503 317.8899 318.0296 318.1692 318.3088 318.4484 318.5880 318.7276 318.8672 319.0068 319.1463 319.2859 319.4254 319.5649 319.7044 319.8439 319.9834 320.1229 320.2624 320.4018 320.5413 320.6807 320.8201 320.9595 321.0989 321.2383 321.3777 321.5170 321.6564 321.7957 321.9351 322.0744 322.2137 322.3530 322.4922 322.6315 322.7708 322.9100 323.0492 323.1885 323.3277 323.4669 323.6061 323.7452 323.8844 324.0235 324.1627 324.3018 324.4409 324.5800 324.7191 324.8582 324.9973 --------------------------------------------------------------------------------------- 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 20231117T130525.7Z 8721.545436 83 1 48.91 2 77.52 129.32 122.65 100.36 0.00 1 0.00 1 0 17 1.800e-01 9.590e-03 2.261e-01 6.433e-03 5.365050e-01 3.531017e-03 6.269622e-03 -6.000000e+00 1.073769e-01 223.20 -2.00 3.51 -2.00 320.78 0.00e+00 3.009563e-03 1.469481e-03 9.886037e-04 -6.000000e+00 4.762415e-03 280.27 -2.00 20.00 -2.00 320.23 0.00e+00 4.498 0.002 302.00 328.00 3 3.6663e+00 1.1132e-02 5.3185e-02 -6.0000e+00 2.6460e-01 4.4249e-02 1.4317e-02 3.0130e-02 -6.0000e+00 2.8713e-01 -4.2777e-02 1.3541e-02 1.4935e-02 -6.0000e+00 1.7065e-01 1.0162e-02 6.7000e-03 5.9621e-03 -6.0000e+00 7.3247e-02 8.5446e-05 -1.2447e-03 2.0783e-04 6.7656e-05 -6.0000e+00 5.5956e-03 1.9284e-03 -3.9264e-05 12 9 8 11 8 0 99.78 22.34 0.24 0.00193 -0.00742 30 7 1 5 0 1629.890 26.94 20.00 22.34 16.50 18.6 962.85 8622 -72514 33733 20439 -5669 -73933 -61229 900000 -46401 -24995 -79708 -4139 -63795 -32419 -10226 -71548 -41970 -3535 6141 -28859 -6829 -12645 -21958 14644 -6376 17785 -21329 15482 -27200 27696 6239 -15816 6599 -11044 13203 -4586 8211 -289 -6000 -408 -7906 5440 -11409 6038 -7765 5711 7201 6437 5687 8625 7818 -912 6806 105 3978 8936 3221 -720 -481 3632 709 752 325 357 1931 -2768 7515 2600 1922 349 -562 -2798 71 3387 424 1491 237 1327 -1167 -233 -2324 -2702 -1752 -2081 -357 -1302 -82 -418 -784 1682 309 934 -1154 923 58 679 1608 220 -131 -1147 607 -1059 1686 146 -2045 -1248 -565 349 -652 637 -84 -265 326 -674 843 631 1063 278 -671 -792 -159 567 -710 1158 -407 1105 434 1272 621 -79 -620 -210 385 -259 130 -197 -126 200 -6 -26 -467 65 900000 54 -869 212 128 -36 -859 -689 900000 -556 -266 -1500 -46 -1497 -691 -211 -2959 -1469 -94 158 -1071 -213 -416 -841 430 -239 558 -959 485 -1298 868 274 -968 366 -724 688 -291 520 -24 -613 -46 -1045 669 -1728 785 -1180 773 978 906 843 1335 1344 -188 1407 24 947 2091 808 -186 -122 897 192 225 106 125 673 -985 2468 940 758 157 -274 -1427 34 1488 180 572 88 508 -516 -118 -1345 -1749 -1211 -1537 -277 -1081 -70 -365 -677 1350 235 663 -816 670 48 630 1681 252 -157 -1359 675 -1100 1632 148 -2257 -1445 -689 442 -910 962 -137 -443 532 -1057 1233 899 1533 424 -1090 -1324 -263 903 -1107 1746 -599 1543 604 1860 983 -139 -1175 -417 777 -557 295 -468 -306 490 -16 -60 -1040 138 900000 SS 20231117T131536.0Z 8721.552500 86 1 48.92 2 76.06 131.28 120.85 101.74 0.00 1 0.00 1 0 25 1.005e-01 5.826e-03 6.212e-02 2.385e-03 4.947247e-01 1.256975e-03 5.687427e-03 -6.000000e+00 5.859582e-02 223.20 -2.00 3.51 -2.00 320.49 0.00e+00 2.518061e-03 4.827180e-04 4.680910e-04 -6.000000e+00 2.629743e-03 280.27 -2.00 20.00 -2.00 319.86 0.00e+00 4.057 0.001 302.00 328.00 3 2.5155e+00 3.8308e-03 4.7764e-02 -6.0000e+00 1.4399e-01 3.0714e-02 4.7697e-03 2.6195e-02 -6.0000e+00 1.5710e-01 -1.6869e-02 4.2583e-03 1.2924e-02 -6.0000e+00 9.3830e-02 -2.7705e-03 2.1353e-03 4.6462e-03 -6.0000e+00 3.9267e-02 4.3547e-04 -9.5072e-04 7.6586e-05 5.5326e-05 -6.0000e+00 3.0880e-03 1.2608e-03 -2.6193e-05 10 0 0 10 0 0 99.28 22.33 0.17 0.00126 -0.00588 128 29 1 5 0 382.110 26.94 19.99 22.33 17.04 18.6 966.16 -58072 -8374 -37346 6915 -51985 -2708 -16475 -40850 -7806 -45546 -6920 -31475 -5909 -4267 -3890 4857 -12365 19513 -3126 -1099 -6532 -4625 -3418 -1510 -486 -1758 -2733 -8249 1468 -4161 -3316 -3160 -1014 2095 -5785 657 -3976 4240 -649 -2074 -2190 -3696 942 -3283 3234 314 -316 28 -708 3354 1195 2426 2440 1468 1011 45 678 -386 1746 131 1893 1980 2394 749 -170 1224 245 1790 993 -13 -448 -437 -37 -654 33 -674 537 105 1242 -624 -1123 -1600 -1763 -947 -1147 -547 -427 29 79 272 734 97 1544 1118 531 850 1062 413 -558 -424 -451 173 605 384 -1187 -1568 -432 -602 172 -95 153 -224 178 252 575 976 716 322 -404 -807 -362 -46 82 58 355 176 1148 977 273 -147 -578 14 199 35 -237 -335 10 67 -244 -352 221 136 191 -859 -83 -505 57 -736 -24 -185 -656 -99 -896 -99 -672 -120 -96 -104 136 -451 560 -119 -43 -273 -194 -150 -70 -24 -90 -140 -435 71 -233 -211 -229 -79 160 -471 52 -378 443 -79 -294 -340 -618 156 -579 543 55 -56 5 -135 655 261 572 622 403 291 13 204 -117 509 39 591 681 908 309 -71 488 98 733 454 -7 -250 -249 -20 -344 16 -296 222 45 589 -348 -717 -1140 -1353 -767 -995 -500 -407 28 75 246 614 76 1165 881 467 847 1196 480 -682 -505 -539 189 633 417 -1393 -1952 -523 -781 240 -145 249 -373 288 386 829 1360 1017 482 -642 -1329 -590 -73 125 86 499 238 1639 1367 421 -249 -1055 27 396 74 -529 -727 21 150 -543 -807 481 284 397 SS 20231117T133837.2Z 8721.568487 96 1 48.87 2 72.91 135.89 116.81 104.82 0.00 1 0.00 1 0 25 2.833e-02 5.524e-03 1.341e-02 9.218e-04 4.178785e-01 4.759071e-04 4.875796e-03 -6.000000e+00 1.651577e-02 223.20 -2.00 3.51 -2.00 319.81 0.00e+00 1.309099e-03 1.458865e-04 2.987263e-04 -6.000000e+00 7.411577e-04 280.27 -2.00 20.00 -2.00 319.15 0.00e+00 3.353 0.001 302.00 328.00 3 1.6326e+00 1.3676e-03 3.9587e-02 -6.0000e+00 4.0585e-02 1.5825e-02 1.6314e-03 2.1610e-02 -6.0000e+00 4.4279e-02 4.6816e-04 1.3140e-03 1.0634e-02 -6.0000e+00 2.6446e-02 -1.0120e-02 6.7597e-04 3.2961e-03 -6.0000e+00 1.1068e-02 2.2643e-03 -7.2677e-04 2.9749e-05 4.2318e-05 -6.0000e+00 8.7028e-04 1.1407e-03 -6.9734e-06 10 0 0 10 0 0 99.59 22.32 0.24 0.00114 -0.00432 496 113 1 5 0 98.510 26.94 20.00 22.32 18.40 18.7 975.59 -12984 -8997 -15379 -7055 -11623 -5952 -5373 -7283 -5001 -8311 -4001 -7031 -2064 -1163 -1515 29 -1955 1618 -1827 182 -2381 1397 -1863 -1507 -2243 -2975 -1319 -3219 -1291 1541 1460 1492 -885 -2117 -2965 92 -853 209 -1563 -1518 -1687 -1854 -839 -1412 65 -597 -543 -235 -57 1751 614 1238 888 1011 710 409 -50 39 606 820 1437 1771 1338 362 -125 534 996 1622 1508 599 -152 44 -287 -162 -424 -319 308 402 360 -597 -885 -1506 -1589 -989 -800 -512 -473 -21 -94 158 557 604 1243 1321 964 769 663 40 -501 -577 -411 408 658 41 -1187 -1058 -649 -387 -28 -17 -167 -266 24 266 668 1018 765 401 -320 -742 -634 -111 46 155 275 404 1248 1349 377 -71 -341 -51 192 27 -268 -364 20 -3 -266 -245 -16 73 262 -260 -188 -346 -137 -224 -111 -109 -170 -125 -225 -110 -225 -75 -50 -77 2 -110 94 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