File name: Pandora55s1_QueensNY_20201114_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T172733.3Z 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_20201114_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: 20201114 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 20201114T123337.2Z 7623.523347 81 1 50.33 2 82.17 122.65 73.17 125.42 0.00 1 0.00 1 0 54 5.863e-01 2.902e-02 2.040e-01 5.241e-03 7.921397e-01 3.066027e-03 9.086593e-03 -6.000000e+00 3.544629e-01 223.27 -2.00 3.51 -2.00 321.63 0.00e+00 5.464317e-03 1.652307e-03 5.875385e-03 -6.000000e+00 1.785392e-02 280.54 -2.00 20.00 -2.00 321.15 0.00e+00 6.846 0.006 302.00 328.00 3 8.3481e-01 1.0994e-02 8.7755e-02 -6.0000e+00 8.8052e-01 5.6006e-01 1.5178e-02 6.6179e-02 -6.0000e+00 9.6692e-01 -7.5450e-01 1.4568e-02 2.4777e-02 -6.0000e+00 5.7110e-01 3.0374e-01 6.7498e-03 1.0057e-02 -6.0000e+00 2.4199e-01 1.1562e-04 -2.1029e-03 1.5647e-04 1.0374e-04 -6.0000e+00 1.8434e-02 8.8981e-03 9.5114e-05 12 9 8 11 8 0 -2.92 23.02 0.57 0.00890 -0.00690 55 10 1 5 0 914.910 25.90 20.00 23.02 13.04 26.3 951.74 900000 900000 -203595 900000 82358 -190649 900000 -32336 900000 -210907 31909 -192075 900000 900000 -94482 -58776 900000 900000 900000 900000 10633 7884 -91715 -66609 -20933 900000 29556 -14343 -75643 110155 900000 -12845 -48976 55437 900000 -24211 -689 326219 134285 30158 30947 2852 57932 49057 129506 3141 108212 68292 63021 21070 21109 -10872 76899 85337 23776 62764 47077 55871 19457 27074 38519 15837 -6389 36804 -2777 22846 -2619 17528 18082 2270 9091 17403 -1515 17561 6361 7068 18668 4849 -2630 -5354 13026 -2854 57 -5296 1015 -5151 -2746 -4763 864 -2528 -1703 802 418 -820 -1842 -4267 -1626 -1047 -4535 -685 -1106 -434 1841 2038 -2022 -1934 -970 -809 2402 -2111 -2935 116 -1703 -976 -520 1717 2260 -491 -110 -2443 443 1667 4032 25 1630 314 2292 1103 -918 268 2283 2198 1557 922 145 107 398 -225 -2902 140 -340 -351 -1198 900000 900000 -7080 900000 420 -4859 900000 -199 900000 -8099 163 -7977 900000 900000 -3038 -1555 900000 900000 900000 900000 178 134 -4188 -2517 -533 900000 456 -333 -3252 886 900000 -489 -2918 1251 900000 -1137 -28 1663 2101 1467 1643 208 2599 2429 3009 247 3236 3121 3232 1738 1924 -1485 5017 5519 2871 5452 4789 5141 2437 3117 4128 2314 -1299 5565 -640 4172 -610 3566 4067 661 2684 4909 -496 4531 1668 1676 3824 1178 -772 -1909 4558 -1306 28 -2878 551 -3108 -1695 -3060 524 -1535 -975 428 221 -460 -1173 -3189 -1367 -987 -4772 -708 -1093 -393 1519 1659 -1779 -1795 -941 -838 2646 -2683 -4132 170 -2588 -1462 -755 2385 3143 -721 -167 -3907 687 2491 5733 36 2244 427 3016 1520 -1411 455 4171 4283 3201 2000 333 257 971 -555 -7307 338 -787 -771 -2569 SS 20201114T124526.2Z 7623.531553 84 1 50.44 2 80.31 124.77 71.47 127.74 0.00 1 0.00 1 0 25 4.999e-01 1.171e-02 1.340e-01 2.392e-03 6.838141e-01 1.319039e-03 7.841107e-03 -6.000000e+00 2.960116e-01 223.27 -2.00 3.51 -2.00 320.97 0.00e+00 4.412261e-03 6.121623e-04 2.481396e-03 -6.000000e+00 1.386003e-02 280.54 -2.00 20.00 -2.00 320.44 0.00e+00 5.670 0.003 302.00 328.00 3 8.0287e-01 4.3018e-03 6.8384e-02 -6.0000e+00 7.2916e-01 8.6735e-02 5.8675e-03 4.2288e-02 -6.0000e+00 7.9492e-01 -8.6242e-02 6.0005e-03 1.9055e-02 -6.0000e+00 4.7289e-01 2.4329e-02 2.8885e-03 8.7432e-03 -6.0000e+00 2.0364e-01 4.2935e-04 -1.1667e-03 7.0707e-05 8.0240e-05 -6.0000e+00 1.5490e-02 8.5540e-03 6.4004e-05 12 8 8 10 0 0 6.58 23.02 0.34 0.00855 -0.00021 113 21 1 5 0 442.410 25.90 20.00 23.02 13.90 26.3 956.68 900000 900000 -212807 900000 -92083 -165655 900000 -93877 -106273 -187312 -37040 -182261 -7908 900000 -67962 -73652 -74078 900000 81525 31307 -39651 -14559 -69341 -54926 -40283 322052 -16844 -14510 -47338 -7838 12039 -15185 -35145 4375 92865 -23784 -8456 22253 18646 -3486 -1385 -9850 2070 2491 8704 -4971 12867 8887 7782 2658 398 -5551 10147 9979 2098 10778 5775 7901 1885 4274 6748 1364 -2256 5865 -1507 5655 192 4164 3707 393 189 2163 -2891 1165 -127 428 3532 1187 -313 -798 2653 -1880 -1104 -2136 -1236 -1985 -1496 -1728 -848 -187 404 563 1190 1716 437 -313 458 76 -1131 -391 -426 622 1355 662 -790 -1076 -1052 -544 464 -487 -1036 201 -178 -146 525 952 1298 274 -589 -1344 -461 246 464 -95 519 192 1532 723 -100 599 609 705 391 316 -297 -83 118 -248 -1398 -42 -61 -4 237 900000 900000 -3432 900000 -433 -1649 900000 -587 -828 -3446 -179 -4343 -46 900000 -1130 -1522 -1742 900000 513 337 -861 -256 -2170 -1632 -1119 751 -395 -335 -1548 -201 307 -595 -1867 167 1536 -1210 -420 994 1033 -274 -119 -976 193 239 810 -537 1226 922 867 338 57 -940 1626 1725 412 2044 1166 1558 385 857 1392 325 -627 1671 -479 1683 60 1324 1307 160 83 963 -1325 491 -50 155 1192 424 -126 -375 1386 -1140 -718 -1483 -900 -1527 -1195 -1412 -685 -146 299 397 820 1218 345 -280 457 85 -1346 -466 -485 653 1337 655 -825 -1181 -1206 -657 597 -686 -1575 317 -284 -228 795 1397 1905 417 -937 -2204 -750 389 713 -144 762 275 2138 1043 -156 1016 1109 1348 777 654 -644 -188 271 -574 -3266 -96 -134 -9 489 SS 20201114T130219.7Z 7623.543284 97 1 49.49 2 77.73 127.89 69.13 131.17 0.00 1 0.00 1 0 25 1.395e-01 6.723e-03 3.879e-02 1.098e-03 5.678585e-01 5.767415e-04 6.665400e-03 -6.000000e+00 8.147396e-02 223.27 -2.00 3.51 -2.00 320.05 0.00e+00 1.729914e-03 1.992659e-04 1.102056e-03 -6.000000e+00 3.639512e-03 280.54 -2.00 20.00 -2.00 319.45 0.00e+00 4.571 0.002 302.00 328.00 3 5.7042e-01 1.6862e-03 5.4216e-02 -6.0000e+00 2.0032e-01 2.7640e-02 2.0845e-03 3.0687e-02 -6.0000e+00 2.1783e-01 -1.1577e-02 1.8960e-03 1.4923e-02 -6.0000e+00 1.3007e-01 -6.2257e-03 9.7147e-04 5.0509e-03 -6.0000e+00 5.5450e-02 1.7352e-03 -7.9675e-04 3.2626e-05 5.6083e-05 -6.0000e+00 4.1845e-03 8.2585e-03 6.0371e-05 11 8 0 10 0 0 40.34 23.02 0.24 0.00826 0.00227 251 47 1 5 0 197.120 25.90 20.00 23.02 14.84 26.5 960.63 -3125 -2904 -46650 -50094 -20807 -69190 57553 -41015 -42836 -57914 -38644 -44265 -23145 15772 -27747 -11594 -6389 16833 1659 1491 -5879 -6315 -9635 -13321 -5192 2478 -2885 -9981 -9302 -2875 906 -3349 -8192 -600 5666 -5292 -4907 3060 -1905 -2614 -3015 -2738 -1810 -793 2038 -1903 1554 24 2935 -286 752 -181 2363 2283 478 1566 234 2019 119 1869 1774 2346 361 987 -169 1454 503 2445 1587 93 79 -611 -521 -695 229 112 1539 1005 -9 -253 81 -1561 -1541 -1392 -1044 -1089 -946 -695 -557 30 743 922 1599 1502 1394 644 907 -159 -526 -363 -303 120 979 167 -1015 -747 -1016 -85 56 -120 -548 -138 -185 99 616 821 909 337 -321 -1079 -482 -241 -218 -50 122 354 1354 1054 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