File name: Pandora55s1_QueensNY_20240502_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240511T161218.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240502_L1_smca1c17d20220526p1-8.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: 20240502 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20240502T152401.1Z 8888.641679 310 1 50.91 2 31.54 136.27 72.16 227.74 0.00 1 0.00 1 0 25 8.142e-03 6.398e-03 2.844e-04 1.966e-04 1.798228e-01 1.049836e-04 2.189698e-03 -6.000000e+00 4.878938e-03 230.11 -2.00 3.51 -2.00 314.95 0.00e+00 5.872346e-05 8.893759e-06 3.631312e-05 -6.000000e+00 2.140428e-04 282.34 -2.00 20.00 -2.00 314.36 0.00e+00 1.173 0.000 302.00 328.00 3 1.2875e+00 2.7011e-04 1.5049e-02 -6.0000e+00 1.2181e-02 2.3453e-03 2.9888e-04 9.2840e-03 -6.0000e+00 1.3177e-02 3.3159e-04 1.7095e-04 4.5427e-03 -6.0000e+00 7.8339e-03 -1.8041e-03 7.4531e-05 1.2627e-03 -6.0000e+00 3.2978e-03 3.7765e-02 4.6881e-04 6.0284e-06 1.8395e-05 -6.0000e+00 2.4471e-04 1.0716e-02 0.0000e+00 11 1 0 11 4 0 99.98 22.82 0.21 0.01072 0.01424 1279 242 1 5 0 39.440 26.11 20.01 22.82 24.65 37.1 1100.00 -1688 -2584 -3045 -1367 48 985 1260 1040 -412 -63 993 934 652 485 -343 -416 71 400 551 5 958 1327 808 551 147 -689 -671 338 1414 1338 1548 1467 -939 -520 231 205 418 382 -704 -1363 -1095 -1272 -1161 -963 -796 -1073 -870 -690 339 680 555 813 644 611 547 772 328 643 807 1348 1189 1101 449 -722 -173 -68 368 1239 824 146 -242 -628 -467 -716 -143 210 501 1306 339 108 -687 -1414 -1180 -976 -1029 -685 -493 -424 -605 -196 197 217 1140 1355 1209 834 743 -293 -480 -303 -472 -1 774 85 -666 -256 -704 -139 -83 -125 -306 -305 -161 -106 410 680 766 686 10 -471 -315 -235 -268 213 215 487 1335 957 400 506 -38 225 125 254 -282 -179 144 -401 -418 -232 -250 -329 -21 -580 -921 -1048 -452 14 292 405 371 -148 -23 353 348 269 210 -163 -196 34 196 277 3 493 681 427 306 80 -383 -380 178 693 688 780 786 -534 -289 122 110 235 240 -497 -1033 -886 -1018 -942 -781 -641 -854 -702 -536 254 512 438 675 536 527 482 690 297 575 712 1190 1045 1035 434 -727 -168 -63 330 1088 744 141 -252 -654 -482 -744 -137 198 428 1109 302 102 -692 -1494 -1267 -1059 -1192 -814 -594 -524 -745 -240 232 241 1196 1373 1278 923 870 -362 -601 -374 -570 -2 894 98 -800 -325 -905 -184 -111 -170 -434 -433 -220 -138 526 819 946 848 13 -623 -430 -320 -356 280 280 599 1613 1149 504 648 -49 298 168 340 -399 -257 214 -590 -622 -340 -368 -469 -30 SS 20240502T153248.0Z 8888.647778 316 1 3.62 2 30.42 139.76 73.34 229.50 0.00 1 0.00 1 0 25 8.616e-03 6.733e-03 2.417e-03 1.753e-03 1.791633e-01 9.392948e-04 2.196888e-03 -6.000000e+00 5.162521e-03 230.11 -2.00 3.51 -2.00 314.70 0.00e+00 1.495115e-04 7.579987e-05 4.184333e-05 -6.000000e+00 2.265088e-04 282.34 -2.00 20.00 -2.00 314.13 0.00e+00 1.159 0.000 302.00 328.00 3 2.9586e+00 2.4108e-03 1.4941e-02 -6.0000e+00 1.2889e-02 2.1952e-02 2.6659e-03 9.2801e-03 -6.0000e+00 1.3943e-02 -1.1222e-03 1.5243e-03 4.5438e-03 -6.0000e+00 8.2895e-03 -1.8159e-03 6.5915e-04 1.2718e-03 -6.0000e+00 3.4891e-03 7.1521e-03 3.3096e-04 5.3593e-05 1.9216e-05 -6.0000e+00 2.5896e-04 1.1594e-02 0.0000e+00 12 9 1 12 13 1 97.77 22.81 0.18 0.01159 0.01408 9 26 1 5 0 360.760 26.11 19.97 22.81 25.85 36.9 1100.00 -1738 -2354 -3903 -767 -646 554 1030 1455 -703 -743 735 699 675 525 -386 -476 563 197 1416 -14 951 1197 733 923 582 -6 -816 717 1009 1980 1516 1426 -759 -628 381 82 693 5 -733 -1229 -1118 -1337 -1107 -1137 -948 -1435 -891 -879 638 945 397 864 765 589 363 1039 276 670 453 1216 1303 1001 611 -631 107 -86 184 1186 873 -30 -503 -658 -566 -634 -185 383 375 1382 -64 -126 -773 -1406 -1096 -862 -963 -701 -406 -827 -294 -305 321 -226 1539 1283 1079 748 682 -409 -336 -39 -611 220 832 40 -754 -121 -568 -48 -208 127 -151 -257 -275 -154 401 556 927 710 -210 -398 -192 -31 -517 -45 185 674 1283 1074 194 555 19 313 93 177 -284 -176 180 -340 -548 -379 -396 -276 212 -656 -909 -1486 -269 -214 182 357 541 -277 -294 288 283 292 244 -191 -243 291 104 753 -7 517 648 405 525 340 -3 -473 396 535 1038 818 800 -442 -361 212 46 415 3 -536 -964 -911 -1113 -929 -954 -794 -1193 -728 -702 499 741 320 717 654 514 322 927 248 599 403 1082 1185 946 599 -633 106 -82 166 1056 810 -29 -519 -692 -594 -652 -182 355 331 1183 -57 -118 -766 -1465 -1177 -952 -1102 -831 -494 -1024 -362 -369 372 -250 1604 1315 1133 824 791 -499 -420 -49 -736 254 942 46 -907 -151 -722 -62 -276 173 -210 -359 -376 -202 503 675 1115 872 -269 -526 -259 -42 -689 -58 234 829 1534 1279 237 699 24 409 123 238 -392 -249 259 -496 -804 -553 -570 -390 296 SS 20240502T153643.1Z 8888.650499 319 1 6.77 2 29.95 141.39 73.88 230.27 0.00 1 0.00 1 0 25 8.165e-03 6.611e-03 4.717e-04 3.437e-04 1.774076e-01 1.841230e-04 2.170460e-03 -6.000000e+00 4.892437e-03 230.11 -2.00 3.51 -2.00 314.69 0.00e+00 1.080259e-04 1.486951e-05 4.024261e-05 -6.000000e+00 2.146436e-04 282.35 -2.00 20.00 -2.00 314.13 0.00e+00 1.154 0.000 302.00 328.00 3 4.5948e-01 4.7271e-04 1.4830e-02 -6.0000e+00 1.2215e-02 -2.2263e-03 5.2290e-04 9.1747e-03 -6.0000e+00 1.3214e-02 2.4932e-04 2.9866e-04 4.4905e-03 -6.0000e+00 7.8556e-03 -1.4571e-03 1.2895e-04 1.2529e-03 -6.0000e+00 3.3068e-03 8.8628e-02 4.7680e-04 1.0520e-05 1.8735e-05 -6.0000e+00 2.4540e-04 1.1029e-02 0.0000e+00 12 9 1 12 5 1 99.08 22.79 0.23 0.01103 0.01461 218 312 1 5 0 30.600 26.11 19.99 22.79 26.23 37.0 1100.00 -1507 -2735 -2760 -1338 111 943 1155 1056 -483 47 958 1108 714 467 -428 -264 178 470 564 -16 928 1261 888 532 156 -677 -783 372 1382 1275 1522 1443 -789 -522 178 222 357 313 -782 -1433 -1122 -1211 -1172 -963 -879 -1170 -846 -705 438 676 631 854 697 511 550 782 312 647 863 1425 1159 1047 425 -708 -132 -41 345 1284 862 120 -260 -692 -456 -736 -239 265 556 1345 373 110 -705 -1398 -1195 -1062 -1093 -717 -494 -406 -609 -206 177 258 1191 1343 1245 851 767 -322 -494 -295 -425 39 763 110 -685 -230 -740 -170 -98 -162 -334 -307 -218 -156 463 728 750 660 17 -497 -356 -212 -239 245 253 538 1354 984 496 540 14 241 116 243 -222 -207 138 -434 -424 -274 -288 -324 -54 -563 -1064 -1096 -477 38 322 401 407 -189 18 370 448 320 221 -211 -136 94 253 296 -9 498 675 489 308 90 -395 -462 203 742 677 840 804 -466 -302 98 124 211 208 -563 -1116 -896 -1000 -983 -807 -732 -962 -700 -562 337 522 509 699 598 438 481 694 280 574 755 1248 1058 985 413 -718 -129 -38 308 1160 807 117 -264 -731 -477 -744 -240 248 489 1166 326 103 -709 -1436 -1299 -1177 -1252 -847 -596 -502 -752 -250 206 281 1257 1369 1323 924 887 -396 -618 -365 -509 45 864 126 -819 -281 -953 -220 -129 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