File name: Pandora55s1_QueensNY_20240724_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T142455.6Z 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_20240724_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: 20240724 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 20240724T160731.8Z 8971.671896 399 1 50.58 2 24.06 147.15 120.21 287.07 0.00 1 0.00 1 0 17 1.361e-02 7.546e-03 2.750e-03 1.741e-03 1.629481e-01 9.309471e-04 1.944702e-03 -6.000000e+00 8.215225e-03 232.54 -2.00 3.51 -2.00 315.27 0.00e+00 -4.091303e-05 8.572147e-05 2.477769e-05 -6.000000e+00 3.679026e-04 289.82 -2.00 20.00 -2.00 314.54 0.00e+00 1.095 0.000 302.00 328.00 3 5.5850e+00 2.4148e-03 1.3932e-02 -6.0000e+00 2.0580e-02 1.4193e-02 2.6738e-03 8.4573e-03 -6.0000e+00 2.2190e-02 8.7202e-03 1.5247e-03 4.0960e-03 -6.0000e+00 1.3237e-02 -4.0775e-03 6.6637e-04 1.1173e-03 -6.0000e+00 5.5507e-03 5.6660e-04 -2.8212e-04 5.3479e-05 1.5813e-05 -6.0000e+00 4.0655e-04 2.6134e-03 0.0000e+00 11 8 0 10 0 0 99.99 22.63 0.34 0.00261 0.00049 49 9 1 5 0 1031.800 26.21 19.99 22.63 33.94 38.1 1100.00 -1292 -3894 2994 -6615 -2935 1726 728 5653 1055 -120 -2456 -311 -1671 -362 2991 -1213 -1721 3510 3343 1714 -931 763 1679 -1178 -385 -148 2832 -1350 -500 -301 371 2597 634 -1654 -1908 2638 -1002 -535 761 -205 -1634 -336 -1855 -973 -948 82 -1609 -236 -603 530 201 63 -122 1675 1597 430 1338 907 1011 929 1246 1552 963 -173 -6 -980 455 -402 674 577 106 189 409 -598 439 -629 155 1003 353 -451 -1074 -289 -2063 -914 -1539 -747 -797 -113 -430 -209 -188 -427 272 1028 734 659 208 533 -137 -376 -256 -657 -294 972 31 -644 -165 -496 267 694 371 -278 85 -318 -227 42 553 712 378 -91 -700 41 420 680 134 286 -79 728 148 -352 426 291 267 272 348 -340 84 305 -68 -602 -188 -285 -370 -271 -372 -1233 914 -2114 -839 444 189 1515 322 -39 -814 -101 -570 -133 1165 -522 -772 1536 1494 793 -448 364 797 -583 -196 -78 1460 -699 -244 -140 170 1205 312 -853 -972 1250 -496 -288 461 -141 -1226 -262 -1497 -791 -768 66 -1290 -183 -458 392 150 49 -98 1370 1337 369 1158 792 876 802 1079 1377 899 -170 -6 -963 417 -351 580 521 103 194 427 -628 446 -614 140 845 289 -382 -981 -281 -2144 -981 -1719 -867 -965 -141 -549 -265 -233 -505 300 1066 744 687 230 625 -171 -483 -325 -804 -343 1104 36 -792 -210 -651 358 954 525 -404 123 -452 -307 54 678 868 473 -119 -958 58 584 932 180 371 -100 882 179 -438 548 385 357 367 479 -484 124 456 -103 -925 -286 -426 -544 -393 SS 20240724T162144.2Z 8971.681762 406 1 15.06 2 22.76 154.91 122.61 289.86 0.00 1 0.00 1 0 17 9.059e-03 6.859e-03 2.384e-03 1.755e-03 1.586420e-01 9.475262e-04 1.923874e-03 -6.000000e+00 5.470056e-03 232.54 -2.00 3.51 -2.00 314.53 0.00e+00 5.628887e-05 7.588195e-05 1.634184e-05 -6.000000e+00 2.449514e-04 289.82 -2.00 20.00 -2.00 313.88 0.00e+00 1.084 0.000 302.00 328.00 3 4.5729e+00 2.4404e-03 1.3732e-02 -6.0000e+00 1.3703e-02 1.5286e-02 2.6911e-03 8.2829e-03 -6.0000e+00 1.4775e-02 2.6135e-03 1.5390e-03 4.0220e-03 -6.0000e+00 8.8139e-03 -2.2287e-03 6.5898e-04 1.1008e-03 -6.0000e+00 3.6961e-03 1.5943e-03 -2.3821e-04 5.3650e-05 1.6632e-05 -6.0000e+00 2.7068e-04 2.1439e-03 0.0000e+00 12 9 1 12 1 1 99.92 22.56 0.31 0.00214 0.00035 10 7 1 5 0 1368.340 26.21 20.02 22.56 34.20 38.3 1100.00 -1382 -2099 -308 -4177 -1311 503 1270 2659 1372 -429 -553 -82 -379 469 1270 -282 -1455 1523 1410 1379 -464 1426 1361 -74 418 48 678 -758 -38 446 1020 1490 1519 -1301 -1209 990 -313 -136 85 -73 -1477 -701 -1512 -1226 -849 -563 -1607 -933 -509 291 506 246 524 1156 1124 497 1402 216 674 957 1137 1486 1145 -122 -722 -327 46 12 1634 856 207 -157 -233 -166 -164 -172 223 354 838 57 -433 -552 -1242 -1100 -1196 -1212 -803 -616 -490 -475 -23 54 118 1365 1089 963 389 773 -264 -398 -505 -705 -166 635 -26 -449 -495 -662 -96 266 308 -341 20 -248 -360 556 573 762 615 15 -442 -230 -46 9 189 278 523 1330 996 200 439 166 340 179 175 -289 -408 286 -305 -719 -175 -199 -293 -220 -518 -842 -124 -1677 -482 172 432 954 535 -176 -229 -34 -161 211 612 -145 -775 809 759 758 -261 797 761 -42 246 29 410 -451 -22 243 547 816 867 -770 -706 554 -179 -83 58 -54 -1190 -585 -1292 -1056 -729 -481 -1367 -777 -413 232 403 201 442 998 991 445 1263 196 610 859 1026 1367 1097 -121 -735 -326 43 11 1452 798 206 -163 -246 -175 -169 -171 208 312 718 50 -406 -547 -1296 -1185 -1327 -1396 -958 -756 -610 -590 -28 63 130 1422 1113 1010 428 895 -322 -497 -627 -848 -192 717 -30 -540 -616 -845 -125 353 420 -475 28 -338 -470 692 689 910 751 19 -584 -309 -62 13 246 351 640 1582 1181 242 549 212 440 234 233 -396 -575 408 -442 -1051 -253 -284 -411 -307 SS 20240724T165958.6Z 8971.708318 430 1 2.47 2 21.09 178.76 128.81 298.03 0.00 1 0.00 1 0 17 8.328e-03 6.824e-03 1.738e-03 1.328e-03 1.558818e-01 7.186935e-04 1.899130e-03 -6.000000e+00 5.029093e-03 232.54 -2.00 3.51 -2.00 314.32 0.00e+00 1.123315e-04 5.545885e-05 3.017096e-05 -6.000000e+00 2.252061e-04 289.82 -2.00 20.00 -2.00 313.69 0.00e+00 1.072 0.000 302.00 328.00 3 2.3183e+00 1.8466e-03 1.3548e-02 -6.0000e+00 1.2599e-02 5.8180e-03 2.0341e-03 8.1520e-03 -6.0000e+00 1.3583e-02 1.5368e-03 1.1657e-03 3.9622e-03 -6.0000e+00 8.1034e-03 -2.7660e-03 4.9658e-04 1.0934e-03 -6.0000e+00 3.3982e-03 1.5541e-02 -2.9536e-04 4.0534e-05 1.6903e-05 -6.0000e+00 2.4886e-04 2.1373e-03 0.0000e+00 12 9 1 12 1 1 98.62 22.69 0.24 0.00214 -0.00008 15 62 1 5 0 153.680 26.21 20.01 22.69 35.81 38.1 1100.00 -712 -1565 -2374 -2646 -1420 945 745 1735 849 -168 -122 1478 789 1230 639 -325 -379 -189 783 493 2 807 1052 347 548 74 -921 -655 186 1098 1216 1861 1817 -660 -795 418 515 442 49 -677 -1511 -1248 -1157 -1138 -747 -1009 -1126 -795 -577 264 837 589 848 788 495 664 712 297 709 871 1557 1167 1155 503 -922 -326 -127 292 1101 844 194 -386 -517 -648 -744 -392 -8 715 1347 100 160 -704 -1535 -1050 -902 -942 -626 -378 -579 -544 -11 231 287 1087 1516 1114 768 791 -358 -559 -347 -460 137 917 100 -789 -367 -729 -314 -198 -119 -372 -360 -125 -38 460 780 715 920 54 -381 -314 -331 -262 231 369 632 1402 1025 388 540 33 -45 69 96 -259 -270 154 -361 -511 -214 -273 -176 -100 -296 -670 -1047 -1119 -572 342 270 675 369 -73 -53 631 354 603 330 -174 -212 -107 451 292 1 463 601 204 336 48 -568 -406 112 619 673 1062 1095 -400 -471 246 308 280 33 -517 -1247 -1051 -1004 -1002 -655 -881 -967 -658 -478 211 667 490 712 692 450 591 642 271 638 775 1386 1084 1102 494 -943 -320 -123 270 994 787 194 -402 -539 -673 -771 -390 -7 623 1158 90 147 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