File name: Pandora55s1_QueensNY_20240502_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T134514.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c18p1-8 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_v18d20230426.txt Level 1 file used: Pandora55s1_QueensNY_20240502_L1_smca1c18d20230426p1-8.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: 20240502 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: Based on session 17 for new VP from 20230426 First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0111 305.1511 305.2911 305.4311 305.5710 305.7110 305.8510 305.9909 306.1308 306.2708 306.4107 306.5506 306.6905 306.8303 306.9702 307.1101 307.2499 307.3897 307.5296 307.6694 307.8092 307.9490 308.0888 308.2286 308.3683 308.5081 308.6478 308.7876 308.9273 309.0670 309.2067 309.3464 309.4861 309.6257 309.7654 309.9050 310.0447 310.1843 310.3239 310.4635 310.6031 310.7427 310.8823 311.0219 311.1614 311.3010 311.4405 311.5800 311.7195 311.8590 311.9985 312.1380 312.2775 312.4169 312.5564 312.6958 312.8352 312.9747 313.1141 313.2535 313.3929 313.5322 313.6716 313.8110 313.9503 314.0896 314.2290 314.3683 314.5076 314.6469 314.7861 314.9254 315.0647 315.2039 315.3432 315.4824 315.6216 315.7608 315.9000 316.0392 316.1784 316.3175 316.4567 316.5958 316.7350 316.8741 317.0132 317.1523 317.2914 317.4305 317.5695 317.7086 317.8476 317.9867 318.1257 318.2647 318.4037 318.5427 318.6817 318.8207 318.9596 319.0986 319.2375 319.3765 319.5154 319.6543 319.7932 319.9321 320.0710 320.2098 320.3487 320.4875 320.6264 320.7652 320.9040 321.0428 321.1816 321.3204 321.4592 321.5979 321.7367 321.8754 322.0141 322.1529 322.2916 322.4303 322.5689 322.7076 322.8463 322.9849 323.1236 323.2622 323.4008 323.5394 323.6780 323.8166 323.9552 324.0938 324.2323 324.3709 324.5094 324.6479 324.7864 324.9249 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20240502T152401.1Z 8888.641679 310 1 50.91 2 31.54 136.27 72.16 227.74 0.00 1 0.00 1 0 17 8.222e-03 6.429e-03 2.875e-04 1.971e-04 1.798289e-01 1.048903e-04 2.198407e-03 -6.000000e+00 4.922305e-03 230.11 -2.00 3.51 -2.00 314.92 0.00e+00 7.701799e-05 8.867979e-06 3.356197e-05 -6.000000e+00 2.155044e-04 282.34 -2.00 20.00 -2.00 314.33 0.00e+00 1.173 0.000 302.00 328.00 3 1.4120e+00 2.6990e-04 1.5061e-02 -6.0000e+00 1.2289e-02 2.2782e-03 2.9864e-04 9.3062e-03 -6.0000e+00 1.3289e-02 2.0330e-04 1.7077e-04 4.5606e-03 -6.0000e+00 7.9078e-03 -1.6508e-03 7.4001e-05 1.2690e-03 -6.0000e+00 3.3091e-03 3.3155e-02 -2.1052e-04 6.0147e-06 1.8422e-05 -6.0000e+00 2.4542e-04 -1.5067e-03 0.0000e+00 11 8 0 10 0 0 99.98 22.82 0.21 -0.00151 -0.00309 1279 242 1 5 0 39.440 26.11 20.01 22.82 24.65 37.1 1100.00 -666 -1588 -2564 -3108 -1465 11 1047 1385 1131 -396 -99 982 999 762 593 -272 -380 100 432 582 24 952 1330 834 574 142 -738 -756 249 1360 1344 1591 1509 -935 -565 202 247 521 498 -618 -1318 -1084 -1279 -1178 -984 -817 -1102 -904 -719 322 689 580 834 656 614 544 763 309 616 786 1342 1202 1123 463 -728 -205 -109 341 1242 852 168 -233 -633 -482 -739 -173 177 476 1299 349 123 -675 -1406 -1176 -972 -1025 -683 -493 -426 -607 -198 197 218 1142 1353 1205 828 737 -297 -478 -293 -455 15 778 75 -679 -265 -711 -146 -93 -134 -309 -293 -134 -68 447 704 765 668 -18 -490 -317 -221 -245 243 250 523 1361 951 368 475 -55 219 114 226 -319 -208 125 -412 -417 -214 -222 -303 -20 -223 -547 -916 -1073 -485 3 311 446 405 -143 -36 350 374 316 257 -130 -179 48 213 294 12 492 684 442 319 78 -411 -429 131 669 694 805 810 -534 -316 107 133 295 314 -437 -1003 -880 -1027 -960 -801 -660 -880 -731 -561 242 521 458 695 548 531 480 684 280 553 696 1188 1060 1058 448 -735 -200 -102 308 1094 772 163 -244 -661 -500 -770 -167 167 408 1106 312 116 -681 -1490 -1267 -1058 -1192 -814 -596 -528 -750 -243 232 242 1201 1375 1277 920 865 -369 -601 -362 -551 18 902 87 -818 -337 -917 -195 -125 -184 -438 -417 -183 -89 576 849 948 828 -23 -651 -434 -302 -327 321 326 646 1649 1145 465 611 -71 290 154 304 -453 -300 186 -609 -622 -314 -328 -433 -28 SS 20240502T153248.0Z 8888.647778 316 1 3.62 2 30.42 139.76 73.34 229.50 0.00 1 0.00 1 0 17 8.731e-03 6.773e-03 2.443e-03 1.758e-03 1.791020e-01 9.386528e-04 2.204135e-03 -6.000000e+00 5.226567e-03 230.11 -2.00 3.51 -2.00 314.66 0.00e+00 1.768378e-04 7.561531e-05 4.022437e-05 -6.000000e+00 2.288396e-04 282.34 -2.00 20.00 -2.00 314.10 0.00e+00 1.159 0.000 302.00 328.00 3 3.0833e+00 2.4094e-03 1.4949e-02 -6.0000e+00 1.3049e-02 2.1704e-02 2.6643e-03 9.2969e-03 -6.0000e+00 1.4111e-02 -1.3055e-03 1.5232e-03 4.5593e-03 -6.0000e+00 8.3970e-03 -1.5515e-03 6.5494e-04 1.2786e-03 -6.0000e+00 3.5132e-03 6.2795e-03 -3.5950e-04 5.3469e-05 1.9206e-05 -6.0000e+00 2.6063e-04 -5.2012e-04 0.0000e+00 12 9 1 12 9 1 97.77 22.81 0.18 -0.00052 -0.00322 9 26 1 5 0 360.760 26.11 19.97 22.81 25.85 36.9 1100.00 -1350 -1586 -2284 -3917 -820 -644 657 1189 1575 -662 -756 742 787 808 655 -291 -417 613 250 1467 25 965 1215 770 954 581 -53 -900 631 959 1992 1567 1474 -749 -667 356 129 800 123 -646 -1187 -1112 -1349 -1128 -1161 -971 -1465 -925 -908 622 954 421 884 776 588 354 1023 248 636 425 1206 1314 1021 623 -639 72 -131 154 1186 898 -10 -499 -667 -586 -662 -220 345 347 1373 -54 -111 -761 -1400 -1093 -860 -961 -700 -406 -829 -296 -307 320 -226 1540 1282 1076 742 676 -412 -333 -28 -594 236 838 33 -763 -126 -572 -51 -214 121 -151 -244 -247 -116 438 579 927 693 -235 -414 -191 -14 -491 -11 221 712 1311 1070 165 526 3 306 81 148 -322 -206 158 -354 -549 -364 -371 -254 211 -480 -601 -885 -1497 -288 -214 216 414 588 -261 -300 290 319 350 306 -145 -214 317 132 783 14 526 661 427 544 340 -31 -523 348 510 1048 848 830 -436 -385 199 73 481 82 -474 -934 -909 -1125 -950 -977 -816 -1221 -756 -728 488 751 341 736 665 515 314 916 224 571 379 1076 1196 968 613 -644 72 -124 139 1057 836 -10 -516 -704 -617 -683 -218 322 307 1180 -48 -104 -757 -1464 -1178 -953 -1103 -832 -496 -1030 -366 -372 372 -250 1610 1319 1133 819 786 -504 -418 -35 -718 273 950 38 -921 -157 -729 -66 -285 166 -210 -341 -339 -153 551 703 1119 855 -302 -550 -258 -19 -657 -15 281 880 1571 1279 202 665 3 401 107 199 -446 -293 229 -518 -809 -532 -536 -359 295 SS 20240502T153643.1Z 8888.650499 319 1 6.77 2 29.95 141.39 73.88 230.27 0.00 1 0.00 1 0 17 8.246e-03 6.635e-03 4.772e-04 3.446e-04 1.774338e-01 1.839570e-04 2.179008e-03 -6.000000e+00 4.936695e-03 230.11 -2.00 3.51 -2.00 314.66 0.00e+00 1.160885e-04 1.484972e-05 3.688905e-05 -6.000000e+00 2.161417e-04 282.35 -2.00 20.00 -2.00 314.10 0.00e+00 1.154 0.000 302.00 328.00 3 5.8401e-01 4.7232e-04 1.4843e-02 -6.0000e+00 1.2325e-02 -2.2987e-03 5.2241e-04 9.1967e-03 -6.0000e+00 1.3329e-02 1.9674e-04 2.9844e-04 4.5094e-03 -6.0000e+00 7.9311e-03 -1.3662e-03 1.2819e-04 1.2588e-03 -6.0000e+00 3.3185e-03 7.7810e-02 -2.3493e-04 1.0511e-05 1.8748e-05 -6.0000e+00 2.4615e-04 -9.6330e-04 0.0000e+00 12 9 1 12 1 1 99.08 22.79 0.23 -0.00096 -0.00273 218 312 1 5 0 30.600 26.11 19.99 22.79 26.23 37.0 1100.00 -577 -1440 -2753 -2855 -1466 40 980 1256 1134 -476 5 938 1166 812 557 -372 -244 188 486 576 -13 908 1252 906 551 154 -722 -862 284 1326 1274 1558 1477 -794 -574 144 258 455 428 -697 -1386 -1108 -1214 -1186 -982 -902 -1200 -883 -738 419 681 653 874 710 514 548 776 297 626 846 1423 1173 1068 437 -716 -164 -81 320 1289 891 143 -250 -696 -467 -757 -268 237 535 1340 382 126 -693 -1391 -1190 -1058 -1088 -714 -493 -407 -611 -207 178 261 1194 1343 1240 845 760 -327 -493 -285 -408 55 766 99 -699 -240 -749 -178 -110 -173 -337 -295 -190 -118 501 751 749 640 -12 -518 -360 -199 -217 276 286 573 1380 976 463 508 -3 234 104 216 -259 -235 119 -444 -422 -254 -259 -297 -51 -208 -540 -1074 -1071 -525 14 336 437 438 -187 2 364 473 365 264 -184 -127 99 263 303 -7 489 672 500 320 89 -423 -510 156 715 678 863 825 -470 -333 79 145 270 285 -503 -1083 -887 -1006 -998 -825 -753 -990 -732 -590 323 527 528 717 611 441 481 690 267 557 743 1250 1074 1008 427 -728 -161 -76 286 1168 837 139 -254 -737 -491 -768 -269 222 471 1165 336 118 -699 -1433 -1298 -1176 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