File name: Pandora55s1_QueensNY_20201027_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T171301.7Z 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_20201027_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: 20201027 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 20201027T141709.1Z 7605.595244 220 1 2.16 2 63.04 140.61 148.00 6.14 0.00 1 0.00 1 0 25 1.052e-02 7.196e-03 3.609e-03 1.577e-03 2.792360e-01 8.176176e-04 3.425315e-03 -6.000000e+00 6.179465e-03 224.83 -2.00 3.51 -2.00 316.56 0.00e+00 -1.466814e-04 9.944146e-05 7.127135e-05 -6.000000e+00 2.769713e-04 282.74 -2.00 20.00 -2.00 315.86 0.00e+00 2.193 0.000 302.00 328.00 3 8.9625e-01 2.1159e-03 2.6032e-02 -6.0000e+00 1.5235e-02 1.4247e-02 2.3704e-03 1.4239e-02 -6.0000e+00 1.6544e-02 -3.7107e-03 1.3831e-03 7.0495e-03 -6.0000e+00 9.8799e-03 -2.1577e-03 6.5483e-04 1.9949e-03 -6.0000e+00 4.2061e-03 1.7525e-02 -4.6598e-04 4.8415e-05 2.7176e-05 -6.0000e+00 3.1570e-04 8.1865e-03 1.3737e-05 12 9 1 12 1 1 52.67 22.96 0.24 0.00819 0.00468 19 96 1 5 0 98.850 25.79 20.02 22.96 18.18 26.5 975.48 -2154 -3939 -4569 -4213 -734 -555 1393 -353 -476 -1564 1248 -686 438 633 -1400 -392 -204 256 -218 -169 1086 1426 756 885 126 -222 -565 -347 1018 1321 2285 1514 -336 -888 38 482 455 1267 -756 -1209 -1175 -1373 -1102 -619 -473 -758 -1114 -455 520 926 851 886 1027 596 623 561 296 695 891 1358 1067 1206 678 -751 -384 103 550 1522 1062 79 -418 -786 -548 -568 -114 360 573 1540 670 -102 -551 -1510 -1218 -1193 -1301 -685 -631 -850 -905 -201 323 359 1400 1634 1489 782 928 -473 -811 -652 -603 -37 1120 393 -748 -534 -719 -326 -243 -162 -284 -350 -165 21 723 757 792 962 -161 -666 -593 -448 -291 194 511 584 1595 1215 714 538 181 240 108 469 -223 -265 -21 -251 -629 -347 -155 -436 -118 -355 -693 -790 -670 -105 -80 216 -62 -91 -310 245 -148 99 163 -385 -115 -62 81 -72 -58 368 486 269 313 47 -85 -211 -122 362 473 816 592 -141 -375 15 197 196 605 -413 -715 -751 -874 -714 -402 -306 -489 -743 -296 332 604 561 625 732 446 480 443 227 551 694 1057 829 1006 588 -664 -348 87 453 1240 901 72 -399 -781 -539 -536 -104 306 465 1255 557 -92 -534 -1561 -1292 -1290 -1449 -810 -759 -1053 -1116 -236 365 385 1481 1693 1570 882 1119 -594 -1043 -857 -772 -45 1289 467 -928 -679 -961 -441 -336 -231 -414 -518 -244 31 978 997 1032 1298 -226 -967 -858 -643 -417 276 690 775 2073 1582 954 747 258 353 158 713 -350 -426 -34 -413 -1046 -566 -251 -682 -184 SS 20201027T142258.5Z 7605.599288 223 1 50.92 2 62.35 142.01 147.84 8.72 0.00 1 0.00 1 0 25 9.998e-03 6.636e-03 1.218e-03 4.494e-04 2.717525e-01 2.322742e-04 3.321952e-03 -6.000000e+00 5.875434e-03 224.83 -2.00 3.51 -2.00 316.95 0.00e+00 -1.757542e-04 3.123019e-05 8.241310e-05 -6.000000e+00 2.632617e-04 282.74 -2.00 20.00 -2.00 316.23 0.00e+00 2.144 0.000 302.00 328.00 3 1.6007e+00 6.0603e-04 2.5420e-02 -6.0000e+00 1.4486e-02 9.3531e-03 6.8081e-04 1.3882e-02 -6.0000e+00 1.5728e-02 4.2049e-03 4.0212e-04 6.8704e-03 -6.0000e+00 9.3929e-03 -5.2954e-03 1.9415e-04 1.9464e-03 -6.0000e+00 4.0001e-03 9.1984e-03 -3.2349e-05 1.3916e-05 2.5550e-05 -6.0000e+00 3.0008e-04 8.0610e-03 9.6917e-05 11 8 0 10 0 0 100.00 22.96 0.16 0.00806 0.00782 651 123 1 5 0 77.360 25.79 20.00 22.96 18.38 26.4 976.23 -3155 -2383 -5087 -2253 -1100 386 1634 615 145 -983 1835 634 1395 807 -562 -881 -266 200 316 -382 470 1183 562 529 -56 -142 -995 666 1314 1550 1717 1427 -1222 -973 844 158 534 371 -546 -1592 -1151 -1286 -1139 -922 -716 -1031 -836 -567 350 731 474 796 684 660 411 922 315 517 787 1435 1441 1202 619 -615 -167 136 578 1642 1126 128 -429 -684 -597 -725 -290 360 822 1732 621 204 -503 -1479 -1259 -1066 -946 -809 -620 -517 -667 -295 225 438 1433 1633 1452 905 769 -277 -715 -439 -561 -7 862 217 -804 -477 -749 -209 -35 -110 -344 -385 -189 -106 532 870 886 641 -101 -701 -591 -335 -316 174 266 420 1400 1131 509 486 24 235 262 327 -142 -192 77 -368 -507 -253 -224 -233 37 -427 -335 -719 -286 -128 45 205 87 22 -157 290 109 270 169 -133 -225 -71 55 90 -113 139 351 174 163 -18 -47 -325 202 404 479 534 484 -449 -355 292 56 211 164 -273 -912 -674 -787 -711 -577 -447 -641 -509 -338 205 436 300 538 466 470 303 692 240 391 585 1064 1112 954 533 -536 -143 114 451 1264 941 115 -401 -665 -576 -671 -259 302 658 1333 510 179 -478 -1490 -1298 -1160 -1054 -960 -746 -638 -820 -348 255 472 1475 1645 1545 1022 928 -356 -939 -570 -713 -9 992 258 -994 -623 -993 -289 -49 -159 -522 -593 -282 -153 732 1169 1177 854 -144 -1031 -863 -502 -460 243 366 571 1802 1457 695 686 35 349 399 500 -222 -316 127 -620 -862 -423 -373 -374 60 SS 20201027T142810.1Z 7605.602895 226 1 16.25 2 61.75 143.27 147.67 11.01 0.00 1 0.00 1 0 25 9.472e-03 6.679e-03 1.032e-03 4.633e-04 2.663412e-01 2.407455e-04 3.270752e-03 -6.000000e+00 5.566287e-03 224.83 -2.00 3.51 -2.00 316.48 0.00e+00 -6.775283e-05 2.879290e-05 6.513721e-05 -6.000000e+00 2.494103e-04 282.74 -2.00 20.00 -2.00 315.78 0.00e+00 2.103 0.000 302.00 328.00 3 6.8598e-01 6.2303e-04 2.4923e-02 -6.0000e+00 1.3723e-02 6.4673e-03 6.9734e-04 1.3596e-02 -6.0000e+00 1.4900e-02 -8.2298e-04 4.0645e-04 6.7315e-03 -6.0000e+00 8.8987e-03 -2.3635e-03 1.9162e-04 1.9084e-03 -6.0000e+00 3.7896e-03 2.4168e-02 -8.5056e-05 1.4279e-05 2.6074e-05 -6.0000e+00 2.8429e-04 8.1690e-03 9.9555e-05 12 9 1 12 1 1 99.96 22.95 0.20 0.00817 0.00753 265 157 1 5 0 60.430 25.79 20.00 22.95 18.56 26.4 977.25 -2038 -3268 -4132 -3198 -387 -727 1102 320 -627 -773 863 1244 776 597 -527 -231 -165 574 202 -268 682 1389 929 345 287 -548 -660 240 1678 1326 1535 1296 -1057 -1100 344 372 347 554 -871 -1341 -1165 -1065 -1197 -864 -692 -972 -711 -605 453 742 681 706 905 574 637 823 392 553 814 1469 1309 1212 594 -664 -304 167 533 1418 1130 106 -395 -796 -536 -726 -227 295 738 1438 578 33 -621 -1454 -1282 -1062 -1076 -813 -627 -485 -716 -258 192 368 1206 1578 1330 914 834 -299 -634 -481 -536 -56 850 190 -816 -460 -746 -180 -26 -106 -334 -318 -163 -43 523 938 906 674 -100 -661 -567 -330 -215 110 304 497 1427 1195 561 473 29 247 246 277 -223 -208 39 -374 -525 -277 -255 -290 80 -350 -595 -740 -524 -57 -118 177 58 -124 -156 174 269 177 156 -156 -68 -51 183 67 -92 233 475 330 131 107 -210 -246 89 591 471 582 501 -442 -457 136 149 156 276 -492 -816 -765 -692 -796 -576 -460 -643 -460 -403 296 494 455 505 651 433 494 653 316 441 639 1150 1019 1016 516 -611 -275 141 438 1150 992 95 -388 -781 -522 -706 -213 261 594 1165 476 29 -592 -1473 -1332 -1162 -1210 -938 -762 -604 -890 -308 220 400 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