File name: Pandora55s1_QueensNY_20210702_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T191148.5Z 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_20210702_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: 20210702 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 20210702T140247.0Z 7853.585266 327 1 51.24 2 40.96 101.89 51.66 233.65 0.00 1 0.00 1 0 17 1.590e-02 8.845e-03 2.973e-03 1.810e-03 1.862378e-01 9.678573e-04 2.221649e-03 -6.000000e+00 9.600570e-03 232.90 -2.00 3.51 -2.00 315.43 0.00e+00 -3.609108e-04 9.155301e-05 3.635874e-05 -6.000000e+00 4.271627e-04 288.33 -2.00 20.00 -2.00 314.70 0.00e+00 1.323 0.000 302.00 328.00 3 5.4931e+00 2.5167e-03 1.6491e-02 -6.0000e+00 2.4084e-02 2.0897e-02 2.7893e-03 9.7040e-03 -6.0000e+00 2.5979e-02 6.6622e-03 1.5903e-03 4.6863e-03 -6.0000e+00 1.5478e-02 -4.1972e-03 6.9700e-04 1.2845e-03 -6.0000e+00 6.4644e-03 4.7443e-04 -2.5733e-04 5.5626e-05 1.7883e-05 -6.0000e+00 4.7528e-04 6.6200e-03 3.0682e-05 12 9 1 12 40 32 99.98 22.76 0.15 0.00662 0.00469 15 3 1 5 0 3412.400 25.58 19.98 22.76 30.67 29.9 1100.00 -586 -36 5147 -7614 -587 3338 -536 -1712 1316 -2935 4044 468 -2798 -5704 3665 -1049 -3075 2616 3511 1501 1641 1187 -11 -992 695 -585 2814 -1615 1688 346 1300 -162 50 -3183 -1306 4392 -1485 -1825 1878 -800 -1705 13 -2162 -1580 -1162 1042 -1797 579 -625 654 -368 -632 -303 1603 1532 1038 2037 289 1095 777 1432 1762 1009 -501 -44 -1873 360 -555 2004 1634 -441 -566 148 -666 821 -327 -120 891 289 401 -533 73 -1332 -1447 -1705 -904 -784 -264 -586 107 10 220 187 442 718 1212 206 383 -198 -619 -423 -315 -128 1570 305 -476 -113 -476 -36 143 166 -178 93 -447 -621 132 286 846 286 29 -1202 -391 445 653 82 285 -164 851 673 -269 333 -180 575 385 675 -45 631 171 -133 -465 -552 -393 -356 -317 -154 -10 1424 -2259 -152 787 -132 -461 378 -914 1202 143 -919 -2087 1357 -432 -1331 1108 1508 669 743 544 -5 -474 341 -299 1408 -811 786 157 582 -76 24 -1641 -654 2047 -738 -989 1118 -543 -1256 10 -1707 -1258 -921 814 -1408 438 -467 478 -273 -485 -241 1300 1276 880 1743 251 941 664 1229 1547 930 -486 -43 -1827 328 -486 1718 1478 -432 -580 153 -694 825 -317 -109 755 241 344 -492 72 -1386 -1564 -1910 -1049 -946 -328 -740 134 12 258 206 461 738 1279 231 455 -247 -797 -538 -386 -150 1790 359 -586 -144 -624 -49 197 235 -257 134 -634 -842 170 356 1045 363 38 -1660 -548 619 895 111 371 -209 1043 824 -341 435 -242 778 527 942 -65 932 257 -204 -717 -844 -591 -524 -464 SS 20210702T143956.0Z 7853.611065 345 1 24.84 2 34.20 110.51 57.41 242.32 0.00 1 0.00 1 0 17 1.069e-02 7.256e-03 2.883e-03 1.971e-03 1.714886e-01 1.059657e-03 2.050906e-03 -6.000000e+00 6.457543e-03 232.90 -2.00 3.51 -2.00 314.92 0.00e+00 -2.572442e-04 9.058702e-05 2.055063e-05 -6.000000e+00 2.872215e-04 288.33 -2.00 20.00 -2.00 314.24 0.00e+00 1.208 0.000 302.00 328.00 3 5.0464e+00 2.7418e-03 1.5105e-02 -6.0000e+00 1.6200e-02 1.9302e-02 3.0304e-03 8.9225e-03 -6.0000e+00 1.7472e-02 4.6806e-03 1.7283e-03 4.3154e-03 -6.0000e+00 1.0410e-02 -2.8417e-03 7.4472e-04 1.1809e-03 -6.0000e+00 4.3495e-03 8.5576e-04 1.4364e-04 6.0376e-05 1.7110e-05 -6.0000e+00 3.1951e-04 5.5806e-03 9.4329e-05 12 9 1 12 33 1 99.94 22.76 0.20 0.00558 0.00666 9 4 1 5 0 2466.790 25.58 19.99 22.76 31.96 29.7 1100.00 -965 -1607 1414 -4604 -1381 780 -48 4367 1119 -582 -1290 757 -1221 -1948 1606 -769 -2198 -338 2034 1018 712 1721 1366 -29 837 -760 1624 -1665 -221 365 1088 1901 1177 -2324 -552 2776 -1278 -473 910 -5 -1678 -208 -1898 -971 -600 -230 -1123 -368 -242 178 120 -368 385 473 1350 596 2020 726 1299 850 1383 1769 548 104 -342 -907 213 -115 1593 315 -184 -353 -307 -690 -505 -197 148 138 1159 12 -763 62 -1516 -1143 -1170 -979 -684 99 -617 -76 -653 299 257 704 827 1122 500 567 -349 -827 -388 -315 315 1218 -20 -846 -203 -518 -74 179 244 -541 37 62 -533 335 265 765 286 71 -788 -372 326 267 492 188 287 877 702 190 673 311 478 331 341 -172 120 159 -440 -691 -349 -201 -398 -334 -312 -559 488 -1614 -440 230 -14 1352 385 -213 -476 274 -466 -805 699 -362 -1077 -166 1001 514 366 883 704 -15 457 -431 909 -929 -116 184 543 970 631 -1303 -302 1441 -693 -276 587 -4 -1307 -168 -1573 -807 -498 -190 -920 -295 -189 137 93 -294 317 401 1163 523 1783 647 1151 750 1224 1599 519 103 -344 -896 199 -103 1401 293 -181 -365 -323 -725 -518 -193 136 120 980 11 -715 61 -1586 -1234 -1305 -1132 -821 122 -774 -95 -798 348 283 735 849 1181 555 665 -430 -1048 -487 -380 365 1381 -24 -1034 -256 -668 -98 241 338 -768 52 86 -707 422 323 928 356 93 -1063 -509 444 359 646 241 357 1057 845 235 856 407 630 441 463 -241 172 232 -653 -1033 -516 -293 -571 -475 SS 20210702T154309.2Z 7853.654968 386 1 12.04 2 23.93 132.10 68.16 254.83 0.00 1 0.00 1 0 17 8.644e-03 7.152e-03 1.315e-03 1.006e-03 1.523889e-01 5.430811e-04 1.850544e-03 -6.000000e+00 5.220932e-03 232.90 -2.00 3.51 -2.00 314.32 0.00e+00 4.713870e-05 4.173339e-05 2.886084e-05 -6.000000e+00 2.322541e-04 288.34 -2.00 20.00 -2.00 313.71 0.00e+00 1.094 0.000 302.00 328.00 3 3.2864e+00 1.3981e-03 1.3603e-02 -6.0000e+00 1.3097e-02 7.0620e-03 1.5407e-03 7.9704e-03 -6.0000e+00 1.4127e-02 1.4367e-03 8.8147e-04 3.8665e-03 -6.0000e+00 8.4168e-03 -2.6337e-03 3.7428e-04 1.0604e-03 -6.0000e+00 3.5162e-03 5.8307e-03 -7.3561e-05 3.0698e-05 1.6242e-05 -6.0000e+00 2.5838e-04 5.8326e-03 6.5152e-05 12 9 1 12 1 1 95.73 22.75 0.26 0.00583 0.00528 26 22 1 5 0 439.460 25.58 19.98 22.75 31.11 29.9 1100.00 -498 -1747 -2149 -3173 -658 1157 1173 1544 830 -797 -243 1115 873 748 453 -203 -430 300 492 409 -11 1147 1548 664 448 -124 -763 -823 503 1385 1387 1569 1470 -942 -628 570 492 364 191 -727 -1544 -887 -1291 -1452 -1188 -828 -1377 -924 -856 44 751 173 739 719 594 571 946 503 937 1002 1353 1392 1084 198 -879 -259 -82 574 1637 963 228 -227 -604 -704 -512 -213 252 650 1222 461 -128 -967 -1416 -1123 -1001 -935 -978 -453 -553 -601 -131 210 155 1388 1480 1198 764 692 -397 -426 -350 -545 165 1028 43 -643 -392 -625 -156 -94 -112 -292 -402 -226 -178 539 724 788 795 72 -654 -507 -244 -182 371 168 757 1322 1183 352 509 40 152 116 191 -455 -127 211 -545 -364 -412 -177 -236 -85 -207 -749 -942 -1338 -261 415 450 602 360 -349 -106 475 389 367 233 -108 -237 168 281 239 -7 680 914 405 272 -78 -486 -503 297 765 796 885 874 -591 -383 328 290 228 134 -549 -1254 -761 -1101 -1255 -1024 -706 -1158 -779 -694 36 611 142 633 618 526 516 864 464 853 902 1225 1312 1051 198 -907 -255 -77 513 1491 911 222 -239 -635 -736 -532 -213 235 570 1066 405 -120 -968 -1485 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