File name: Pandora55s1_QueensNY_20220513_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T121222.2Z 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_20220513_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: 20220513 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 20220513T144552.5Z 8168.615191 346 1 50.35 2 34.92 120.19 144.29 1.60 0.00 1 0.00 1 0 17 1.675e-02 8.889e-03 3.311e-03 1.958e-03 1.978046e-01 1.038674e-03 2.357733e-03 -6.000000e+00 1.004656e-02 230.95 -2.00 3.51 -2.00 315.52 0.00e+00 2.445293e-04 9.922129e-05 5.524946e-05 -6.000000e+00 4.409237e-04 283.44 -2.00 20.00 -2.00 314.87 0.00e+00 1.219 0.000 302.00 328.00 3 5.5359e+00 2.6928e-03 1.6003e-02 -6.0000e+00 2.5123e-02 5.2087e-02 2.9911e-03 1.0169e-02 -6.0000e+00 2.7159e-02 -2.0068e-03 1.7072e-03 4.9536e-03 -6.0000e+00 1.6160e-02 -1.8094e-03 7.5199e-04 1.3876e-03 -6.0000e+00 6.7458e-03 4.8409e-04 3.3648e-04 6.0075e-05 1.9044e-05 -6.0000e+00 5.0028e-04 -6.0527e-03 3.5668e-04 11 9 0 11 32 0 99.95 17.73 0.17 -0.00605 -0.00352 18 3 1 5 0 2796.430 26.00 20.01 17.73 25.41 32.2 1100.00 -1812 442 -3451 -10045 405 2356 -3057 5097 2104 -1202 -2192 -772 -3785 -315 4297 -897 -2515 2712 1463 2528 3776 442 2090 -2324 1426 -1314 3790 -1259 -568 -1077 874 2185 367 -2348 -1582 4427 -1625 -1353 1916 -1619 -2185 -39 -98 -1575 -1248 -1020 -1652 895 480 720 -448 1 -390 1894 2007 871 2501 971 1233 841 861 2530 1415 -228 585 -1058 -362 -489 857 -160 272 -367 331 -755 -520 -377 306 1162 -40 -748 -771 -866 -1337 -629 -1909 -1348 -952 -251 -577 130 -445 -523 237 667 735 379 -272 407 -375 -184 -359 -224 -20 1311 289 -299 -264 -328 272 738 713 -754 152 -11 -468 -32 292 903 -79 -147 -399 -332 384 672 212 489 41 1201 272 -109 303 714 71 618 430 -51 247 275 -108 -418 -458 -650 -574 -602 -460 119 -978 -2912 99 533 -732 1229 569 -349 -647 -226 -1196 -106 1527 -357 -1055 1117 621 1091 1639 199 927 -1093 675 -654 1825 -611 -261 -478 381 983 176 -1182 -780 2022 -792 -717 1122 -1090 -1598 -29 -76 -1243 -982 -800 -1283 670 353 523 -330 1 -309 1529 1660 737 2126 836 1054 714 737 2203 1297 -221 573 -1027 -331 -427 740 -146 266 -377 345 -787 -527 -364 274 976 -33 -644 -712 -856 -1395 -679 -2147 -1576 -1156 -314 -732 163 -547 -614 261 694 754 402 -306 485 -474 -238 -459 -275 -23 1498 341 -369 -338 -430 366 1015 1012 -1101 222 -16 -639 -41 364 1119 -100 -195 -552 -466 536 921 284 636 52 1463 333 -137 395 953 97 846 602 -74 367 417 -166 -646 -701 -981 -848 -882 SS 20220513T150534.9Z 8168.628876 355 1 49.34 2 31.80 126.52 144.03 9.60 0.00 1 0.00 1 0 17 8.539e-03 6.494e-03 9.619e-04 6.440e-04 1.862226e-01 3.435883e-04 2.256730e-03 -6.000000e+00 5.120253e-03 230.95 -2.00 3.51 -2.00 315.02 0.00e+00 4.660087e-05 2.959812e-05 3.485645e-05 -6.000000e+00 2.247839e-04 283.44 -2.00 20.00 -2.00 314.40 0.00e+00 1.176 0.000 302.00 328.00 3 3.5093e+00 8.8630e-04 1.5317e-02 -6.0000e+00 1.2804e-02 3.2845e-02 9.8165e-04 9.6338e-03 -6.0000e+00 1.3843e-02 -2.0639e-03 5.6014e-04 4.7055e-03 -6.0000e+00 8.2363e-03 -1.4843e-03 2.4248e-04 1.2997e-03 -6.0000e+00 3.4377e-03 3.9605e-03 -1.8416e-05 1.9723e-05 1.8998e-05 -6.0000e+00 2.5509e-04 -9.1191e-03 1.6973e-04 11 9 0 11 4 0 99.98 17.42 0.16 -0.00912 -0.00926 136 26 1 5 0 362.660 26.00 19.99 17.42 25.87 32.2 1100.00 -995 -1281 -1999 -3855 -1460 148 736 1873 835 -826 -510 853 1109 727 1010 -556 -568 -1039 1088 863 383 927 1332 503 524 -130 -356 -543 178 1234 1309 1833 1374 -1330 -444 764 357 565 574 -486 -1327 -943 -1259 -1256 -1088 -602 -1225 -689 -647 474 628 543 656 794 630 592 943 295 670 857 1355 1321 1089 313 -720 -287 -135 236 1377 756 68 -460 -615 -501 -626 -33 222 717 1136 129 -113 -617 -1424 -1075 -1040 -852 -708 -534 -526 -580 -134 192 381 1060 1308 1147 725 603 -384 -517 -339 -442 88 811 129 -704 -303 -698 -114 -75 -100 -441 -220 -159 -71 581 779 814 636 -50 -557 -297 -104 -117 258 304 538 1458 897 366 519 -9 224 100 200 -312 -157 93 -344 -448 -207 -368 -270 -99 -309 -428 -681 -1288 -448 42 211 570 278 -291 -179 297 403 286 430 -254 -269 -503 527 428 194 469 672 261 281 -72 -198 -293 91 607 642 927 727 -733 -240 398 190 324 367 -346 -1018 -751 -1026 -1035 -895 -493 -994 -547 -502 361 482 429 537 668 543 517 834 262 592 751 1190 1190 1024 307 -722 -281 -125 210 1214 701 67 -475 -647 -524 -641 -32 204 620 960 113 -106 -613 -1492 -1161 -1160 -986 -851 -659 -660 -722 -162 223 418 1106 1341 1211 807 711 -476 -657 -426 -536 103 926 152 -860 -382 -903 -151 -102 -139 -628 -313 -220 -95 736 954 995 794 -65 -753 -408 -142 -158 340 390 669 1758 1081 454 665 -12 298 134 274 -440 -228 137 -513 -672 -308 -539 -388 -141 SS 20220513T153418.4Z 8168.648824 374 1 46.25 2 27.75 137.58 142.78 20.89 0.00 1 0.00 1 0 25 8.515e-03 6.697e-03 4.713e-04 3.296e-04 1.767582e-01 1.763323e-04 2.151210e-03 -6.000000e+00 5.105500e-03 230.95 -2.00 3.51 -2.00 314.80 0.00e+00 3.698286e-05 1.458096e-05 3.061080e-05 -6.000000e+00 2.241439e-04 283.44 -2.00 20.00 -2.00 314.20 0.00e+00 1.130 0.000 302.00 328.00 3 2.1981e+00 4.5410e-04 1.4650e-02 -6.0000e+00 1.2767e-02 2.4494e-02 5.0244e-04 9.1641e-03 -6.0000e+00 1.3803e-02 -2.0604e-03 2.8674e-04 4.4781e-03 -6.0000e+00 8.2127e-03 -1.4632e-03 1.2321e-04 1.2369e-03 -6.0000e+00 3.4277e-03 1.5748e-02 -5.4233e-05 1.0089e-05 1.8599e-05 -6.0000e+00 2.5437e-04 -8.6444e-03 1.7736e-04 11 9 0 11 12 0 99.98 16.92 0.22 -0.00864 -0.00905 497 94 1 5 0 93.040 26.00 20.00 16.92 26.80 32.5 1100.00 -851 -1529 -2736 -3131 -1215 220 1168 1539 1109 -548 -32 1126 972 805 529 -389 -385 -47 481 525 121 1080 1256 870 582 6 -608 -805 211 1451 1476 1730 1388 -998 -707 443 494 648 599 -695 -1388 -1078 -1303 -1199 -990 -860 -1237 -918 -721 467 677 538 830 678 601 485 761 311 684 858 1512 1235 1101 334 -776 -267 -117 496 1373 832 23 -378 -648 -422 -623 -194 192 628 1317 343 25 -733 -1468 -1136 -1023 -990 -698 -465 -474 -643 -186 154 309 1244 1397 1200 818 608 -393 -490 -345 -430 201 896 33 -727 -300 -724 -132 -97 -166 -388 -279 -159 -75 552 800 814 676 -57 -554 -324 -198 -180 329 276 670 1367 893 379 411 -35 177 123 185 -331 -192 118 -413 -391 -214 -215 -252 -95 -297 -545 -1007 -1103 -408 68 357 512 410 -203 -12 410 373 342 236 -190 -196 -24 240 268 63 561 652 466 327 4 -359 -457 111 756 762 932 748 -568 -392 247 265 389 401 -521 -1108 -870 -1087 -1012 -834 -719 -1020 -730 -580 362 529 441 682 583 535 420 669 276 598 776 1370 1117 1065 330 -796 -263 -110 452 1230 771 23 -385 -683 -440 -651 -187 173 539 1135 298 23 -718 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