File name: Pandora55s1_QueensNY_20220515_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T121318.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220515_L1_smca1c19d20211111p1-8.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: 20220515 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 20220515T140109.4Z 8170.584137 341 1 29.06 2 42.34 107.99 142.12 299.15 0.00 1 0.00 1 0 17 1.105e-02 7.098e-03 2.564e-03 1.599e-03 2.045105e-01 8.509746e-04 2.464296e-03 -6.000000e+00 6.629427e-03 231.11 -2.00 3.51 -2.00 315.32 0.00e+00 -6.039928e-05 7.792028e-05 3.880255e-05 -6.000000e+00 2.910496e-04 283.65 -2.00 20.00 -2.00 314.68 0.00e+00 1.351 0.000 302.00 328.00 3 4.5071e+00 2.2019e-03 1.7270e-02 -6.0000e+00 1.6584e-02 4.5112e-02 2.4420e-03 1.0578e-02 -6.0000e+00 1.7924e-02 -1.5331e-03 1.3935e-03 5.1559e-03 -6.0000e+00 1.0665e-02 -2.1034e-03 6.1021e-04 1.4180e-03 -6.0000e+00 4.4523e-03 1.1812e-03 -1.5723e-05 4.8861e-05 2.0224e-05 -6.0000e+00 3.2997e-04 -1.0890e-02 1.8239e-04 12 9 1 12 33 1 99.97 23.26 0.14 -0.01089 -0.01101 14 5 1 5 0 1925.300 26.00 19.99 23.26 27.68 32.5 1100.00 -666 -1929 1587 -7272 -631 940 -1359 2372 146 -1407 128 -78 -436 519 1638 -784 -2027 82 1868 2108 993 -99 1700 -947 803 -267 1562 -1153 601 428 1059 1955 1377 -2115 -1079 2140 -451 118 1111 -108 -1806 -761 -1508 -1505 -1009 -441 -1424 -499 -202 323 854 356 689 1096 1139 815 1429 657 759 791 1091 1583 1056 170 -589 -752 -325 13 1591 356 -228 -580 -93 -623 -247 -289 265 896 769 83 -253 -509 -1408 -1148 -1400 -881 -728 -328 -432 -139 -458 -65 120 1136 1105 705 824 483 -647 -465 -371 -340 98 1077 216 -491 -312 -696 -16 273 149 -617 -33 -272 -105 618 732 858 459 -67 -588 -574 140 154 383 56 437 1240 706 156 473 238 59 404 357 -447 -105 286 -377 -577 -401 -459 -206 48 -181 -567 464 -2210 -170 236 -350 639 43 -444 40 -25 -145 186 635 -330 -895 36 834 963 464 -47 796 -462 401 -138 803 -588 290 199 491 935 694 -1116 -559 1056 -231 65 680 -74 -1343 -585 -1191 -1200 -803 -348 -1122 -385 -152 240 638 276 552 901 961 698 1238 573 659 681 944 1398 975 164 -582 -730 -300 11 1390 328 -224 -596 -97 -649 -251 -281 241 771 650 73 -236 -505 -1476 -1243 -1565 -1019 -874 -404 -541 -173 -558 -76 132 1188 1140 751 924 573 -809 -596 -471 -417 115 1235 255 -602 -396 -906 -21 372 209 -886 -48 -382 -142 794 910 1062 582 -89 -806 -799 193 210 510 73 550 1513 863 197 616 318 80 551 496 -643 -154 429 -572 -882 -607 -684 -300 69 SS 20220515T141003.8Z 8170.590321 347 1 49.50 2 40.74 110.07 143.52 301.57 0.00 1 0.00 1 0 25 8.928e-03 6.402e-03 1.451e-03 8.962e-04 1.972282e-01 4.765017e-04 2.377907e-03 -6.000000e+00 5.358922e-03 231.11 -2.00 3.51 -2.00 315.36 0.00e+00 2.785931e-05 4.397223e-05 3.219877e-05 -6.000000e+00 2.352528e-04 283.65 -2.00 20.00 -2.00 314.71 0.00e+00 1.318 0.000 302.00 328.00 3 3.9749e+00 1.2337e-03 1.6777e-02 -6.0000e+00 1.3405e-02 3.5104e-02 1.3683e-03 1.0212e-02 -6.0000e+00 1.4489e-02 2.7836e-04 7.8081e-04 4.9767e-03 -6.0000e+00 8.6207e-03 -2.1833e-03 3.4232e-04 1.3706e-03 -6.0000e+00 3.5994e-03 2.1136e-03 5.3243e-05 2.7447e-05 1.9477e-05 -6.0000e+00 2.6670e-04 -1.1243e-02 1.9413e-04 11 8 0 10 0 0 99.97 23.26 0.31 -0.01124 -0.01084 82 16 1 5 0 603.620 26.00 20.00 23.26 28.25 32.5 1100.00 -422 -1399 -1202 -4801 -1216 999 329 2661 1594 -880 -841 1042 115 454 1148 -418 -757 -775 1073 1207 564 555 1207 156 374 14 6 -817 148 818 1194 1616 1048 -1491 -872 1227 30 66 760 -327 -1398 -904 -1578 -1215 -933 -447 -1186 -961 -502 419 495 347 479 1055 705 555 1067 414 783 867 1388 1528 1161 153 -582 -209 -143 195 1383 798 -65 -260 -392 -456 -479 -135 261 992 1186 104 -136 -572 -1519 -815 -957 -1054 -678 -443 -569 -528 -187 57 275 1040 1215 998 736 672 -720 -391 -449 -440 78 935 103 -591 -295 -707 -112 81 -48 -434 -241 -130 -91 444 727 943 557 -65 -571 -264 -226 -71 206 277 530 1300 922 218 519 -92 111 201 222 -259 63 130 -303 -454 -216 -328 -327 -90 -113 -407 -356 -1423 -325 247 83 706 463 -273 -264 322 37 161 441 -174 -327 -342 478 549 262 259 563 75 186 7 3 -412 71 375 545 764 521 -774 -445 600 15 36 462 -223 -1030 -694 -1243 -965 -740 -353 -929 -740 -378 309 369 267 382 865 593 474 921 361 677 744 1193 1345 1071 148 -575 -202 -131 171 1202 731 -64 -266 -410 -475 -487 -131 237 847 991 90 -126 -566 -1589 -880 -1067 -1223 -816 -549 -714 -661 -228 66 302 1085 1250 1058 822 795 -901 -502 -571 -540 91 1072 121 -726 -375 -923 -150 111 -67 -626 -348 -183 -123 571 904 1165 706 -85 -784 -368 -314 -97 276 361 667 1587 1127 274 676 -123 151 275 309 -373 93 196 -461 -696 -327 -490 -480 -131 SS 20220515T141507.3Z 8170.593834 350 1 22.19 2 39.84 111.29 144.31 303.01 0.00 1 0.00 1 0 17 1.889e-02 9.966e-03 5.609e-03 3.299e-03 2.018853e-01 1.751119e-03 2.401958e-03 -6.000000e+00 1.134143e-02 231.11 -2.00 3.51 -2.00 315.53 0.00e+00 1.824506e-04 1.676584e-04 6.049031e-05 -6.000000e+00 4.977628e-04 283.65 -2.00 20.00 -2.00 314.87 0.00e+00 1.301 0.000 302.00 328.00 3 5.5011e+00 4.5417e-03 1.6761e-02 -6.0000e+00 2.8371e-02 6.0692e-02 5.0440e-03 1.0378e-02 -6.0000e+00 3.0661e-02 -4.0852e-03 2.8780e-03 5.0512e-03 -6.0000e+00 1.8244e-02 -1.3981e-03 1.2689e-03 1.4083e-03 -6.0000e+00 7.6187e-03 4.5818e-04 3.8064e-04 1.0106e-04 1.9384e-05 -6.0000e+00 5.6420e-04 -1.0952e-02 2.6629e-04 12 9 9 12 33 1 99.96 23.26 0.35 -0.01095 -0.00809 5 3 1 5 0 3668.270 26.00 20.00 23.26 28.77 32.4 1100.00 -1977 1655 -5755 -9457 -131 5533 -1130 7926 822 486 -3909 -461 -2733 968 -346 -1567 -2319 -1054 6450 2560 3367 226 850 682 338 -572 4127 -1341 -1547 619 -142 1480 1847 -3063 -1274 5548 -940 -2299 1568 345 -1786 997 -2292 -2476 -2187 637 -1851 876 612 632 -348 -42 -858 2104 1629 1013 2034 1900 1362 60 247 1936 692 -1152 750 -1656 120 -958 1858 50 -963 -928 660 -991 152 -696 395 1911 697 286 -1465 849 -876 -687 -559 -1180 -392 -589 -565 235 -201 -784 1124 357 787 446 24 636 -1587 -595 -375 -66 -269 849 96 -415 -429 -377 -54 1323 610 -914 405 -720 -98 -224 656 469 544 -594 -1047 429 384 773 302 310 -126 592 715 -39 324 570 -110 969 630 -204 602 21 165 -944 -227 -676 -420 -580 -498 437 -1652 -2708 -32 1214 -265 1854 223 139 -1167 -134 -853 321 -127 -625 -967 -446 2629 1101 1464 102 380 313 161 -283 1977 -651 -717 271 -63 670 877 -1550 -630 2517 -457 -1228 921 229 -1301 746 -1790 -1960 -1727 492 -1441 655 449 459 -257 -32 -682 1695 1350 857 1732 1625 1165 51 212 1689 637 -1118 732 -1611 109 -843 1594 46 -947 -956 686 -1036 154 -675 355 1604 577 245 -1362 830 -914 -741 -623 -1376 -474 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