File name: Pandora69s1_NewBrunswickNJ_20210912_L2Fit_fout2c23d20210421p1-8.txt File generation date: 20250604T185840.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c23p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 69 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora69_OF_v2d20210223.txt Instrument calibration file used: Pandora69s1_CF_v23d20210421.txt Level 1 file used: Pandora69s1_NewBrunswickNJ_20210912_L1_smca1c23d20210421p1-8.txt Full location name: Rutgers NJDEP (USEPA AQS ID 34-023-0011) Short location name: NewBrunswickNJ Country of location: USA Location latitude [deg]: 40.4622 Location longitude [deg]: -74.4294 Location altitude [m]: 19 Local noon date: 20210912 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: based on s13, field cal for NewBrunswick, revisited HCHO First and last pixel inside fitting window: 259 400 Nominal wavelengths inside fitting window [nm]: 305.1248 305.2657 305.4066 305.5475 305.6883 305.8292 305.9700 306.1109 306.2517 306.3925 306.5333 306.6741 306.8148 306.9556 307.0963 307.2371 307.3778 307.5185 307.6592 307.7999 307.9406 308.0812 308.2219 308.3625 308.5032 308.6438 308.7844 308.9250 309.0656 309.2062 309.3467 309.4873 309.6278 309.7683 309.9089 310.0494 310.1898 310.3303 310.4708 310.6113 310.7517 310.8921 311.0326 311.1730 311.3134 311.4537 311.5941 311.7345 311.8748 312.0152 312.1555 312.2958 312.4361 312.5764 312.7167 312.8570 312.9972 313.1375 313.2777 313.4179 313.5581 313.6983 313.8385 313.9787 314.1189 314.2590 314.3991 314.5393 314.6794 314.8195 314.9596 315.0997 315.2397 315.3798 315.5198 315.6599 315.7999 315.9399 316.0799 316.2199 316.3598 316.4998 316.6397 316.7797 316.9196 317.0595 317.1994 317.3393 317.4792 317.6190 317.7589 317.8987 318.0386 318.1784 318.3182 318.4580 318.5978 318.7375 318.8773 319.0170 319.1568 319.2965 319.4362 319.5759 319.7156 319.8552 319.9949 320.1345 320.2742 320.4138 320.5534 320.6930 320.8326 320.9722 321.1117 321.2513 321.3908 321.5303 321.6698 321.8093 321.9488 322.0883 322.2278 322.3672 322.5067 322.6461 322.7855 322.9249 323.0643 323.2037 323.3430 323.4824 323.6217 323.7611 323.9004 324.0397 324.1790 324.3183 324.4575 324.5968 324.7360 324.8753 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20210912T120536.1Z 7925.503891 81 1 49.68 2 73.83 98.77 142.15 70.21 0.00 1 0.00 1 0 17 2.415e-01 9.214e-03 1.586e-01 6.152e-03 4.632523e-01 3.276706e-03 5.288766e-03 -6.000000e+00 1.429559e-01 229.51 -2.00 3.50 -2.00 320.32 0.00e+00 6.188146e-04 9.701830e-04 2.926626e-04 -6.000000e+00 5.684458e-03 288.44 -2.00 20.00 -2.00 320.00 0.00e+00 3.530 0.001 302.00 328.00 3 3.8742e+00 9.3410e-03 4.2876e-02 -6.0000e+00 3.5920e-01 8.8554e-03 1.1187e-02 2.4421e-02 -6.0000e+00 3.8992e-01 -4.4257e-02 1.0758e-02 1.2794e-02 -6.0000e+00 2.2806e-01 1.2104e-02 5.6840e-03 4.0097e-03 -6.0000e+00 9.5559e-02 1.9202e-04 1.4907e-04 1.9495e-04 4.7430e-05 -6.0000e+00 6.8591e-03 7.6070e-04 1.2102e-04 11 8 0 10 0 0 31.74 22.80 0.64 0.00076 0.00188 19 4 1 5 0 2614.170 25.90 20.01 22.80 26.16 12.1 989.68 6892 212972 -59177 61109 -78216 900000 -32419 -26197 -30750 -83733 1407 -50476 18366 -39553 25290 10299 20999 -7516 -9301 4638 -8259 11362 -21003 33935 -17115 7459 -13863 14838 7944 -19190 15341 -5723 5224 -7834 11270 -9653 -9391 -1904 -1975 1259 -4954 3507 1386 4057 -551 1190 -1666 2701 -460 -974 3920 -1825 5416 1761 3517 1776 1482 -1126 1724 3057 2484 5353 -1529 1181 19 1073 738 -96 794 -503 1514 -56 825 -534 1565 -923 649 -1863 -1170 -637 -650 -2011 -1633 -1488 -2366 1386 581 1576 -432 -942 2316 172 -262 -1283 660 47 1162 656 -349 164 -383 -820 -908 -77 -1556 -951 -1017 -424 834 -652 95 -240 128 -608 1349 -190 268 594 -523 -441 13 719 -40 1049 175 -70 703 1853 -162 244 412 -406 477 -341 -105 -523 636 -114 29 -358 -275 -244 71 1277 -1287 390 -1771 900000 -543 -467 -635 -3005 23 -1560 354 -1585 645 340 675 -341 -453 206 -419 487 -1311 1350 -1173 422 -953 736 415 -1411 919 -470 426 -728 834 -916 -1011 -227 -284 203 -918 630 263 758 -109 233 -337 530 -95 -216 911 -487 1451 522 1065 565 480 -370 541 957 827 1906 -644 516 8 442 302 -41 375 -270 856 -33 469 -291 764 -420 276 -836 -583 -363 -419 -1450 -1249 -1204 -2075 1240 545 1493 -412 -856 1898 135 -200 -1028 574 46 1279 796 -440 199 -438 -870 -936 -83 -1812 -1153 -1303 -573 1199 -1027 157 -402 208 -941 1938 -271 388 901 -848 -735 21 1153 -63 1566 254 -98 968 2670 -259 418 746 -769 929 -704 -229 -1179 1448 -266 66 -793 -587 -503 SS 20210912T121708.1Z 7925.511899 84 1 49.38 2 71.67 100.76 140.20 72.86 0.00 1 0.00 1 0 17 5.593e-02 6.047e-03 5.484e-02 3.753e-03 4.138501e-01 1.969806e-03 4.795243e-03 -6.000000e+00 3.287460e-02 229.51 -2.00 3.50 -2.00 319.88 0.00e+00 7.324753e-04 5.170605e-04 2.154964e-04 -6.000000e+00 1.304082e-03 288.44 -2.00 20.00 -2.00 319.57 0.00e+00 3.138 0.001 302.00 328.00 3 3.5788e+00 5.5081e-03 3.8150e-02 -6.0000e+00 8.2636e-02 -1.2003e-02 6.4041e-03 2.1680e-02 -6.0000e+00 8.9670e-02 -1.5370e-02 5.6251e-03 1.1132e-02 -6.0000e+00 5.2626e-02 -4.4414e-04 3.0063e-03 3.3980e-03 -6.0000e+00 2.2120e-02 3.9979e-04 2.4404e-04 1.1786e-04 3.9618e-05 -6.0000e+00 1.5816e-03 6.6862e-04 4.4393e-05 10 0 0 10 0 0 15.80 22.80 0.42 0.00067 0.00250 30 6 1 5 0 1645.520 25.90 19.97 22.80 26.61 12.1 992.49 -30054 -24646 -32099 -5381 -1912 -3341 -10094 1486 -24319 -4280 -13204 2573 -12940 -646 6133 -1685 -7870 1705 -7930 2816 -3984 -6736 -7599 -2486 -3347 5367 -3252 5088 737 1634 4143 -1075 965 -6620 1475 -3475 2787 -4631 -728 -690 -1556 -609 71 -704 -2016 992 -476 3627 1118 1338 331 162 -719 -233 1422 -222 1415 -890 1548 89 443 2598 970 1961 666 1314 -1092 1079 1875 132 616 814 242 -33 581 760 22 -22 -1142 -1444 -1457 -2048 -2046 -755 -1493 -409 88 633 654 815 1432 74 619 671 15 576 807 302 -105 -182 -823 -859 258 -425 -1559 -105 -789 -697 -89 426 -117 168 -72 142 0 37 386 244 68 -523 -476 169 -20 426 389 -55 1186 676 184 495 104 -95 70 376 20 -59 123 -482 -119 -161 371 -675 -696 -590 -835 -101 -32 -59 -211 31 -719 -109 -379 71 -493 -26 269 -89 -469 99 -532 178 -271 -477 -580 -193 -276 423 -276 377 56 132 366 -111 107 -788 155 -403 346 -731 -133 -145 -355 -145 17 -174 -510 246 -119 878 283 357 97 51 -246 -85 525 -86 545 -346 581 34 180 1128 471 995 335 625 -521 520 996 80 397 535 156 -20 325 387 11 -11 -635 -917 -1041 -1612 -1708 -659 -1405 -403 89 654 668 789 1282 63 502 563 14 594 928 380 -136 -228 -977 -947 274 -479 -1890 -131 -1046 -975 -132 674 -196 281 -117 217 0 53 557 369 109 -868 -786 273 -31 641 564 -76 1627 980 289 828 184 -173 132 743 42 -127 268 -1076 -261 -343 760 -1356 SS 20210912T122443.9Z 7925.517174 88 1 49.91 2 70.26 102.09 138.89 74.52 0.00 1 0.00 1 0 17 5.735e-02 6.258e-03 2.824e-02 2.530e-03 3.870993e-01 1.319779e-03 4.528881e-03 -6.000000e+00 3.371426e-02 229.51 -2.00 3.50 -2.00 319.56 0.00e+00 5.467576e-04 3.157974e-04 1.760364e-04 -6.000000e+00 1.337320e-03 288.44 -2.00 20.00 -2.00 319.25 0.00e+00 2.927 0.000 302.00 328.00 3 3.2355e+00 3.6489e-03 3.5605e-02 -6.0000e+00 8.4748e-02 -1.3980e-02 4.1835e-03 2.0226e-02 -6.0000e+00 9.1957e-02 -1.2085e-02 3.4380e-03 1.0282e-02 -6.0000e+00 5.3967e-02 -1.7137e-03 1.8430e-03 3.0923e-03 -6.0000e+00 2.2686e-02 7.1459e-04 3.7554e-04 7.9020e-05 3.5962e-05 -6.0000e+00 1.6217e-03 8.9674e-04 9.6541e-05 10 0 0 10 0 0 25.52 22.80 0.46 0.00090 0.00372 45 9 1 5 0 1108.820 25.90 20.01 22.80 26.93 12.2 994.95 -18802 2430 -31517 1132 -36890 -7785 -20322 -4689 -8726 -8688 -1859 -18523 1531 -9216 10310 -10276 3075 -5317 745 -2609 -2816 417 -6008 8267 -6386 4846 -4940 3768 -3410 1632 -1431 -1412 -2 -4545 4728 -3018 -919 -3600 333 -1465 -1550 -409 -2026 1480 -558 1167 -1452 341 -888 2643 1979 -658 2703 519 1866 13 1820 -569 711 1042 1880 1271 984 1928 -477 1716 -285 1741 699 68 580 -303 105 -373 1035 -396 101 -663 -336 -1336 -1089 -1623 -1895 -495 -1278 -99 -235 492 281 904 810 274 649 247 547 222 847 116 -550 -471 -271 -253 29 -231 -1284 -697 -940 -358 144 92 -287 -231 276 0 529 376 447 25 -43 -860 -327 36 -63 587 459 513 1130 1104 654 290 153 -17 202 94 -77 -247 512 -301 -337 -441 -51 -332 -525 60 -1089 26 -1152 -190 -615 -137 -293 -304 -62 -812 65 -512 551 -738 207 -413 57 -216 -235 34 -559 716 -671 474 -524 347 -328 160 -160 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