File name: Pandora55s1_QueensNY_20240307_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240315T153702.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240307_L1_smca1c17d20220526p1-8.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: 20240307 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]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 20240307T152050.6Z 8832.639475 208 1 15.65 2 51.64 145.70 64.87 189.71 0.00 1 0.00 1 0 25 8.872e-03 6.422e-03 7.971e-04 4.637e-04 2.372132e-01 2.429947e-04 2.891344e-03 -6.000000e+00 5.231086e-03 225.87 -2.00 3.51 -2.00 315.67 0.00e+00 1.303448e-05 2.366810e-05 4.718276e-05 -6.000000e+00 2.278315e-04 276.66 -2.00 20.00 -2.00 315.11 0.00e+00 1.608 0.000 302.00 328.00 3 1.3606e+00 6.2399e-04 2.0054e-02 -6.0000e+00 1.2955e-02 2.3819e-02 6.9528e-04 1.2007e-02 -6.0000e+00 1.4073e-02 -7.4315e-03 3.9925e-04 5.9506e-03 -6.0000e+00 8.3666e-03 2.2064e-04 1.7994e-04 1.6871e-03 -6.0000e+00 3.5334e-03 2.0653e-02 4.8098e-04 1.4246e-05 2.3772e-05 -6.0000e+00 2.6630e-04 1.3160e-02 0.0000e+00 12 9 1 12 5 1 99.79 22.71 0.19 0.01316 0.01677 171 105 1 5 0 90.960 26.00 20.00 22.71 16.25 36.0 1072.16 -2165 -3192 -3972 -2094 -548 774 750 1057 -897 -636 688 703 576 254 -249 -641 30 336 589 21 1350 1285 992 718 278 -405 -791 513 1302 1520 1640 1515 -905 -572 224 213 267 497 -573 -1229 -983 -1334 -988 -890 -753 -1043 -818 -558 378 727 545 817 703 586 561 827 238 622 906 1475 1306 1126 425 -759 -76 -27 390 1220 738 91 -392 -627 -525 -751 -31 263 579 1305 215 28 -681 -1491 -1291 -1060 -1021 -781 -563 -459 -616 -304 226 324 1194 1411 1223 758 820 -307 -466 -369 -522 109 797 49 -755 -243 -675 -54 -66 -130 -380 -345 -155 -161 538 802 809 723 42 -514 -257 -198 -216 221 159 502 1281 960 414 488 -24 213 101 226 -268 -134 157 -454 -421 -272 -241 -338 3 -572 -824 -1000 -508 -121 170 180 282 -243 -175 188 205 189 89 -97 -250 12 139 251 9 589 563 450 325 132 -196 -371 237 568 663 758 712 -456 -284 106 103 136 284 -370 -859 -704 -996 -747 -675 -568 -780 -596 -395 273 532 403 641 558 484 456 684 200 516 739 1251 1108 988 387 -727 -71 -24 338 1043 658 88 -392 -649 -539 -741 -29 240 502 1087 183 25 -672 -1561 -1386 -1158 -1150 -936 -686 -573 -765 -361 265 358 1250 1442 1316 839 968 -388 -600 -468 -642 128 921 57 -915 -311 -880 -70 -91 -185 -549 -502 -217 -223 703 1016 1015 943 57 -722 -359 -275 -301 294 208 643 1604 1202 531 647 -32 296 144 322 -393 -201 242 -700 -653 -426 -365 -509 4 SS 20240307T152605.2Z 8832.643116 212 1 0.30 2 51.09 147.21 65.03 190.99 0.00 1 0.00 1 0 25 1.391e-02 8.339e-03 9.560e-03 5.708e-03 2.351829e-01 2.990971e-03 2.876103e-03 -6.000000e+00 8.199120e-03 225.87 -2.00 3.51 -2.00 315.59 0.00e+00 -3.466427e-04 2.856668e-04 3.470962e-05 -6.000000e+00 3.570916e-04 276.66 -2.00 20.00 -2.00 315.03 0.00e+00 1.589 0.000 302.00 328.00 3 1.7192e+00 7.6751e-03 1.9854e-02 -6.0000e+00 2.0305e-02 2.6787e-02 8.5530e-03 1.1927e-02 -6.0000e+00 2.2058e-02 -7.2110e-03 4.9086e-03 5.9106e-03 -6.0000e+00 1.3114e-02 -2.3904e-04 2.2004e-03 1.6769e-03 -6.0000e+00 5.5383e-03 1.4756e-02 5.9849e-04 1.7491e-04 2.3593e-05 -6.0000e+00 4.1738e-04 1.2965e-02 0.0000e+00 12 9 1 12 5 1 999.00 22.71 0.33 0.01296 0.01746 1 67 1 5 0 143.130 26.00 20.00 22.71 16.74 36.2 1074.83 -1441 -5812 -4038 -6436 -1761 -2474 4571 927 1064 -902 1078 1328 -482 450 -1281 58 -1400 2790 -195 3179 1015 2096 -766 3704 103 -1624 -1565 1094 1876 818 3498 1615 658 -1354 547 626 -420 411 -652 -969 -123 -840 -1803 -1015 -1097 -585 -839 412 -1083 -129 95 1347 697 479 1126 -40 -716 408 630 594 1557 961 1017 -157 -48 539 883 859 -377 764 -155 -1136 -262 -471 -91 991 1082 87 -79 602 -1221 -1788 -881 -1520 -446 -516 -702 -209 -754 -296 623 -640 1634 1409 355 1240 969 -454 -906 -925 -731 286 1501 157 -996 356 -620 -228 154 -252 -775 -413 591 -50 23 1346 301 964 -90 -858 -603 155 -345 193 -88 272 1697 1075 260 738 -54 627 886 234 -626 201 351 -691 -493 -283 -185 -595 -320 -379 -1619 -1087 -1654 -413 -589 1107 250 302 -263 313 403 -161 163 -501 23 -585 1159 -85 1370 447 920 -350 1704 50 -804 -759 500 827 363 1588 779 328 -682 265 308 -223 241 -425 -679 -89 -627 -1370 -769 -831 -438 -620 298 -784 -94 71 1039 557 393 933 -34 -611 345 528 499 1332 858 946 -150 -45 486 765 742 -343 732 -156 -1167 -267 -469 -87 891 926 73 -69 554 -1205 -1862 -943 -1682 -509 -609 -855 -257 -929 -356 718 -704 1705 1455 380 1386 1146 -567 -1164 -1179 -902 338 1724 185 -1223 449 -804 -302 210 -354 -1116 -596 834 -68 30 1694 379 1235 -120 -1186 -845 216 -476 261 -116 348 2103 1336 332 976 -74 865 1232 332 -919 302 536 -1070 -766 -436 -280 -886 -472 SS 20240307T153001.6Z 8832.645852 215 1 1.78 2 50.69 148.37 65.16 191.95 0.00 1 0.00 1 0 25 9.016e-03 6.649e-03 2.997e-03 1.746e-03 2.319177e-01 9.139008e-04 2.832727e-03 -6.000000e+00 5.315909e-03 225.87 -2.00 3.51 -2.00 315.67 0.00e+00 9.336164e-05 8.892316e-05 5.996070e-05 -6.000000e+00 2.315237e-04 276.66 -2.00 20.00 -2.00 315.11 0.00e+00 1.575 0.000 302.00 328.00 3 1.7967e+00 2.3474e-03 1.9642e-02 -6.0000e+00 1.3165e-02 2.4838e-02 2.6160e-03 1.1758e-02 -6.0000e+00 1.4301e-02 -4.1833e-03 1.5025e-03 5.8264e-03 -6.0000e+00 8.5023e-03 -1.6462e-03 6.7676e-04 1.6578e-03 -6.0000e+00 3.5907e-03 1.3890e-02 4.3952e-04 5.3620e-05 2.3265e-05 -6.0000e+00 2.7061e-04 1.3074e-02 0.0000e+00 12 9 1 12 5 1 99.95 22.71 0.19 0.01307 0.01638 14 81 1 5 0 118.500 26.00 20.00 22.71 17.06 36.1 1076.28 -1780 -3375 -3590 -1411 -1512 1541 726 542 -1129 -481 -659 793 307 1086 -713 -175 316 154 1421 -265 1007 749 395 718 599 -407 -334 335 1842 1742 1353 1602 -829 -513 44 712 -346 865 -589 -1306 -835 -1225 -945 -1066 -409 -1328 -1037 -724 347 946 1035 750 318 484 508 1190 173 742 619 1434 964 1466 234 -741 -285 197 314 1325 894 -51 -195 -631 -439 -560 -20 -198 488 1320 77 -44 -695 -1905 -934 -1007 -1084 -735 -627 -695 -717 -27 491 491 1226 1331 1091 859 707 -405 -377 -446 -502 261 889 299 -964 -139 -623 26 -25 23 -394 -320 -443 -268 640 628 667 768 231 -659 -379 -150 -184 198 -30 574 1334 1039 197 577 55 327 9 339 -363 -99 210 -404 -430 -223 -250 -327 -95 -453 -893 -931 -338 -341 342 173 142 -313 -134 -186 232 98 380 -272 -69 128 64 596 -115 435 326 176 330 284 -196 -157 151 794 752 612 761 -412 -252 21 343 -181 500 -380 -907 -605 -911 -710 -801 -307 -994 -763 -524 248 678 766 578 253 396 421 995 147 623 517 1194 824 1304 218 -709 -269 177 272 1139 805 -49 -196 -647 -448 -559 -19 -179 417 1100 67 -41 -682 -1979 -1000 -1114 -1241 -871 -764 -860 -885 -32 566 539 1283 1373 1158 961 838 -508 -484 -569 -620 308 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