File name: Pandora55s1_QueensNY_20210603_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T185657.6Z 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_20210603_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: 20210603 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 20210603T184111.6Z 7824.778606 430 1 3.34 2 29.14 239.22 98.79 270.93 0.00 1 0.00 1 0 25 8.944e-03 7.098e-03 2.669e-03 1.974e-03 1.700845e-01 1.063890e-03 2.071410e-03 -6.000000e+00 5.394245e-03 232.23 -2.00 3.51 -2.00 314.51 0.00e+00 -6.628841e-05 8.366239e-05 2.091033e-05 -6.000000e+00 2.375632e-04 285.56 -2.00 20.00 -2.00 313.92 0.00e+00 1.144 0.000 302.00 328.00 3 3.1233e+00 2.7407e-03 1.4576e-02 -6.0000e+00 1.3523e-02 2.6840e-02 3.0243e-03 8.8771e-03 -6.0000e+00 1.4595e-02 -1.4121e-03 1.7276e-03 4.3199e-03 -6.0000e+00 8.6863e-03 -7.0223e-04 7.3629e-04 1.1840e-03 -6.0000e+00 3.6279e-03 6.2394e-03 3.5750e-05 5.9980e-05 1.7738e-05 -6.0000e+00 2.6714e-04 -1.1187e-03 9.5002e-05 12 9 1 12 1 1 99.84 22.80 0.25 -0.00112 -0.00085 7 24 1 5 0 394.090 25.68 20.01 22.80 35.03 29.4 1100.00 -1055 -1263 -2197 -3592 -1828 1132 -174 2034 1233 -229 -29 1302 1024 418 1095 -99 -590 336 591 507 517 250 1109 1029 465 10 -724 -1323 629 1739 1402 1716 791 -566 -13 526 164 1354 370 -1123 -1539 -1231 -1225 -1798 -843 -495 -1054 -685 -1421 892 567 684 502 500 70 772 1029 620 774 588 1670 940 886 128 -761 -421 230 591 1561 637 157 -100 -267 -407 -924 61 178 790 1081 507 250 -1073 -1122 -1300 -1091 -1239 -746 -519 -473 -714 -215 -9 292 1292 1403 1298 786 633 -239 -543 -593 -556 194 786 281 -508 -484 -427 -316 -28 -188 -450 -121 10 -220 354 561 928 837 244 -768 -440 -71 -270 201 187 808 1368 979 476 586 43 104 155 156 -222 -285 145 -483 -593 -98 -245 -269 -84 -402 -500 -899 -1428 -682 398 -62 730 494 -94 -12 525 433 187 541 -52 -308 178 319 281 293 143 626 596 272 6 -447 -789 358 963 767 933 459 -331 -7 297 94 824 248 -830 -1234 -1016 -1044 -1563 -725 -422 -888 -575 -1157 716 459 558 419 436 61 687 927 565 697 524 1484 874 853 129 -767 -420 216 528 1405 602 155 -103 -278 -434 -951 61 166 710 926 455 232 -1085 -1161 -1388 -1224 -1407 -877 -641 -584 -879 -260 -11 319 1354 1422 1371 856 737 -289 -671 -740 -669 222 888 322 -611 -601 -540 -414 -38 -257 -623 -167 14 -290 437 685 1118 1021 311 -1004 -592 -95 -362 258 233 976 1609 1177 583 738 55 137 201 209 -305 -403 205 -705 -873 -141 -353 -376 -117 SS 20210603T184456.1Z 7824.781205 433 1 6.14 2 29.75 240.46 99.47 271.54 0.00 1 0.00 1 0 25 8.701e-03 6.946e-03 1.078e-03 7.971e-04 1.687176e-01 4.298294e-04 2.058133e-03 -6.000000e+00 5.247314e-03 232.23 -2.00 3.51 -2.00 314.51 0.00e+00 6.667900e-05 3.377459e-05 3.875756e-05 -6.000000e+00 2.310941e-04 285.56 -2.00 20.00 -2.00 313.92 0.00e+00 1.151 0.000 302.00 328.00 3 2.0675e+00 1.1063e-03 1.4584e-02 -6.0000e+00 1.3154e-02 1.4485e-02 1.2199e-03 8.8109e-03 -6.0000e+00 1.4197e-02 6.8870e-04 6.9796e-04 4.2880e-03 -6.0000e+00 8.4497e-03 -1.7998e-03 2.9804e-04 1.1847e-03 -6.0000e+00 3.5290e-03 1.7929e-02 1.9303e-06 2.4222e-05 1.8045e-05 -6.0000e+00 2.5988e-04 -1.3104e-03 7.5723e-05 12 9 1 12 1 1 99.76 22.80 0.20 -0.00131 -0.00130 45 72 1 5 0 129.500 25.68 20.00 22.80 35.56 29.4 1100.00 -761 -1934 -2764 -3105 -824 118 1546 1402 925 -709 173 1174 1186 823 394 -377 -299 173 397 753 -249 979 1330 1191 448 -46 -522 -775 615 1573 1646 1517 1588 -944 -379 553 280 334 414 -713 -1670 -1277 -1351 -1218 -976 -784 -1174 -803 -751 284 801 605 852 577 541 541 665 290 566 811 1353 1141 961 303 -954 -147 13 611 1219 969 51 -284 -560 -462 -695 -176 328 596 1444 494 218 -750 -1391 -1274 -1010 -1032 -678 -574 -442 -705 -263 192 236 1410 1471 1305 762 804 -378 -617 -221 -458 130 762 192 -663 -131 -713 -146 -77 -235 -434 -420 -296 -261 463 782 786 705 116 -413 -392 -203 -329 242 320 720 1313 916 450 608 -6 242 190 284 -313 -107 183 -475 -531 -225 -217 -364 -115 -287 -756 -1116 -1280 -302 42 543 502 369 -287 74 494 491 377 190 -200 -157 92 216 419 -143 557 754 692 261 -28 -320 -457 352 842 868 834 923 -553 -227 314 163 205 285 -529 -1339 -1045 -1143 -1044 -834 -665 -983 -676 -608 222 627 495 704 500 485 476 593 262 504 742 1239 1047 908 296 -967 -148 12 561 1097 902 51 -295 -584 -478 -718 -174 303 518 1241 428 201 -744 -1453 -1360 -1133 -1195 -809 -698 -550 -875 -323 224 259 1447 1516 1353 834 932 -466 -771 -270 -546 148 865 220 -792 -164 -915 -187 -103 -322 -598 -579 -403 -338 582 952 948 856 147 -543 -532 -274 -434 314 408 897 1549 1075 553 762 -8 314 251 374 -437 -152 259 -694 -782 -326 -315 -512 -158 SS 20210603T184841.4Z 7824.783812 436 1 1.98 2 30.38 241.67 100.15 272.15 0.00 1 0.00 1 0 25 8.228e-03 6.797e-03 1.900e-03 1.408e-03 1.688029e-01 7.599778e-04 2.062249e-03 -6.000000e+00 4.962007e-03 232.23 -2.00 3.51 -2.00 314.51 0.00e+00 -4.176874e-05 5.990645e-05 3.627397e-05 -6.000000e+00 2.185395e-04 285.56 -2.00 20.00 -2.00 313.92 0.00e+00 1.159 0.000 302.00 328.00 3 1.9607e+00 1.9561e-03 1.4648e-02 -6.0000e+00 1.2439e-02 9.3060e-03 2.1582e-03 8.8265e-03 -6.0000e+00 1.3426e-02 3.0651e-03 1.2344e-03 4.2957e-03 -6.0000e+00 7.9905e-03 -2.9156e-03 5.2622e-04 1.1797e-03 -6.0000e+00 3.3369e-03 1.9841e-02 -3.5728e-05 4.2803e-05 1.8077e-05 -6.0000e+00 2.4578e-04 -1.1653e-03 5.9093e-05 12 9 1 12 1 1 98.98 22.80 0.23 -0.00117 -0.00143 13 73 1 5 0 128.780 25.68 19.98 22.80 35.93 29.4 1100.00 -435 -1575 -2571 -2750 -942 598 759 357 1185 -332 -102 1284 561 975 260 -482 -166 372 599 737 -140 973 623 683 807 -28 -555 -1028 344 1525 1310 1458 1738 -1011 -507 429 672 670 224 -482 -1529 -1184 -1114 -1272 -1049 -861 -1208 -967 -583 498 733 416 709 493 350 741 881 344 705 1007 1274 1142 1130 574 -975 -311 -136 325 1254 900 190 -207 -667 -712 -630 -247 239 597 1633 163 50 -766 -1379 -1368 -1070 -1021 -615 -497 -454 -483 -346 42 482 1114 1156 1308 744 694 -241 -464 -258 -420 277 793 170 -600 -276 -652 51 -8 -116 -485 -480 -185 -6 505 811 710 504 -64 -599 -367 -448 -289 255 434 514 1406 1074 542 553 -145 214 395 199 -247 -183 86 -386 -592 -192 -345 -276 -18 -166 -624 -1052 -1080 -351 216 274 132 481 -137 -42 519 239 455 128 -247 -89 202 332 398 -78 538 346 388 479 -17 -332 -624 193 837 710 822 982 -607 -296 251 378 421 151 -366 -1208 -994 -928 -1077 -886 -721 -999 -804 -465 399 590 337 604 423 311 669 807 307 646 909 1156 1039 1059 575 -983 -311 -130 296 1118 832 189 -214 -694 -761 -648 -243 219 535 1386 146 48 -756 -1435 -1459 -1199 -1180 -733 -604 -566 -599 -412 49 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