File name: Pandora55s1_QueensNY_20210611_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T190759.8Z 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_20210611_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: 20210611 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 20210611T133757.1Z 7832.568022 192 1 49.26 2 44.69 97.68 54.28 86.11 0.00 1 0.00 1 0 17 1.715e-02 9.046e-03 3.411e-03 1.916e-03 1.968733e-01 1.021011e-03 2.337268e-03 -6.000000e+00 1.036091e-02 232.68 -2.00 3.51 -2.00 315.71 0.00e+00 -1.305463e-04 1.017122e-04 5.730279e-05 -6.000000e+00 4.570687e-04 286.33 -2.00 20.00 -2.00 314.99 0.00e+00 1.405 0.000 302.00 328.00 3 5.4248e+00 2.6614e-03 1.7452e-02 -6.0000e+00 2.5996e-02 2.7647e-02 2.9532e-03 1.0219e-02 -6.0000e+00 2.8045e-02 9.9146e-03 1.6857e-03 4.9411e-03 -6.0000e+00 1.6693e-02 -5.6022e-03 7.4770e-04 1.3460e-03 -6.0000e+00 6.9690e-03 4.5686e-04 1.9856e-04 5.8943e-05 1.8486e-05 -6.0000e+00 5.1244e-04 1.7443e-03 1.4367e-04 11 9 0 11 32 0 99.98 22.80 0.51 0.00174 0.00324 19 4 1 5 0 2591.890 25.68 19.99 22.80 25.72 29.1 1093.74 -1951 2426 5003 -7246 144 3549 -4739 6127 424 1121 -1963 -1797 -3178 114 4937 -515 -2386 -5602 3432 1034 3040 511 2007 -452 121 -369 3054 -1851 -687 531 551 2594 62 -3421 -1387 3760 -1672 -1054 1373 26 -2273 103 -2493 -1994 -970 -525 -2095 870 250 840 -655 -237 253 1855 1560 1083 1875 1309 1890 324 1081 1738 1427 -730 46 -1538 290 -677 1951 455 -686 -59 290 -488 853 160 405 1232 519 -41 -676 -80 -1359 -875 -1807 -1038 -901 -353 -506 -355 -495 -112 276 657 980 1307 87 732 -148 -756 -397 -539 -35 1403 194 -361 -500 -454 90 282 344 -746 -19 -204 -116 -94 37 942 337 160 -1220 -532 656 715 -212 224 30 1509 -18 -78 680 332 375 361 759 -40 272 290 -267 -618 -395 -392 -382 -360 -455 592 1225 -1910 33 742 -1070 1362 109 302 -548 -501 -939 36 1642 -193 -946 -2329 1362 429 1265 219 851 -200 56 -175 1423 -872 -305 224 232 1117 29 -1673 -660 1668 -787 -539 780 17 -1615 76 -1905 -1540 -744 -401 -1598 637 180 596 -473 -177 195 1468 1269 899 1572 1106 1587 272 911 1498 1291 -698 45 -1480 261 -586 1652 410 -666 -60 299 -505 852 153 362 1030 426 -35 -619 -78 -1410 -940 -2021 -1206 -1089 -440 -640 -447 -609 -132 305 685 1004 1377 98 871 -186 -980 -509 -667 -42 1610 229 -447 -642 -599 121 391 491 -1097 -27 -292 -159 -123 47 1176 432 214 -1707 -755 924 991 -288 296 38 1859 -22 -100 895 449 514 501 1073 -59 410 445 -415 -970 -614 -599 -573 -535 SS 20210611T135639.2Z 7832.581010 205 1 49.46 2 41.20 101.36 50.82 88.93 0.00 1 0.00 1 0 25 8.652e-03 6.746e-03 6.121e-04 4.022e-04 1.869301e-01 2.154587e-04 2.260650e-03 -6.000000e+00 5.224816e-03 232.69 -2.00 3.51 -2.00 315.12 0.00e+00 -4.289240e-06 1.897729e-05 3.788510e-05 -6.000000e+00 2.305294e-04 286.33 -2.00 20.00 -2.00 314.45 0.00e+00 1.328 0.000 302.00 328.00 3 2.5608e+00 5.5816e-04 1.6563e-02 -6.0000e+00 1.3109e-02 1.6435e-02 6.1769e-04 9.7706e-03 -6.0000e+00 1.4144e-02 -2.5795e-04 3.5210e-04 4.7395e-03 -6.0000e+00 8.4185e-03 -1.8579e-03 1.5243e-04 1.2986e-03 -6.0000e+00 3.5137e-03 8.8852e-03 -1.0060e-05 1.2298e-05 1.8625e-05 -6.0000e+00 2.5851e-04 2.0458e-03 9.3223e-05 11 8 0 10 0 0 99.94 22.80 0.22 0.00205 0.00197 361 68 1 5 0 136.980 25.68 19.98 22.80 26.57 29.3 1099.07 -1104 -1601 -2575 -3302 -1133 887 735 1701 1076 -519 -74 1203 913 417 527 -557 -399 -59 546 519 77 917 1255 869 543 100 -532 -659 382 1534 1464 1820 1445 -1119 -562 474 434 455 501 -853 -1437 -1171 -1344 -1248 -879 -737 -1205 -812 -810 350 620 616 729 680 593 529 821 392 663 812 1390 1233 1150 254 -782 -298 56 501 1445 925 7 -355 -610 -509 -791 -162 319 796 1415 503 109 -669 -1452 -1217 -1063 -975 -753 -528 -518 -702 -222 222 295 1175 1422 1348 858 777 -367 -525 -414 -410 97 865 75 -628 -313 -700 -125 -115 -109 -394 -333 -237 -132 480 747 898 665 -16 -586 -388 -206 -253 258 238 572 1423 952 414 507 5 262 128 274 -218 -239 132 -461 -397 -292 -239 -258 -49 -332 -529 -882 -1093 -334 237 197 494 349 -181 -26 415 333 158 223 -244 -183 -27 261 255 39 461 630 449 278 54 -288 -344 196 737 698 905 766 -594 -291 247 231 255 313 -597 -1075 -934 -1057 -995 -699 -582 -941 -644 -621 259 463 481 601 560 506 462 727 351 587 710 1217 1075 1073 243 -779 -286 52 446 1264 835 7 -370 -630 -522 -816 -161 298 674 1201 429 104 -676 -1537 -1306 -1202 -1128 -892 -657 -637 -858 -270 259 325 1228 1442 1431 955 913 -456 -657 -529 -492 112 1001 87 -756 -398 -899 -166 -155 -153 -557 -471 -332 -178 615 936 1113 827 -21 -807 -531 -281 -349 339 310 731 1721 1149 525 654 6 347 173 383 -311 -346 196 -704 -610 -443 -351 -380 -70 SS 20210611T140853.5Z 7832.589508 212 1 50.13 2 38.94 103.96 48.56 90.84 0.00 1 0.00 1 0 17 8.693e-03 6.816e-03 3.277e-04 2.227e-04 1.801461e-01 1.192227e-04 2.185534e-03 -6.000000e+00 5.249114e-03 232.69 -2.00 3.51 -2.00 314.96 0.00e+00 2.205350e-05 1.024440e-05 3.725819e-05 -6.000000e+00 2.316178e-04 286.33 -2.00 20.00 -2.00 314.31 0.00e+00 1.284 0.000 302.00 328.00 3 1.4752e+00 3.0864e-04 1.6009e-02 -6.0000e+00 1.3170e-02 9.9554e-03 3.4132e-04 9.4329e-03 -6.0000e+00 1.4210e-02 4.8453e-04 1.9446e-04 4.5777e-03 -6.0000e+00 8.4578e-03 -1.9169e-03 8.3906e-05 1.2546e-03 -6.0000e+00 3.5298e-03 2.7891e-02 -2.8492e-06 6.7992e-06 1.8152e-05 -6.0000e+00 2.5974e-04 2.6303e-03 9.4787e-05 11 8 0 10 0 0 99.99 22.78 0.22 0.00263 0.00261 1012 191 1 5 0 49.430 25.58 19.99 22.78 27.45 29.5 1100.00 -916 -1691 -2825 -3054 -1139 497 1277 1396 1024 -639 162 1195 1170 707 452 -507 -458 -41 369 486 -45 946 1288 934 558 169 -725 -710 556 1648 1532 1757 1423 -912 -586 463 540 514 417 -816 -1483 -1205 -1313 -1217 -980 -863 -1144 -841 -703 387 697 611 747 599 573 529 763 276 614 861 1425 1148 1086 299 -782 -239 34 606 1408 954 87 -315 -705 -500 -753 -220 300 747 1528 432 85 -715 -1453 -1173 -984 -998 -735 -513 -496 -687 -235 189 294 1250 1509 1281 828 737 -338 -578 -357 -468 113 893 118 -655 -286 -736 -150 -111 -178 -402 -330 -224 -121 546 754 846 679 -26 -563 -429 -278 -251 271 284 609 1403 1004 439 461 -9 206 175 275 -249 -191 110 -433 -433 -269 -283 -324 -6 -301 -571 -990 -1028 -367 145 372 443 361 -227 57 418 430 289 194 -239 -226 -20 179 242 -23 480 652 487 306 97 -397 -396 287 844 778 876 755 -513 -322 241 287 305 261 -575 -1120 -968 -1092 -979 -787 -721 -944 -671 -540 302 547 478 617 496 490 463 677 248 544 753 1249 1051 1017 288 -782 -229 31 538 1227 899 84 -328 -730 -514 -776 -218 279 660 1286 384 80 -720 -1533 -1256 -1109 -1155 -873 -640 -611 -843 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