File name: Pandora84s1_Rotterdam-Haven_20240801_L2Fit_fout2c2d20240321p1-8.txt File generation date: 20250426T150709.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Alexander Cede Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 84 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora84_OF_v3d20231130.txt Instrument calibration file used: Pandora84s1_CF_v2d20240321.txt Level 1 file used: Pandora84s1_Rotterdam-Haven_20240801_L1_smca1c2d20240321p1-8.txt Full location name: De Slufter Visitor Centre Short location name: Rotterdam-Haven Country of location: Netherlands Location latitude [deg]: 51.9335 Location longitude [deg]: 3.9998 Location altitude [m]: 0 Local noon date: 20240801 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: OoB session based on session 1 lab analysis First and last pixel inside fitting window: 197 339 Nominal wavelengths inside fitting window [nm]: 305.0841 305.2250 305.3659 305.5068 305.6477 305.7886 305.9294 306.0703 306.2111 306.3519 306.4928 306.6336 306.7744 306.9151 307.0559 307.1967 307.3374 307.4782 307.6189 307.7596 307.9003 308.0410 308.1817 308.3224 308.4631 308.6037 308.7444 308.8850 309.0256 309.1662 309.3068 309.4474 309.5880 309.7286 309.8691 310.0097 310.1502 310.2907 310.4312 310.5717 310.7122 310.8527 310.9932 311.1336 311.2741 311.4145 311.5549 311.6953 311.8357 311.9761 312.1165 312.2569 312.3972 312.5376 312.6779 312.8182 312.9585 313.0988 313.2391 313.3794 313.5197 313.6599 313.8002 313.9404 314.0806 314.2208 314.3610 314.5012 314.6414 314.7816 314.9217 315.0619 315.2020 315.3421 315.4822 315.6223 315.7624 315.9025 316.0426 316.1826 316.3227 316.4627 316.6027 316.7427 316.8827 317.0227 317.1627 317.3027 317.4426 317.5826 317.7225 317.8624 318.0023 318.1422 318.2821 318.4220 318.5618 318.7017 318.8415 318.9814 319.1212 319.2610 319.4008 319.5406 319.6803 319.8201 319.9599 320.0996 320.2393 320.3790 320.5187 320.6584 320.7981 320.9378 321.0774 321.2171 321.3567 321.4964 321.6360 321.7756 321.9152 322.0548 322.1943 322.3339 322.4734 322.6130 322.7525 322.8920 323.0315 323.1710 323.3105 323.4499 323.5894 323.7288 323.8683 324.0077 324.1471 324.2865 324.4259 324.5653 324.7046 324.8440 324.9833 --------------------------------------------------------------------------------------- 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 20240801T103127.3Z 8979.438510 306 1 53.74 2 37.48 148.13 27.46 216.58 0.00 1 0.00 1 0 17 9.185e-03 7.001e-03 1.217e-03 8.256e-04 1.849420e-01 4.328240e-04 2.412142e-03 -6.000000e+00 5.403675e-03 233.15 -2.00 3.84 -2.00 315.06 0.00e+00 4.824201e-04 3.715212e-05 2.535684e-05 -6.000000e+00 2.354017e-04 283.46 -2.00 20.00 -2.00 314.44 0.00e+00 1.259 0.000 302.00 328.00 3 4.4464e+00 1.1232e-03 1.6567e-02 -6.0000e+00 1.3594e-02 -1.1855e-03 1.2456e-03 1.0526e-02 -6.0000e+00 1.4714e-02 2.6493e-03 7.0866e-04 5.0800e-03 -6.0000e+00 8.7322e-03 -4.6704e-03 3.0586e-04 1.4012e-03 -6.0000e+00 3.6307e-03 1.4570e-03 1.9818e-04 2.4034e-05 1.8602e-05 -6.0000e+00 2.5915e-04 -3.7375e-03 6.5236e-05 11 8 0 10 0 0 99.31 25.78 0.35 -0.00374 -0.00225 47 5 1 5 0 1143.250 33.75 20.01 25.78 30.80 1.1 1016.50 887 734 -437 -3327 -2280 -2348 158 949 1057 -891 -1515 -1213 -965 127 24 -33 331 335 884 1567 506 636 1255 807 861 593 262 -491 143 712 1817 1735 1239 -1454 -2976 -2309 -1736 -957 -432 -806 -885 -415 -755 -489 -104 -136 -476 -654 -699 50 825 542 883 850 775 855 507 522 153 359 850 1514 1580 1311 233 -511 -753 -262 877 371 655 575 720 535 18 -264 -854 -1024 -597 -1047 -1322 -1786 -2139 -1476 -927 -417 69 432 725 543 371 -12 -324 126 137 -90 755 722 226 -265 -800 -765 -304 -345 -1007 -1091 -907 -568 243 698 696 608 334 -19 -206 -51 -77 151 391 -66 65 134 369 593 670 101 387 855 367 323 -6 -317 -32 129 147 -85 193 240 -31 -65 -364 -679 -787 283 250 -151 -1087 -711 -706 49 299 365 -324 -543 -442 -358 52 11 -15 156 161 437 791 261 325 650 411 456 323 141 -265 71 345 906 917 655 -791 -1640 -1256 -966 -579 -292 -594 -703 -323 -604 -391 -82 -107 -384 -510 -529 38 644 426 726 729 681 726 437 446 136 319 741 1406 1501 1302 228 -481 -656 -233 785 357 652 594 740 554 17 -240 -743 -895 -517 -966 -1297 -1837 -2337 -1613 -1081 -497 83 530 885 661 433 -13 -345 130 142 -103 902 906 285 -327 -967 -894 -342 -407 -1242 -1364 -1183 -741 330 956 989 859 467 -25 -264 -61 -93 192 514 -90 90 183 490 778 867 124 475 1054 462 413 -8 -432 -42 178 207 -126 283 359 -46 -95 -538 -975 -1118 SS 20240801T104109.7Z 8979.445251 309 1 54.43 2 36.74 151.75 28.38 220.58 0.00 1 0.00 1 0 17 8.984e-03 6.993e-03 8.658e-04 6.087e-04 1.828972e-01 3.201327e-04 2.383813e-03 -6.000000e+00 5.286024e-03 233.15 -2.00 3.84 -2.00 314.89 0.00e+00 4.943533e-04 2.653679e-05 2.009242e-05 -6.000000e+00 2.302689e-04 283.46 -2.00 20.00 -2.00 314.27 0.00e+00 1.247 0.000 302.00 328.00 3 3.8935e+00 8.2924e-04 1.6392e-02 -6.0000e+00 1.3298e-02 1.0402e-03 9.1818e-04 1.0407e-02 -6.0000e+00 1.4393e-02 3.4709e-04 5.2316e-04 5.0220e-03 -6.0000e+00 8.5417e-03 -4.0500e-03 2.2460e-04 1.3907e-03 -6.0000e+00 3.5520e-03 2.5744e-03 2.6612e-04 1.7711e-05 1.8431e-05 -6.0000e+00 2.5347e-04 -4.4254e-03 6.9773e-05 11 8 0 10 0 0 99.92 25.83 0.30 -0.00443 -0.00243 86 9 1 5 0 632.760 33.75 20.00 25.83 31.38 1.1 1022.25 252 437 28 -2668 -2333 -1884 121 1172 706 -1109 -2073 -1147 -837 348 341 116 436 423 1274 1072 510 539 1362 958 814 718 307 -473 74 1036 1608 1647 1297 -1353 -2952 -2238 -1967 -1031 -454 -725 -793 -360 -737 -526 -249 -139 -643 -535 -907 -37 568 572 844 780 571 916 618 358 209 408 863 1451 1767 1391 209 -441 -815 -117 802 548 592 423 616 690 99 -377 -774 -1158 -732 -1157 -1330 -1800 -2119 -1450 -892 -374 90 530 617 665 423 -101 -206 195 50 126 737 766 183 -207 -615 -739 -307 -349 -962 -1027 -836 -612 183 636 681 559 192 -8 -213 -40 -82 206 316 -6 41 171 313 571 602 43 399 917 449 318 -90 -325 -31 79 82 -30 251 274 -19 -25 -450 -706 -670 87 160 10 -925 -772 -597 40 393 260 -430 -795 -444 -331 152 156 57 219 218 631 547 264 277 708 522 462 395 177 -256 39 533 855 872 730 -784 -1625 -1215 -1168 -667 -312 -546 -615 -288 -605 -432 -203 -112 -506 -425 -702 -28 453 461 711 656 492 798 546 315 182 354 774 1326 1728 1365 202 -408 -729 -102 736 541 609 435 629 705 98 -352 -687 -981 -646 -1093 -1340 -1908 -2292 -1576 -1035 -445 109 652 757 808 492 -111 -216 198 53 142 875 926 232 -256 -741 -858 -343 -409 -1183 -1286 -1093 -804 241 879 946 772 262 -10 -262 -48 -99 261 417 -8 55 234 418 751 750 53 486 1121 562 406 -120 -429 -41 110 116 -44 371 402 -28 -38 -649 -1022 -959 SS 20240801T105106.0Z 8979.452152 312 1 37.30 2 36.06 155.57 29.39 224.46 0.00 1 0.00 1 0 17 8.595e-03 6.676e-03 9.677e-04 6.891e-04 1.811421e-01 3.624348e-04 2.360748e-03 -6.000000e+00 5.056404e-03 233.15 -2.00 3.84 -2.00 314.81 0.00e+00 5.370385e-04 2.961061e-05 1.961372e-05 -6.000000e+00 2.202780e-04 283.46 -2.00 20.00 -2.00 314.19 0.00e+00 1.236 0.000 302.00 328.00 3 3.7650e+00 9.3819e-04 1.6242e-02 -6.0000e+00 1.2720e-02 4.8075e-03 1.0389e-03 1.0310e-02 -6.0000e+00 1.3769e-02 -4.4014e-04 5.9222e-04 4.9731e-03 -6.0000e+00 8.1711e-03 -3.8351e-03 2.5375e-04 1.3837e-03 -6.0000e+00 3.3973e-03 2.9651e-03 1.1452e-04 2.0100e-05 1.8662e-05 -6.0000e+00 2.4250e-04 -3.3237e-03 7.0681e-05 12 9 1 12 1 1 95.58 25.90 0.35 -0.00332 -0.00246 56 9 1 5 0 654.230 33.75 20.01 25.90 32.47 1.1 1030.71 466 38 -192 -2905 -2407 -1664 327 985 809 -848 -1225 -909 -530 -76 598 -133 260 344 1248 1281 718 787 1263 921 998 543 -4 -475 -217 848 1432 1789 1160 -1341 -2743 -2044 -1831 -927 -674 -867 -1020 -514 -771 -465 -18 -320 -584 -717 -672 -22 532 622 902 682 596 1005 386 451 157 652 1058 1385 1740 1153 -91 -425 -704 166 1008 667 489 419 534 578 51 -270 -612 -769 -470 -1105 -1210 -1808 -2093 -1449 -832 -573 55 299 541 513 395 -107 -58 299 266 7 720 731 60 -261 -605 -684 -170 -341 -1009 -923 -826 -544 148 438 475 501 162 51 -70 167 66 244 398 -109 -55 212 380 484 506 187 472 896 369 375 -27 -304 -44 81 1 -127 167 221 -38 -31 -410 -640 -579 162 14 -72 -1024 -804 -531 108 359 301 -332 -470 -354 -226 -34 277 -67 133 180 630 665 379 411 669 511 575 306 -2 -261 -117 442 772 959 663 -788 -1528 -1122 -1101 -578 -474 -669 -812 -421 -622 -375 -15 -265 -471 -558 -530 -17 414 512 743 588 525 895 350 406 139 577 929 1298 1675 1121 -91 -402 -642 147 904 647 496 442 559 582 50 -247 -552 -661 -421 -1019 -1194 -1885 -2234 -1614 -954 -678 65 367 660 618 453 -116 -60 308 278 8 844 905 76 -320 -720 -783 -194 -394 -1228 -1145 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