File name: Pandora55s1_QueensNY_20240211_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240212T051439.0Z 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_20240211_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: 20240211 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 20240211T193345.2Z 8807.815106 301 1 50.17 2 64.11 219.41 49.11 193.77 0.00 1 0.00 1 0 25 2.501e-02 6.874e-03 4.659e-03 1.127e-03 3.568824e-01 5.813756e-04 4.264826e-03 -6.000000e+00 1.468427e-02 224.76 -2.00 3.51 -2.00 317.67 0.00e+00 3.619117e-04 9.277472e-05 1.412304e-04 -6.000000e+00 6.386692e-04 275.26 -2.00 20.00 -2.00 317.08 0.00e+00 2.277 0.000 302.00 328.00 3 3.3647e+00 1.5338e-03 2.9003e-02 -6.0000e+00 3.6290e-02 3.5453e-02 1.7278e-03 1.8052e-02 -6.0000e+00 3.9466e-02 -1.2520e-02 1.0845e-03 8.9850e-03 -6.0000e+00 2.3464e-02 4.9480e-04 5.4891e-04 2.6220e-03 -6.0000e+00 9.9176e-03 1.1940e-03 3.5276e-04 3.4487e-05 3.2056e-05 -6.0000e+00 7.5054e-04 1.4490e-02 0.0000e+00 11 9 0 11 4 0 99.31 22.68 0.17 0.01449 0.01714 58 11 1 5 0 864.910 26.00 20.00 22.68 15.55 35.6 1074.73 -8975 9686 -13884 -1950 -1155 -2780 7222 -213 -3568 -6755 -4382 -4867 -3524 4713 -1200 -2703 -11263 4444 3560 2142 1160 1742 -2939 120 -857 3739 -1376 -395 -796 775 2333 -82 -1941 -876 2918 -1304 -294 620 432 -1787 -249 -1664 -1231 -594 450 -1345 222 235 1216 783 845 415 1772 1538 461 1221 590 1161 852 1317 1735 1156 -454 -179 -202 467 53 1112 884 84 -294 -502 -950 -281 -364 469 706 937 -113 -467 -224 -1543 -1170 -1420 -1139 -1060 -378 -560 -554 -161 285 438 1182 1449 814 797 401 -216 -528 -407 -703 43 733 -8 -696 -256 -674 -31 188 -39 -565 -84 -190 -204 508 742 1017 647 -8 -647 -218 -17 -72 58 138 318 1254 847 280 478 148 476 285 285 -282 -127 145 -452 -557 -278 -308 -192 -31 -732 702 -1233 -145 -81 -202 524 -18 -343 -690 -452 -554 -457 655 -197 -485 -2289 827 695 433 240 363 -662 28 -210 899 -338 -93 -184 182 585 -23 -580 -260 819 -388 -95 229 183 -845 -124 -866 -651 -314 237 -717 116 123 635 421 477 248 1098 993 307 825 404 789 572 886 1198 846 -356 -145 -163 362 40 839 710 73 -268 -466 -880 -252 -310 373 533 701 -90 -401 -207 -1531 -1208 -1523 -1267 -1225 -448 -674 -665 -188 319 465 1201 1470 865 903 487 -279 -706 -540 -902 52 864 -9 -871 -331 -899 -42 266 -58 -867 -130 -291 -301 720 1018 1389 905 -12 -971 -330 -25 -107 84 194 436 1668 1136 392 698 225 736 448 460 -470 -218 252 -796 -985 -485 -527 -321 -51 SS 20240211T194722.6Z 8807.824567 306 1 50.42 2 65.80 222.55 49.73 198.05 0.00 1 0.00 1 0 25 1.626e-02 6.162e-03 2.418e-03 5.397e-04 3.798513e-01 2.785031e-04 4.542372e-03 -6.000000e+00 9.545515e-03 224.76 -2.00 3.51 -2.00 317.77 0.00e+00 7.642072e-05 4.569380e-05 1.603867e-04 -6.000000e+00 4.151952e-04 275.26 -2.00 20.00 -2.00 317.18 0.00e+00 2.423 0.000 302.00 328.00 3 1.7735e+00 7.3661e-04 3.0879e-02 -6.0000e+00 2.3590e-02 3.6485e-02 8.3025e-04 1.9227e-02 -6.0000e+00 2.5656e-02 -1.4528e-02 5.2755e-04 9.5719e-03 -6.0000e+00 1.5253e-02 -2.0090e-05 2.6886e-04 2.7548e-03 -6.0000e+00 6.4464e-03 4.9386e-03 3.1161e-04 1.6438e-05 3.4117e-05 -6.0000e+00 4.8793e-04 1.5169e-02 0.0000e+00 11 1 0 11 4 0 99.40 22.69 0.20 0.01517 0.01751 256 48 1 5 0 196.920 26.00 20.00 22.69 15.78 35.8 1075.72 -7026 -2930 -9436 -6222 -4184 -4051 -213 -3225 -3291 -5200 -1175 -3030 -1600 569 -949 -1102 2868 1293 556 371 178 1401 -341 110 -479 414 -1149 -661 644 673 1882 1120 -1206 -1226 590 -464 60 200 -512 -1234 -1151 -1176 -1122 -548 -214 -779 -449 -345 556 727 639 757 1217 869 801 1041 376 687 962 1360 1527 1196 177 -538 -214 271 428 1326 881 223 -284 -527 -450 -529 -162 412 710 1143 140 -158 -809 -1569 -1219 -1220 -1096 -876 -587 -517 -542 -37 351 534 1380 1396 1191 841 708 -286 -635 -437 -519 36 727 -71 -758 -358 -729 -91 -84 -100 -315 -244 -145 -80 592 833 864 685 -173 -626 -423 -202 -344 79 150 447 1379 995 397 559 85 270 97 212 -223 -122 159 -411 -541 -246 -257 -187 120 -497 -211 -715 -425 -264 -261 -15 -259 -286 -479 -109 -318 -194 74 -143 -182 486 235 106 74 36 282 -73 24 -109 96 -263 -144 145 147 450 300 -354 -360 166 -135 18 73 -211 -551 -558 -599 -585 -287 -112 -409 -233 -178 288 392 351 450 731 551 528 704 259 467 641 905 1060 860 133 -433 -171 205 323 1008 702 191 -253 -485 -408 -476 -134 321 534 848 108 -132 -740 -1533 -1273 -1297 -1194 -1013 -686 -617 -642 -43 397 554 1389 1405 1241 944 859 -372 -847 -577 -665 43 864 -84 -959 -462 -958 -125 -119 -148 -481 -380 -221 -119 838 1153 1190 949 -256 -947 -649 -304 -503 114 214 608 1849 1352 561 828 130 417 154 343 -373 -208 278 -735 -972 -432 -444 -318 199 SS 20240211T195735.8Z 8807.831664 312 1 51.50 2 67.14 224.83 50.32 201.19 0.00 1 0.00 1 0 25 1.132e-01 1.032e-02 1.617e-02 2.113e-03 3.974885e-01 1.088728e-03 4.701087e-03 -6.000000e+00 6.646038e-02 224.76 -2.00 3.51 -2.00 318.33 0.00e+00 -3.115878e-04 2.100795e-04 1.322824e-04 -6.000000e+00 2.890716e-03 275.26 -2.00 20.00 -2.00 317.75 0.00e+00 2.554 0.000 302.00 328.00 3 4.2123e+00 2.9129e-03 3.2441e-02 -6.0000e+00 1.6425e-01 5.0341e-02 3.3098e-03 2.0112e-02 -6.0000e+00 1.7863e-01 -2.4974e-02 2.2419e-03 1.0063e-02 -6.0000e+00 1.0620e-01 8.2353e-03 1.1675e-03 2.8956e-03 -6.0000e+00 4.4884e-02 3.6895e-04 2.1760e-04 6.4666e-05 3.4960e-05 -6.0000e+00 3.3971e-03 1.4946e-02 0.0000e+00 12 9 8 11 36 0 99.97 22.69 0.22 0.01495 0.01658 22 4 1 5 0 2340.510 26.00 20.00 22.69 15.69 35.8 1075.40 -31928 106704 -34650 7531 15399 -3364 32103 4977 -16933 -16764 -10555 -15966 -13739 16896 1026 -12916 1102 -6758 10919 11496 2601 2326 -9321 878 -4164 3133 -3934 -2454 -5271 1613 2884 -2381 -2764 -1157 12422 -4827 -2643 1820 4550 -3526 1435 -3851 -195 -1992 3394 -3493 2822 1418 1314 -287 -942 -1116 3628 3533 366 3239 795 2575 683 1106 2972 590 1633 223 -1295 346 -585 656 589 -534 -127 325 -1311 1164 -584 820 1588 3176 -1696 392 298 -1466 -1067 -1426 -989 -2441 -915 -1182 -176 -630 -124 74 759 843 747 200 130 -532 -373 -284 -818 19 1188 350 -623 -399 -883 -117 425 354 -665 124 -92 -555 544 864 1473 378 -45 -1047 -279 549 723 174 -44 285 1021 579 174 755 570 585 278 273 -398 203 127 -415 -763 -544 -360 -157 -182 -1983 1950 -2318 320 577 -154 1171 262 -1180 -1214 -755 -1330 -1306 1410 113 -1758 140 -973 1399 1508 375 342 -1594 146 -768 552 -724 -429 -928 278 538 -515 -637 -265 2458 -1143 -681 528 1494 -1383 581 -1688 -85 -886 1452 -1576 1206 612 577 -132 -462 -585 1934 1971 215 1916 483 1534 408 659 1804 388 1138 164 -962 245 -405 457 438 -434 -109 283 -1145 968 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