File name: Pandora55s1_QueensNY_20210625_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T191242.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210625_L1_smca1c11d20210101p1-8.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: 20210625 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]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 20210625T133921.5Z 7846.568999 321 1 49.42 2 44.85 97.10 127.86 266.46 0.00 1 0.00 1 0 25 9.442e-03 6.765e-03 1.385e-03 7.655e-04 2.016135e-01 4.077763e-04 2.428568e-03 -6.000000e+00 5.703686e-03 232.90 -2.00 3.51 -2.00 315.80 0.00e+00 -8.878081e-05 4.151954e-05 3.983730e-05 -6.000000e+00 2.529871e-04 287.67 -2.00 20.00 -2.00 315.05 0.00e+00 1.408 0.000 302.00 328.00 3 3.5814e+00 1.0646e-03 1.7708e-02 -6.0000e+00 1.4312e-02 2.4893e-02 1.1819e-03 1.0575e-02 -6.0000e+00 1.5438e-02 4.2786e-03 6.7451e-04 5.1174e-03 -6.0000e+00 9.1943e-03 -4.2284e-03 2.9988e-04 1.3910e-03 -6.0000e+00 3.8386e-03 2.8559e-03 6.7696e-05 2.3600e-05 1.9329e-05 -6.0000e+00 2.8221e-04 6.3428e-03 1.1347e-04 11 8 0 10 0 0 99.99 22.79 0.21 0.00634 0.00685 246 47 1 5 0 200.860 25.68 20.01 22.79 28.38 29.2 1098.82 -1219 -1577 -2291 -3694 -1904 928 -182 2835 542 -545 -52 1415 1015 -898 1573 -763 -782 -858 1117 224 413 683 1350 403 726 -21 -49 -794 272 1628 1412 2205 1105 -1073 -810 1197 493 606 1047 -834 -1428 -1250 -1376 -1549 -790 -720 -1078 -781 -629 523 275 604 419 949 698 642 885 381 750 1096 1533 1299 1137 135 -707 -359 100 466 1701 912 -38 -442 -644 -520 -625 -241 223 1057 1477 600 -140 -539 -1488 -1139 -1134 -959 -741 -413 -533 -661 -57 105 340 1112 1477 1376 855 637 -347 -588 -560 -364 -11 987 14 -685 -390 -755 -152 90 -2 -466 -251 -157 -82 428 839 798 714 -97 -752 -366 -163 -75 177 277 465 1473 894 342 403 44 221 178 431 -265 -60 33 -343 -493 -267 -346 -286 51 -276 -389 -582 -918 -433 193 -39 637 136 -145 -14 375 284 -280 528 -281 -300 -338 441 91 172 286 563 174 326 -10 -23 -362 117 667 581 937 499 -507 -378 533 225 302 589 -534 -995 -914 -1030 -1173 -597 -543 -804 -571 -450 368 195 442 321 748 567 530 742 320 628 908 1274 1115 1023 127 -685 -340 90 398 1433 815 -37 -448 -666 -534 -626 -230 198 878 1198 506 -127 -526 -1547 -1226 -1260 -1113 -894 -515 -674 -833 -69 122 373 1155 1505 1451 956 759 -439 -762 -720 -449 -13 1137 17 -850 -501 -998 -207 125 -3 -686 -369 -225 -113 559 1053 1000 917 -131 -1053 -520 -231 -104 241 366 594 1823 1108 437 535 60 306 249 615 -392 -91 51 -540 -778 -418 -534 -431 76 SS 20210625T134613.4Z 7846.573767 325 1 44.07 2 43.56 98.40 129.09 267.49 0.00 1 0.00 1 0 25 8.685e-03 6.792e-03 2.291e-04 1.507e-04 1.962728e-01 8.078996e-05 2.379604e-03 -6.000000e+00 5.246339e-03 232.90 -2.00 3.51 -2.00 315.13 0.00e+00 1.243796e-05 7.158018e-06 3.789658e-05 -6.000000e+00 2.327114e-04 287.67 -2.00 20.00 -2.00 314.44 0.00e+00 1.378 0.000 302.00 328.00 3 4.4947e-01 2.0947e-04 1.7292e-02 -6.0000e+00 1.3164e-02 2.2442e-03 2.3172e-04 1.0291e-02 -6.0000e+00 1.4200e-02 -7.1621e-04 1.3201e-04 4.9882e-03 -6.0000e+00 8.4570e-03 -1.1532e-03 5.7253e-05 1.3611e-03 -6.0000e+00 3.5310e-03 6.8878e-02 -1.6518e-04 4.6142e-06 2.0017e-05 -6.0000e+00 2.5961e-04 4.3788e-03 3.6311e-05 11 8 0 10 0 0 97.41 22.79 0.23 0.00438 0.00314 1659 314 1 5 0 25.900 25.68 20.00 22.79 28.99 29.5 1100.00 -1021 -1764 -2873 -3053 -1426 153 1121 1135 811 -546 19 1186 1126 800 444 -367 -263 -367 451 605 8 1049 1304 1044 593 174 -695 -627 553 1674 1511 1758 1457 -911 -584 318 456 480 354 -863 -1460 -1161 -1318 -1195 -971 -826 -1099 -814 -694 401 670 581 871 665 582 561 755 287 626 822 1412 1169 1080 355 -801 -182 -16 577 1355 953 120 -329 -690 -522 -732 -166 287 682 1443 413 128 -799 -1445 -1204 -999 -1027 -712 -552 -529 -687 -208 165 319 1261 1479 1293 873 743 -378 -534 -409 -489 113 862 58 -691 -340 -755 -173 -102 -148 -382 -317 -185 -92 551 779 816 673 -44 -566 -400 -263 -251 300 288 644 1416 1017 468 530 -14 226 153 257 -260 -196 78 -456 -432 -262 -278 -288 -45 -298 -567 -959 -980 -440 43 315 348 259 -187 7 404 405 301 188 -161 -121 -174 218 301 4 504 627 518 310 95 -385 -334 273 821 739 902 754 -501 -314 163 238 266 220 -606 -1102 -893 -1050 -965 -784 -662 -871 -624 -538 302 509 444 702 540 490 483 661 254 547 709 1222 1057 1004 341 -800 -175 -15 511 1185 867 118 -334 -727 -544 -734 -159 268 604 1222 355 118 -790 -1506 -1281 -1118 -1186 -846 -668 -655 -845 -253 192 348 1300 1541 1363 973 881 -460 -680 -512 -594 132 1000 68 -843 -425 -989 -227 -136 -208 -542 -450 -259 -124 697 958 996 858 -59 -777 -548 -359 -344 405 370 809 1744 1253 586 681 -19 302 208 362 -376 -288 119 -688 -657 -392 -415 -416 -65 SS 20210625T135042.9Z 7846.576885 328 1 45.33 2 42.72 99.27 129.90 268.17 0.00 1 0.00 1 0 25 8.571e-03 6.709e-03 3.232e-04 2.086e-04 1.934751e-01 1.119841e-04 2.346389e-03 -6.000000e+00 5.177872e-03 232.90 -2.00 3.51 -2.00 315.20 0.00e+00 4.585186e-06 1.005176e-05 3.692265e-05 -6.000000e+00 2.296489e-04 287.67 -2.00 20.00 -2.00 314.50 0.00e+00 1.359 0.000 302.00 328.00 3 1.1267e+00 2.9045e-04 1.7058e-02 -6.0000e+00 1.2993e-02 8.0755e-03 3.2119e-04 1.0149e-02 -6.0000e+00 1.4014e-02 -9.4212e-06 1.8314e-04 4.9205e-03 -6.0000e+00 8.3464e-03 -1.5831e-03 7.9652e-05 1.3446e-03 -6.0000e+00 3.4852e-03 3.5742e-02 -1.8087e-05 6.3865e-06 1.9226e-05 -6.0000e+00 2.5617e-04 4.2608e-03 6.4134e-05 11 8 0 10 0 0 99.95 22.79 0.21 0.00426 0.00412 1255 237 1 5 0 35.680 25.68 20.00 22.79 29.79 29.5 1100.00 -848 -1785 -2765 -3078 -1315 386 1072 1294 844 -648 40 1199 983 618 371 -480 -455 61 394 437 -34 971 1310 899 640 138 -582 -624 603 1678 1434 1714 1488 -915 -570 412 440 519 321 -840 -1464 -1133 -1270 -1144 -898 -827 -1056 -828 -674 371 732 562 880 662 566 593 795 284 632 833 1397 1211 1070 368 -775 -238 -30 539 1381 933 130 -344 -649 -515 -729 -217 237 647 1442 423 91 -829 -1457 -1192 -1021 -1000 -726 -504 -494 -665 -185 183 307 1233 1446 1287 893 727 -370 -535 -412 -537 62 857 51 -674 -344 -718 -178 -91 -118 -340 -307 -149 -110 554 773 851 646 -44 -549 -378 -251 -265 274 267 658 1416 1058 450 471 -7 197 148 258 -267 -179 74 -460 -401 -259 -285 -304 -24 -247 -573 -920 -985 -377 101 280 368 268 -222 14 405 329 230 155 -207 -206 28 187 213 -16 484 653 436 326 74 -314 -324 290 804 685 858 747 -488 -297 204 223 294 203 -566 -1111 -872 -1012 -924 -725 -663 -836 -635 -524 280 556 428 707 559 472 506 690 249 547 712 1198 1085 982 347 -760 -224 -27 473 1192 873 125 -355 -667 -524 -743 -213 218 567 1208 376 86 -836 -1540 -1280 -1155 -1161 -864 -607 -609 -816 -225 213 337 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