File name: Pandora55s1_QueensNY_20201101_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171252.5Z 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_20201101_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: 20201101 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 20201101T124514.1Z 7610.531413 285 1 50.11 2 77.37 122.38 96.21 295.08 0.00 1 0.00 1 0 25 6.175e-01 2.529e-02 1.853e-01 4.172e-03 5.023089e-01 2.242371e-03 5.908875e-03 -6.000000e+00 3.676863e-01 224.40 -2.00 3.51 -2.00 320.00 0.00e+00 8.092050e-03 7.472832e-04 3.123608e-04 -6.000000e+00 1.746970e-02 282.14 -2.00 20.00 -2.00 319.37 0.00e+00 4.449 0.002 302.00 328.00 3 3.2256e+00 6.5443e-03 5.1476e-02 -6.0000e+00 9.0622e-01 1.4375e-01 7.8745e-03 2.8139e-02 -6.0000e+00 9.8765e-01 -1.4790e-01 6.4809e-03 1.4699e-02 -6.0000e+00 5.8715e-01 6.3152e-02 3.3299e-03 9.6526e-03 -6.0000e+00 2.4978e-01 1.3992e-04 -1.9488e-03 1.3047e-04 8.9882e-05 -6.0000e+00 1.9290e-02 1.3300e-02 -9.0775e-05 12 9 8 11 32 0 99.77 23.00 0.58 0.01330 -0.00134 15 3 1 5 0 3339.900 25.90 20.00 23.00 16.54 26.3 967.30 900000 381156 -112453 900000 -41020 -34025 900000 53688 185097 -108651 112414 -66259 900000 900000 8582 -48045 -95302 900000 66492 375124 27880 27378 -21727 -15442 -26551 900000 -2765 -7347 -43265 3159 11740 7845 -21601 13748 308802 -12924 -16590 44542 29326 14263 17604 -12501 5652 2264 20337 -894 32044 19273 14123 5239 -8582 12411 4102 17216 -1416 11952 6633 5945 -1104 1157 5837 24 -7291 7928 1084 5710 -1164 8957 4843 -4615 -719 3816 1691 5177 -2370 2219 4380 456 -1662 -2780 6241 -2787 -830 -5064 -262 -4034 -2507 -1707 -1671 -3994 -1765 800 -412 -985 -1170 -2020 -815 -207 -1582 1123 -407 -897 2015 2543 -105 -843 210 -254 2267 -882 -1225 -285 -124 -883 120 778 884 299 -254 -2470 -207 1723 2716 944 1428 -144 1130 594 -728 481 1779 1701 1567 463 188 996 611 -225 -3770 91 -881 -757 -181 900000 1549 -5010 900000 -820 -633 900000 498 752 -5194 689 -2633 900000 900000 308 -3332 -11272 900000 1945 1524 1223 1205 -1558 -1090 -2153 900000 -182 -499 -4208 217 858 683 -2695 1256 1640 -1505 -2207 3932 3482 2201 2872 -2843 1134 479 3741 -203 5468 3775 2998 1274 -2554 3320 1262 4982 -500 3846 2254 2020 -394 408 2077 10 -3491 3568 528 2609 -550 3971 2424 -2756 -444 2333 1040 2958 -1347 1120 2057 224 -904 -1729 4047 -2128 -665 -4409 -231 -3845 -2461 -1701 -1661 -3930 -1625 682 -341 -831 -1063 -2042 -903 -248 -2018 1409 -495 -1023 2152 2725 -120 -1014 261 -332 3069 -1304 -1921 -456 -198 -1374 179 1114 1265 442 -392 -3993 -332 2690 4125 1416 2080 -207 1567 839 -1099 772 2988 2970 2814 868 366 1996 1255 -470 -8058 186 -1774 -1470 -344 SS 20201101T125124.6Z 7610.535702 288 1 49.28 2 76.39 123.54 97.22 296.12 0.00 1 0.00 1 0 25 4.250e-01 2.225e-02 1.637e-01 4.550e-03 4.725040e-01 2.445826e-03 5.654572e-03 -6.000000e+00 2.532166e-01 224.40 -2.00 3.51 -2.00 319.88 0.00e+00 2.000164e-03 7.958283e-04 1.723049e-03 -6.000000e+00 1.232895e-02 282.14 -2.00 20.00 -2.00 319.24 0.00e+00 4.150 0.001 302.00 328.00 3 3.6718e+00 7.1002e-03 4.8622e-02 -6.0000e+00 6.2397e-01 4.6779e-02 8.6104e-03 2.7826e-02 -6.0000e+00 6.8003e-01 -3.4084e-02 7.2827e-03 1.2352e-02 -6.0000e+00 4.0468e-01 1.5348e-02 3.7425e-03 4.5661e-03 -6.0000e+00 1.7388e-01 1.2764e-04 -1.0252e-03 1.4506e-04 4.5848e-05 -6.0000e+00 1.3276e-02 1.2530e-02 -3.3315e-05 12 9 8 11 32 0 99.62 23.00 1.49 0.01253 0.00483 16 3 1 5 0 3079.430 25.79 20.00 23.00 16.72 26.3 968.25 900000 900000 -114577 900000 33709 -75841 900000 100244 132351 -82940 119625 -79217 900000 900000 -9273 -46497 80857 900000 217601 167887 13418 22972 -18216 -26815 -14962 900000 5989 -9787 -31520 -5586 25742 -5019 -21366 1986 246459 -273 -20370 51104 21553 -1796 13277 -13673 1382 2512 20166 -8323 26792 9473 14395 -4691 -6990 -10788 13197 13136 -2967 11083 6731 7992 -2026 3563 3368 1151 -8888 7045 -4349 4979 -1497 9257 4707 -4264 -434 2755 -4995 4394 -384 1320 9745 -943 -1220 -972 7256 -2547 -576 -5150 -853 -2258 -2598 -2734 -874 1370 -2632 900 1375 -148 1412 -1616 830 -307 442 -26 -576 575 1598 2138 -593 -330 -487 1005 1943 -451 -1896 -240 -786 -1465 -329 745 1992 -131 -770 -2925 -509 837 3402 13 1046 -960 1083 359 -604 126 2122 1011 794 582 -134 837 -326 -255 -721 74 3 -703 -1340 900000 900000 -4661 900000 292 -1972 900000 580 608 -3289 702 -3721 900000 900000 -383 -3069 1707 900000 1370 1792 655 1043 -1288 -2208 -1170 900000 392 -724 -2871 -428 1656 -491 -2646 202 2314 -29 -2890 4390 2899 -343 2412 -3358 306 560 3874 -2096 4937 2075 3114 -1271 -2098 -3629 3841 4067 -1104 3770 2404 2819 -769 1294 1281 486 -4476 3290 -2277 2331 -724 4179 2415 -2606 -276 1754 -3359 2615 -222 694 4504 -482 -676 -608 4730 -1976 -468 -4566 -770 -2175 -2608 -2810 -882 1317 -2490 779 1140 -126 1272 -1641 914 -370 558 -33 -699 647 1711 2310 -685 -399 -613 1308 2653 -669 -2993 -385 -1257 -2280 -487 1055 2792 -192 -1183 -4714 -815 1306 5110 20 1511 -1368 1483 502 -898 200 3501 1744 1409 1071 -258 1655 -664 -524 -1495 149 6 -1345 -2537 SS 20201101T130125.4Z 7610.542655 291 1 50.79 2 74.83 125.45 98.83 297.83 0.00 1 0.00 1 0 25 2.269e-01 1.761e-02 4.788e-02 3.328e-03 4.278565e-01 1.743675e-03 5.100300e-03 -6.000000e+00 1.348777e-01 224.40 -2.00 3.51 -2.00 319.35 0.00e+00 1.516214e-03 4.745736e-04 6.409892e-04 -6.000000e+00 6.053712e-03 282.14 -2.00 20.00 -2.00 318.68 0.00e+00 3.749 0.001 302.00 328.00 3 3.6255e+00 4.8793e-03 4.3325e-02 -6.0000e+00 3.3311e-01 3.3145e-02 5.7429e-03 2.2818e-02 -6.0000e+00 3.6261e-01 -2.4347e-02 4.4357e-03 1.1023e-02 -6.0000e+00 2.1561e-01 8.8229e-03 2.3139e-03 3.6433e-03 -6.0000e+00 9.1365e-02 2.0865e-04 -7.8832e-04 1.0403e-04 4.1112e-05 -6.0000e+00 6.9297e-03 1.1085e-02 4.4441e-05 12 9 8 11 32 0 99.74 23.01 0.37 0.01109 0.00516 20 4 1 5 0 2539.090 25.90 19.99 23.01 17.06 26.4 970.17 65019 900000 -86384 17036 -19364 -48599 900000 4935 13793 -61284 15661 -47756 49359 150706 -10371 -24947 900000 88073 43938 40112 3760 4378 -20662 -13007 -16881 51840 5839 -16689 -20145 -7725 5095 -1248 -15320 -669 62645 -5089 -16766 16008 11648 -970 3196 -6277 -2374 31 7796 -5125 12652 6846 7097 -462 -4588 -5722 6759 7079 -95 4551 3575 3845 -1236 1547 3120 778 -3450 4400 -2049 3912 -2584 5562 2410 -3763 -723 2090 58 2089 315 285 1606 150 -1633 -1655 3164 -2782 -1022 -1327 -619 -2022 -1893 -1707 -1068 -1544 -1139 1695 1462 72 1492 -806 106 -498 -1362 -199 -580 729 1344 1658 -324 -345 354 221 1589 -48 -1133 -33 -413 -410 -260 420 1584 105 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