File name: Pandora55s1_QueensNY_20200924_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T170750.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20200924_L1_smca1c10d20200414p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20200924 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 20200924T114923.6Z 7572.492634 67 1 49.19 2 78.78 100.87 162.11 28.97 0.00 1 0.00 1 0 25 4.939e-01 2.408e-02 1.694e-01 4.628e-03 5.885903e-01 2.599777e-03 6.746342e-03 -6.000000e+00 3.049970e-01 228.17 -2.00 3.51 -2.00 320.58 0.00e+00 1.297530e-03 1.073205e-03 7.679237e-04 -6.000000e+00 1.543877e-02 286.77 -2.00 20.00 -2.00 319.92 0.00e+00 4.960 0.002 302.00 328.00 3 2.8120e+00 8.1922e-03 5.8356e-02 -6.0000e+00 7.5869e-01 7.6190e-02 1.0524e-02 3.1853e-02 -6.0000e+00 8.2720e-01 -7.3406e-02 9.5084e-03 1.5564e-02 -6.0000e+00 4.8386e-01 2.7860e-02 4.6849e-03 5.0581e-03 -6.0000e+00 2.0229e-01 1.2190e-04 -1.1319e-03 1.4425e-04 5.8941e-05 -6.0000e+00 1.5508e-02 1.2928e-02 -7.2416e-05 12 9 8 11 32 0 99.10 22.95 0.39 0.01293 0.00442 17 3 1 5 0 2892.850 25.79 20.02 22.95 24.97 26.4 1007.27 -23333 900000 -185122 900000 900000 900000 900000 -91867 900000 -94447 336087 -146671 20375 900000 28698 -102036 25277 900000 225313 900000 -24965 -40854 -65006 85856 -21928 900000 11529 -75646 -13966 -26448 75892 -17905 -34681 34194 900000 -32064 -15865 116808 36883 -1627 33611 -26361 -2544 17445 48556 -5171 28805 11804 28030 -2402 -2878 -12260 13910 24656 16057 20883 11385 9945 763 3246 17640 2845 -7856 10472 2166 10010 -5886 6155 3208 -742 -2101 2720 -10155 8083 -1552 4140 7848 -1171 1279 -3043 5877 -430 735 -1828 1039 -3446 -3278 -2328 -406 -3895 -890 3944 -1701 48 302 -856 -748 -500 -1678 -204 4 -344 2991 2126 -1534 -1125 -477 -163 105 1149 -2651 217 -753 181 148 976 1539 38 -708 -3185 3 1128 4000 972 746 -1540 1366 655 -833 1274 2184 -277 577 1362 -742 347 -163 -55 -467 262 -2029 -161 -242 -129 900000 -5360 900000 900000 900000 900000 -1353 900000 -1676 1513 -5494 194 900000 375 -5224 431 900000 1015 900000 -850 -1658 -3522 1226 -927 900000 367 -5379 -570 -1334 1698 -1122 -2794 1485 900000 -2655 -1279 3257 2601 -190 3105 -4516 -364 2109 4469 -798 3313 1637 3520 -428 -567 -2893 2809 4839 3587 4645 2812 2484 204 849 4233 857 -2890 3536 812 3437 -2312 2257 1332 -355 -1096 1403 -5772 3736 -727 1700 2968 -491 578 -1638 3314 -284 515 -1382 810 -2935 -2912 -2092 -358 -3428 -727 2936 -1289 37 252 -803 -782 -570 -2040 -246 4 -369 2982 2151 -1673 -1283 -565 -203 138 1624 -4103 340 -1194 278 219 1391 2187 57 -1099 -5179 5 1751 5929 1438 1077 -2197 1870 921 -1265 2062 3738 -504 1078 2633 -1517 729 -350 -119 -1018 559 -4256 -321 -474 SS 20200924T120609.0Z 7572.504271 76 1 50.01 2 75.68 103.76 160.43 38.95 0.00 1 0.00 1 0 25 2.231e-01 1.629e-02 8.449e-02 3.181e-03 4.769359e-01 1.694799e-03 5.646608e-03 -6.000000e+00 1.336617e-01 228.16 -2.00 3.51 -2.00 319.60 0.00e+00 1.685191e-03 5.001099e-04 8.342582e-04 -6.000000e+00 6.056041e-03 286.77 -2.00 20.00 -2.00 318.86 0.00e+00 3.956 0.001 302.00 328.00 3 3.2811e+00 4.8516e-03 4.6829e-02 -6.0000e+00 3.3194e-01 5.7773e-02 5.7822e-03 2.6041e-02 -6.0000e+00 3.5972e-01 -5.1558e-02 4.5195e-03 1.2319e-02 -6.0000e+00 2.1400e-01 2.0185e-02 2.3334e-03 4.1091e-03 -6.0000e+00 9.0787e-02 2.2367e-04 -1.1088e-03 9.8143e-05 4.4782e-05 -6.0000e+00 6.8418e-03 1.2273e-02 -4.2391e-06 12 9 8 11 32 0 99.66 22.96 0.67 0.01227 0.00394 17 3 1 5 0 2940.910 25.79 20.00 22.96 25.60 26.3 1010.20 -52952 900000 -110179 141811 47420 37359 900000 -42439 -35002 -88200 24199 -43728 22064 900000 -5680 -48391 50778 12001 26240 24240 -6027 5807 -27512 -18455 -19494 740 -2541 12688 -11728 -9742 9394 -7034 -5388 8457 56049 -16075 -8379 20218 11403 -3252 11748 -11678 -4715 4375 10713 -2250 9486 4723 8553 -198 -1688 -4625 4323 9387 5158 6997 5437 4226 751 1296 6744 -89 -2323 2676 -3809 3022 -2343 3917 3294 -73 -1032 431 -5289 -665 -619 1445 2800 -325 -513 -2243 1417 -1127 -426 -3766 95 -2823 -1740 -1486 -62 -1770 574 1644 324 665 1413 -335 117 -112 -1030 -25 -134 126 1938 972 -1421 -288 -203 263 1411 702 -1274 -132 74 163 330 567 1070 -264 -368 -2035 247 786 140 -893 790 -328 1567 674 -106 663 1092 848 558 555 -700 189 -285 -388 -594 -273 -254 155 -560 -1343 900000 -5234 561 448 401 900000 -1222 -1020 -4483 450 -1775 576 900000 -273 -3891 1739 634 1281 1251 -423 371 -2530 -1670 -1893 61 -215 904 -1050 -915 836 -825 -676 949 3955 -2280 -1242 2721 1972 -731 2513 -3242 -1273 1105 2588 -615 2355 1242 2235 -59 -548 -1665 1542 3397 2009 2776 2220 1735 313 541 2792 -42 -1222 1437 -2186 1592 -1260 2047 1876 -47 -715 303 -3864 -450 -394 836 1517 -181 -309 -1535 1043 -923 -368 -3502 90 -2868 -1821 -1583 -66 -1835 559 1500 288 596 1344 -353 135 -139 -1346 -33 -167 148 2158 1102 -1710 -360 -262 353 1974 1047 -2018 -213 119 253 492 818 1536 -394 -569 -3285 397 1242 217 -1366 1164 -474 2183 956 -159 1056 1819 1465 991 1016 -1339 372 -572 -790 -1211 -548 -498 294 -1049 SS 20200924T121605.2Z 7572.511172 79 1 50.47 2 73.86 105.52 159.25 44.15 0.00 1 0.00 1 0 25 6.923e-02 7.711e-03 1.585e-02 1.402e-03 4.350523e-01 7.345015e-04 5.164672e-03 -6.000000e+00 4.116882e-02 228.16 -2.00 3.51 -2.00 319.00 0.00e+00 6.777144e-04 1.795551e-04 4.423494e-04 -6.000000e+00 1.853862e-03 286.77 -2.00 20.00 -2.00 318.23 0.00e+00 3.537 0.001 302.00 328.00 3 2.2423e+00 2.0379e-03 4.1949e-02 -6.0000e+00 1.0214e-01 2.0371e-02 2.3641e-03 2.3018e-02 -6.0000e+00 1.1059e-01 -4.3967e-03 1.7135e-03 1.1150e-02 -6.0000e+00 6.6033e-02 -5.6610e-03 8.9652e-04 3.2544e-03 -6.0000e+00 2.8010e-02 1.0034e-03 -6.9355e-04 4.2995e-05 3.8636e-05 -6.0000e+00 2.0800e-03 1.1518e-02 2.1532e-05 11 8 0 10 0 0 99.02 22.96 0.22 0.01152 0.00631 76 14 1 5 0 663.980 25.79 20.01 22.96 26.19 26.4 1013.40 -16813 49049 -32976 10035 -416 -1352 21285 -15609 -6129 -26276 -10405 -11193 -2823 17068 -2245 -11377 -2998 5187 5812 2179 349 3394 -4898 -5053 -3037 8451 -2202 -7416 -4650 -1470 2732 -850 -6768 1317 7233 -3579 -2820 3562 -316 -2840 310 -3544 -1936 -422 1784 -1384 590 -688 1603 54 118 -688 1958 2148 1667 1495 1168 611 191 1550 2183 1187 -313 344 -737 1116 49 1876 1582 -34 33 -536 -1353 -42 -451 864 1621 1293 143 51 139 -1259 -994 -1576 -837 -1257 -916 -645 -642 -278 304 745 1458 1517 1548 815 440 -392 -862 -476 -448 138 1299 319 -1097 -559 -638 -178 90 -71 -615 -356 -64 35 759 815 865 463 -308 -1124 -471 -332 190 -230 287 194 1370 1033 292 490 394 386 352 486 -222 -154 128 -410 -999 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